data_1soy_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 1soy _Structure_validation_residue.Date_analyzed 2016-10-07 loop_ _Residue_analysis_software.Software_ID _Residue_analysis_software.Software_label _Residue_analysis_software.Method_ID _Residue_analysis_software.Method_label _Residue_analysis_software.Entry_ID _Residue_analysis_software.Structure_validation_oneline_list_ID 1 MolProbity . . ? 1 2 CYRANGE . . ? 1 stop_ loop_ _Residue_analysis.ID _Residue_analysis.PDB_model_num _Residue_analysis.Hydrogen_positions _Residue_analysis.MolProbity_flips _Residue_analysis.Cyrange_core_flag _Residue_analysis.Two_letter_chain_ID _Residue_analysis.PDB_strand_ID _Residue_analysis.PDB_residue_no _Residue_analysis.PDB_ins_code _Residue_analysis.PDB_residue_name _Residue_analysis.Assembly_ID _Residue_analysis.Entity_assembly_ID _Residue_analysis.Entity_ID _Residue_analysis.Comp_ID _Residue_analysis.Comp_index_ID _Residue_analysis.Clash_value _Residue_analysis.Clash_source_PDB_atom_name _Residue_analysis.Clash_destination_PDB_atom_name _Residue_analysis.Clash_destination_PDB_strand_ID _Residue_analysis.Clash_destination_PDB_residue_no _Residue_analysis.Clash_destination_PDB_ins_code _Residue_analysis.Clash_destination_PDB_residue_name _Residue_analysis.Cbeta_deviation_value _Residue_analysis.Rotamer_score _Residue_analysis.Rotamer_name _Residue_analysis.Ramachandran_phi _Residue_analysis.Ramachandran_psi _Residue_analysis.Ramachandran_score _Residue_analysis.Ramachandran_evaluation _Residue_analysis.Ramachandran_type _Residue_analysis.Bond_outlier_count _Residue_analysis.Worst_bond _Residue_analysis.Worst_bond_value _Residue_analysis.Worst_bond_sigma _Residue_analysis.Angle_outlier_count _Residue_analysis.Worst_angle _Residue_analysis.Worst_angle_value _Residue_analysis.Worst_angle_sigma _Residue_analysis.RNA_phosphate_perpendicular_outlier _Residue_analysis.RNA_suitness_score _Residue_analysis.RNA_suite_conformer _Residue_analysis.RNA_suite_triage _Residue_analysis.Max_b_factor _Residue_analysis.Tau_angle _Residue_analysis.Omega_dihedral _Residue_analysis.Disulfide_chi1 _Residue_analysis.Disulfide_chi2 _Residue_analysis.Disulfide_chi3 _Residue_analysis.Disulfide_ss_angle _Residue_analysis.Disulfide_ss _Residue_analysis.Disulfide_ss_angle_prime _Residue_analysis.Disulfide_chi2prime _Residue_analysis.Disulfide_chi1prime _Residue_analysis.Outlier_count_separate_geometry _Residue_analysis.Outlier_count _Residue_analysis.Entry_ID _Residue_analysis.Structure_validation_residue_list_ID . 001 nuclear orig core ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 7.1 p30 . . . . . 0 N--CA 1.43 -1.458 0 N-CA-C 113.842 1.053 . . . . 1.0 113.842 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 35.3 t70 -55.92 -40.08 72.59 Favored 'General case' 0 N--CA 1.429 -1.479 0 C-N-CA 127.125 2.17 . . . . 1.0 113.46 -178.543 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 5.2 p -68.49 -37.94 80.55 Favored 'General case' 0 N--CA 1.43 -1.467 0 C-N-CA 126.274 1.83 . . . . 1.0 114.359 174.972 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 14.2 tp10 -67.74 -53.06 30.44 Favored 'General case' 0 N--CA 1.43 -1.435 0 C-N-CA 125.226 1.41 . . . . 1.0 110.115 177.925 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 16.3 t80 -47.25 -50.94 20.17 Favored 'General case' 0 N--CA 1.431 -1.425 0 C-N-CA 127.425 2.29 . . . . 1.0 114.821 169.657 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 35.2 m-70 -63.97 -41.43 97.56 Favored 'General case' 0 N--CA 1.43 -1.452 0 N-CA-C 114.907 1.447 . . . . 1.0 114.907 177.989 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -70.76 -37.19 73.38 Favored 'General case' 0 N--CA 1.43 -1.435 0 O-C-N 120.366 -1.459 . . . . 1.0 114.074 178.887 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 79.7 mt -59.58 -51.55 69.37 Favored 'General case' 0 N--CA 1.43 -1.444 0 C-N-CA 124.99 1.316 . . . . 1.0 111.747 168.239 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -54.06 -50.34 66.95 Favored 'General case' 0 N--CA 1.431 -1.416 0 C-N-CA 125.011 1.324 . . . . 1.0 113.458 176.991 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -51.58 -49.71 61.57 Favored 'General case' 0 N--CA 1.43 -1.425 0 N-CA-C 114.783 1.401 . . . . 1.0 114.783 173.136 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 12.2 pt20 -68.9 -33.27 73.49 Favored 'General case' 0 N--CA 1.43 -1.433 0 N-CA-C 115.583 1.697 . . . . 1.0 115.583 179.764 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 84.8 mt -66.74 -59.07 3.89 Favored 'General case' 0 N--CA 1.431 -1.419 0 O-C-N 120.087 -1.633 . . . . 1.0 111.02 174.753 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 1.2 m-90 -50.3 -50.11 51.58 Favored 'General case' 0 N--CA 1.429 -1.487 0 C-N-CA 125.65 1.58 . . . . 1.0 113.27 -179.565 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 41.0 tp -61.85 -59.05 5.71 Favored 'General case' 0 N--CA 1.43 -1.447 0 N-CA-C 113.626 0.973 . . . . 1.0 113.626 175.775 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 59.6 m -64.88 -37.42 87.58 Favored 'General case' 0 N--CA 1.431 -1.4 0 N-CA-C 114.252 1.204 . . . . 1.0 114.252 -173.621 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 93.5 mt -64.63 -54.24 32.7 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.458 0 C-N-CA 124.923 1.289 . . . . 1.0 111.686 174.83 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 1.7 tt0 -55.48 -49.66 71.94 Favored 'General case' 0 N--CA 1.43 -1.473 0 C-N-CA 123.984 0.914 . . . . 1.0 113.386 178.565 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 44.4 tt0 -54.65 -49.1 71.38 Favored 'General case' 0 N--CA 1.429 -1.493 0 C-N-CA 125.966 1.706 . . . . 1.0 114.025 174.173 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 7.4 tpm_? -58.95 -45.92 89.29 Favored 'General case' 0 N--CA 1.431 -1.406 0 O-C-N 120.726 -1.234 . . . . 1.0 114.291 179.818 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 3.8 pp -83.51 -26.97 29.71 Favored 'General case' 0 N--CA 1.431 -1.384 0 N-CA-C 115.097 1.517 . . . . 1.0 115.097 -177.387 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 8.7 t70 -62.71 -34.09 76.44 Favored 'General case' 0 CA--C 1.488 -1.405 0 O-C-N 120.336 -1.478 . . . . 1.0 113.342 163.591 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 19.2 t70 -70.59 -55.08 9.65 Favored 'General case' 0 N--CA 1.43 -1.472 0 C-N-CA 126.201 1.8 . . . . 1.0 114.559 178.405 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 24' ' ' TRP . . . . . . . . . . . . . 32.4 t-105 -73.03 138.68 46.11 Favored 'General case' 0 N--CA 1.43 -1.456 0 O-C-N 120.703 -1.248 . . . . 1.0 113.104 -172.643 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 63.3 m-20 -84.16 -141.33 0.07 Allowed 'General case' 0 N--CA 1.431 -1.408 0 O-C-N 120.327 -1.483 . . . . 1.0 112.054 177.519 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 164.3 -164.8 36.9 Favored Glycine 0 N--CA 1.431 -1.664 0 O-C-N 118.592 -2.568 . . . . 1.0 114.181 -175.221 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 37.4 t70 -86.84 -53.43 4.92 Favored 'General case' 0 N--CA 1.43 -1.463 0 C-N-CA 125.238 1.415 . . . . 1.0 107.911 169.242 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 4.5 t -82.7 -176.48 6.3 Favored 'General case' 0 N--CA 1.431 -1.414 0 C-N-CA 125.728 1.611 . . . . 1.0 109.691 178.94 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 32.9 t0 -99.85 178.63 4.76 Favored 'General case' 0 N--CA 1.43 -1.449 0 O-C-N 120.26 -1.525 . . . . 1.0 108.142 175.218 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 9.3 tp -152.26 126.58 1.41 Allowed 'Isoleucine or valine' 0 N--CA 1.43 -1.431 0 N-CA-C 106.936 -1.505 . . . . 1.0 106.936 -173.974 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 28.4 t70 -131.73 119.07 20.82 Favored 'General case' 0 N--CA 1.43 -1.439 0 CA-C-O 122.956 1.36 . . . . 1.0 109.13 163.299 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 17.3 p -86.21 131.17 34.3 Favored 'General case' 0 N--CA 1.43 -1.445 0 O-C-N 120.088 -1.632 . . . . 1.0 111.228 174.349 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 41.0 mm-40 -100.06 137.5 38.42 Favored 'General case' 0 N--CA 1.429 -1.488 0 C-N-CA 124.708 1.203 . . . . 1.0 108.916 174.651 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 3.5 tp -127.42 114.1 34.79 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.407 0 CA-C-O 124.046 1.879 . . . . 1.0 106.245 178.81 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 35' ' ' ASN . . . . . 0.419 ' HB3' ' HB ' ' A' ' 38' ' ' VAL . 1.6 t-20 -125.81 179.98 4.93 Favored 'General case' 0 N--CA 1.43 -1.427 0 C-N-CA 124.805 1.242 . . . . 1.0 107.828 176.663 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -71.36 87.36 0.41 Allowed Glycine 0 N--CA 1.431 -1.653 0 O-C-N 120.566 -1.334 . . . . 1.0 115.898 -168.657 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 82.2 23.57 56.67 Favored Glycine 0 N--CA 1.429 -1.792 0 C-N-CA 125.379 1.466 . . . . 1.0 112.526 -171.889 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . 0.419 ' HB ' ' HB3' ' A' ' 35' ' ' ASN . 61.8 t -138.84 135.05 42.92 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.475 0 CA-C-N 118.307 1.053 . . . . 1.0 109.109 -173.253 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 31.1 mt -118.07 142.01 47.86 Favored 'General case' 0 N--CA 1.43 -1.427 0 CA-C-O 122.919 1.343 . . . . 1.0 108.799 166.273 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -138.49 111.3 7.71 Favored 'General case' 0 N--CA 1.43 -1.426 0 O-C-N 120.422 -1.424 . . . . 1.0 108.436 178.032 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 70.3 mt -96.83 105.41 17.07 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.467 0 N-CA-C 107.362 -1.347 . . . . 1.0 107.362 -165.859 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 14.0 m -118.44 131.2 56.28 Favored 'General case' 0 N--CA 1.43 -1.457 0 CA-C-N 118.896 0.771 . . . . 1.0 112.994 -163.053 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 43' ' ' PHE . . . . . . . . . . . . . 1.4 m-85 -99.56 173.68 6.61 Favored 'General case' 0 N--CA 1.43 -1.431 0 O-C-N 120.608 -1.308 . . . . 1.0 111.193 -179.381 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -71.77 -19.03 62.08 Favored 'General case' 0 N--CA 1.429 -1.481 0 O-C-N 119.219 -2.175 . . . . 1.0 113.476 -179.466 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 29.0 t-20 -67.21 -17.97 65.05 Favored 'General case' 0 N--CA 1.429 -1.502 0 C-N-CA 126.811 2.044 . . . . 1.0 113.512 170.731 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 92.34 -14.9 63.5 Favored Glycine 0 N--CA 1.43 -1.74 0 O-C-N 119.962 -1.712 . . . . 1.0 113.683 179.666 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 13.8 m -77.8 167.86 20.86 Favored 'General case' 0 N--CA 1.431 -1.425 0 O-C-N 121.082 -1.246 . . . . 1.0 111.077 172.943 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 12.9 ptpt -169.93 157.68 6.82 Favored 'General case' 0 N--CA 1.43 -1.439 0 O-C-N 121.156 -0.965 . . . . 1.0 113.07 -162.668 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 5.3 mm -101.54 137.11 30.39 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.438 0 C-N-CA 125.791 1.636 . . . . 1.0 107.389 171.823 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 16.1 mm -111.17 116.85 53.61 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.437 0 C-N-CA 125.032 1.333 . . . . 1.0 109.382 -178.013 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 3.0 mt -125.43 124.76 67.68 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.506 0 O-C-N 120.717 -1.239 . . . . 1.0 110.695 179.297 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 52' ' ' ASN . . . . . 0.413 ' H ' ' HD1' ' A' ' 61' ' ' TRP . 26.6 t30 -162.52 172.93 14.7 Favored 'General case' 0 N--CA 1.43 -1.471 0 N-CA-C 103.142 -2.91 . . . . 1.0 103.142 -172.815 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 1.9 ptm180 -139.76 150.57 44.93 Favored 'General case' 0 N--CA 1.429 -1.524 0 CA-C-O 122.546 1.165 . . . . 1.0 112.337 -158.913 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 15.8 mm-40 -107.16 -108.42 0.31 Allowed 'General case' 0 N--CA 1.43 -1.448 0 C-N-CA 124.653 1.181 . . . . 1.0 109.562 -167.173 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 33.2 mm-40 -79.23 135.75 57.6 Favored Pre-proline 0 N--CA 1.43 -1.446 0 CA-C-O 117.718 -1.134 . . . . 1.0 112.799 -172.041 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 98.5 Cg_endo -73.45 62.69 4.46 Favored 'Trans proline' 0 N--CA 1.434 -1.999 0 C-N-CA 123.277 2.651 . . . . 1.0 112.319 162.997 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 57' ' ' LEU . . . . . 0.404 ' O ' ' HD2' ' A' ' 58' ' ' HIS . 73.1 mt -120.32 -103.0 0.41 Allowed 'General case' 0 N--CA 1.429 -1.493 0 N-CA-C 102.841 -3.022 . . . . 1.0 102.841 164.483 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 58' ' ' HIS . . . . . 0.404 ' HD2' ' O ' ' A' ' 57' ' ' LEU . 42.0 m170 -132.47 92.02 3.01 Favored 'General case' 0 N--CA 1.429 -1.489 0 N-CA-C 106.622 -1.622 . . . . 1.0 106.622 159.412 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 22.1 tt0 -158.68 122.05 3.84 Favored 'General case' 0 N--CA 1.429 -1.516 0 CA-C-N 121.687 2.04 . . . . 1.0 114.161 173.005 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 86.4 t -133.36 157.57 42.63 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.451 0 C-N-CA 127.031 2.132 . . . . 1.0 109.437 -179.013 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 61' ' ' TRP . . . . . 0.413 ' HD1' ' H ' ' A' ' 52' ' ' ASN . 0.0 OUTLIER -111.36 156.06 22.16 Favored 'General case' 0 N--CA 1.429 -1.505 0 C-N-CA 127.867 2.467 . . . . 1.0 109.755 -174.169 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . 0.277 2.3 pt? -150.91 134.01 16.03 Favored 'General case' 0 N--CA 1.432 -1.364 0 CA-C-N 120.686 1.584 . . . . 1.0 113.916 150.939 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -120.08 147.29 45.03 Favored 'General case' 0 N--CA 1.429 -1.514 0 C-N-CA 125.367 1.467 . . . . 1.0 114.429 -179.557 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 64' ' ' THR . . . . . . . . . . . . . 12.5 t -153.96 -149.52 0.29 Allowed 'General case' 0 N--CA 1.429 -1.509 0 C-N-CA 126.745 2.018 . . . . 1.0 112.388 -172.694 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 5.6 tmtm? -63.56 -53.57 49.64 Favored 'General case' 0 N--CA 1.43 -1.456 0 C-N-CA 130.116 3.366 . . . . 1.0 114.362 -174.404 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 31.3 tt0 -82.24 2.19 33.02 Favored 'General case' 0 N--CA 1.429 -1.492 0 CA-C-O 122.581 1.181 . . . . 1.0 111.602 -177.008 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 117.5 -72.92 0.29 Allowed Glycine 0 N--CA 1.43 -1.732 0 N-CA-C 107.343 -2.303 . . . . 1.0 107.343 -177.4 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 106.06 -173.43 19.85 Favored Glycine 0 N--CA 1.43 -1.733 0 C-N-CA 124.229 0.918 . . . . 1.0 112.486 -176.382 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -162.05 169.83 20.29 Favored 'General case' 0 N--CA 1.431 -1.423 0 N-CA-C 107.284 -1.376 . . . . 1.0 107.284 -173.008 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 19.8 p80 -79.87 159.9 26.25 Favored 'General case' 0 N--CA 1.431 -1.422 0 O-C-N 119.775 -1.828 . . . . 1.0 114.653 174.504 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 71' ' ' PHE . . . . . . . . . . . . 0.3 72.3 t80 -112.21 113.77 26.2 Favored 'General case' 0 N--CA 1.431 -1.402 0 C-N-CA 127.744 2.418 . . . . 1.0 107.019 -158.565 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 5.7 m-20 -134.12 155.1 50.66 Favored 'General case' 0 N--CA 1.43 -1.459 0 CA-C-O 121.851 0.834 . . . . 1.0 110.546 -173.99 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 8.0 tt -97.37 133.53 41.84 Favored 'General case' 0 N--CA 1.431 -1.42 0 O-C-N 119.68 -1.888 . . . . 1.0 111.869 -166.677 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 53.5 tttm -101.81 -56.39 2.29 Favored 'General case' 0 N--CA 1.43 -1.471 0 O-C-N 120.823 -1.173 . . . . 1.0 109.556 174.539 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -157.03 -96.91 0.12 Allowed Glycine 0 N--CA 1.431 -1.677 0 O-C-N 121.035 -1.041 . . . . 1.0 111.346 175.863 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 27.9 m-20 -89.72 16.31 8.17 Favored 'General case' 0 N--CA 1.429 -1.479 0 O-C-N 121.047 -1.266 . . . . 1.0 111.405 179.94 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 32.9 tt0 -166.02 132.83 2.66 Favored 'General case' 0 N--CA 1.43 -1.427 0 N-CA-C 102.046 -3.316 . . . . 1.0 102.046 -161.484 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 78' ' ' TRP . . . . . . . . . . . . . 50.2 m95 -87.75 144.88 26.39 Favored 'General case' 0 N--CA 1.432 -1.37 0 N-CA-C 106.322 -1.732 . . . . 1.0 106.322 175.186 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 9.4 pt -102.35 167.54 2.33 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.485 0 N-CA-C 106.618 -1.623 . . . . 1.0 106.618 174.083 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 1.4 m -89.79 135.65 33.5 Favored 'General case' 0 N--CA 1.429 -1.484 0 O-C-N 120.195 -1.565 . . . . 1.0 107.193 155.29 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 36.8 t70 -59.94 -38.87 83.66 Favored 'General case' 0 N--CA 1.43 -1.447 0 CA-C-N 120.689 1.586 . . . . 1.0 115.069 -174.238 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -9.85 -84.34 0.0 OUTLIER 'General case' 0 N--CA 1.43 -1.467 0 C-N-CA 131.628 3.971 . . . . 1.0 118.457 176.634 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 58.8 m -111.19 -12.79 14.09 Favored 'General case' 0 CA--C 1.489 -1.371 0 O-C-N 120.485 -1.384 . . . . 1.0 109.588 158.126 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 115.85 76.41 0.63 Allowed Glycine 0 N--CA 1.43 -1.763 0 N-CA-C 108.041 -2.023 . . . . 1.0 108.041 -173.509 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 5.2 mm-40 -100.74 -136.4 0.31 Allowed 'General case' 0 N--CA 1.431 -1.419 0 N-CA-C 109.141 -0.688 . . . . 1.0 109.141 -175.583 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 95.5 m -154.2 133.95 12.94 Favored 'General case' 0 N--CA 1.43 -1.445 0 O-C-N 120.156 -1.59 . . . . 1.0 110.402 -171.317 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 1.1 t80 -38.02 -92.13 0.0 OUTLIER 'General case' 0 CA--C 1.489 -1.375 0 C-N-CA 128.432 2.693 . . . . 1.0 115.842 168.895 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 88' ' ' TRP . . . . . . . . . . . . . 50.7 m95 -63.16 -32.69 74.14 Favored 'General case' 0 N--CA 1.431 -1.419 0 C-N-CA 125.649 1.58 . . . . 1.0 113.454 -167.195 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 35.7 t70 -77.96 -42.94 31.24 Favored 'General case' 0 N--CA 1.43 -1.456 0 C-N-CA 125.088 1.355 . . . . 1.0 113.027 -175.898 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 35.0 tp -75.3 -38.9 60.08 Favored 'General case' 0 N--CA 1.43 -1.46 0 O-C-N 119.427 -2.045 . . . . 1.0 111.332 179.335 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 41.9 tp -54.78 -38.64 67.51 Favored 'General case' 0 N--CA 1.43 -1.427 0 C-N-CA 126.33 1.852 . . . . 1.0 113.626 168.106 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 3.4 tm-20 -56.85 -59.9 4.35 Favored 'General case' 0 N--CA 1.429 -1.506 0 C-N-CA 124.611 1.164 . . . . 1.0 112.043 165.875 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 35.9 mt-30 -51.92 -41.81 62.29 Favored 'General case' 0 N--CA 1.43 -1.425 0 N-CA-C 116.28 1.956 . . . . 1.0 116.28 177.394 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -59.19 -58.39 8.84 Favored 'General case' 0 N--CA 1.43 -1.473 0 C-N-CA 126.523 1.929 . . . . 1.0 113.906 172.424 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -62.77 -49.11 76.3 Favored 'General case' 0 N--CA 1.429 -1.507 0 O-C-N 120.41 -1.431 . . . . 1.0 113.446 179.783 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 66.1 m -48.18 -47.55 35.11 Favored 'General case' 0 N--CA 1.43 -1.437 0 C-N-CA 127.859 2.464 . . . . 1.0 114.913 170.501 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 6.6 pt20 -73.4 -30.93 63.59 Favored 'General case' 0 N--CA 1.43 -1.441 0 O-C-N 120.306 -1.496 . . . . 1.0 114.428 -179.222 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 49.7 mt-30 -81.03 -37.93 28.3 Favored 'General case' 0 N--CA 1.431 -1.379 0 O-C-N 120.323 -1.486 . . . . 1.0 113.868 174.715 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -79.42 -42.76 24.73 Favored 'General case' 0 N--CA 1.43 -1.456 0 O-C-N 120.32 -1.488 . . . . 1.0 114.98 -179.686 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . 106.98 17.75 11.35 Favored Glycine 0 N--CA 1.431 -1.695 0 O-C-N 120.683 -1.261 . . . . 1.0 115.762 175.408 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 4.9 tt0 -162.41 152.78 16.81 Favored 'General case' 0 N--CA 1.43 -1.455 0 N-CA-C 104.946 -2.242 . . . . 1.0 104.946 179.527 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 35.1 m -53.48 108.31 0.33 Allowed 'General case' 0 N--CA 1.43 -1.463 0 C-N-CA 125.238 1.415 . . . . 1.0 114.571 175.317 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 49.0 t -89.43 110.49 21.69 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.414 0 CA-C-O 123.258 1.504 . . . . 1.0 108.244 176.892 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 61.5 m -94.19 98.98 11.33 Favored 'General case' 0 N--CA 1.43 -1.46 0 N-CA-C 113.615 0.968 . . . . 1.0 113.615 -162.525 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 88.5 m-85 -89.17 -32.91 17.24 Favored 'General case' 0 N--CA 1.429 -1.485 0 O-C-N 120.961 -1.087 . . . . 1.0 112.884 176.738 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 30.7 mmt180 . . . . . 0 C--O 1.26 1.647 0 N-CA-C 107.3 -1.37 . . . . 1.0 107.3 172.78 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 76.8 m-20 . . . . . 0 N--CA 1.431 -1.405 0 CA-C-O 121.172 0.51 . . . . 1.0 110.542 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -56.86 -45.95 82.12 Favored 'General case' 0 N--CA 1.43 -1.446 0 C-N-CA 126.723 2.009 . . . . 1.0 110.611 170.95 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 49.5 m -60.06 -40.79 90.69 Favored 'General case' 0 N--CA 1.431 -1.416 0 C-N-CA 125.285 1.434 . . . . 1.0 114.776 176.57 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 26.1 tt0 -62.8 -57.34 11.25 Favored 'General case' 0 N--CA 1.429 -1.494 0 C-N-CA 124.236 1.014 . . . . 1.0 111.933 175.265 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 2.4 m-85 -67.31 -24.79 65.79 Favored 'General case' 0 N--CA 1.429 -1.499 0 N-CA-C 115.506 1.669 . . . . 1.0 115.506 178.555 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 10.0 t60 -62.56 -43.28 99.19 Favored 'General case' 0 N--CA 1.43 -1.429 0 O-C-N 119.709 -1.869 . . . . 1.0 112.982 167.857 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -73.84 -45.47 51.02 Favored 'General case' 0 N--CA 1.43 -1.458 0 O-C-N 120.355 -1.465 . . . . 1.0 113.683 177.965 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 84.2 mt -59.76 -44.82 93.69 Favored 'General case' 0 N--CA 1.429 -1.495 0 C-N-CA 124.539 1.135 . . . . 1.0 112.782 173.441 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -58.47 -40.57 83.06 Favored 'General case' 0 N--CA 1.43 -1.47 0 O-C-N 120.538 -1.351 . . . . 1.0 113.427 173.01 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -58.51 -38.48 77.78 Favored 'General case' 0 N--CA 1.431 -1.417 0 CA-C-N 120.276 1.398 . . . . 1.0 114.138 172.358 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 57.9 mm-40 -63.06 -47.94 80.79 Favored 'General case' 0 N--CA 1.43 -1.453 0 O-C-N 119.999 -1.688 . . . . 1.0 114.98 171.719 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 77.6 mt -60.71 -50.06 75.0 Favored 'General case' 0 N--CA 1.431 -1.422 0 O-C-N 120.283 -1.51 . . . . 1.0 112.508 173.863 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 0.4 OUTLIER -46.5 -61.75 1.67 Allowed 'General case' 0 N--CA 1.43 -1.451 0 C-N-CA 127.594 2.358 . . . . 1.0 111.799 177.416 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 53.0 tp -53.62 -58.21 7.99 Favored 'General case' 0 N--CA 1.431 -1.415 0 C-N-CA 125.041 1.336 . . . . 1.0 113.304 174.519 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 28.7 m -60.93 -44.13 97.64 Favored 'General case' 0 N--CA 1.429 -1.485 0 N-CA-C 115.038 1.496 . . . . 1.0 115.038 -170.234 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 7.4 mt -83.41 -27.85 7.69 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.408 0 O-C-N 120.237 -1.539 . . . . 1.0 111.4 -178.196 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 5.4 tt0 -59.33 -50.23 74.78 Favored 'General case' 0 N--CA 1.431 -1.394 0 O-C-N 119.852 -1.78 . . . . 1.0 110.944 167.714 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 53.3 mt-10 -51.84 -52.86 46.41 Favored 'General case' 0 N--CA 1.429 -1.48 0 C-N-CA 126.234 1.814 . . . . 1.0 114.397 172.315 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -63.94 -45.28 89.9 Favored 'General case' 0 N--CA 1.43 -1.472 0 O-C-N 120.277 -1.515 . . . . 1.0 114.843 -177.933 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 96.0 mt -63.93 -49.17 73.67 Favored 'General case' 0 N--CA 1.43 -1.447 0 N-CA-C 115.486 1.661 . . . . 1.0 115.486 174.207 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 25.2 t0 -58.28 -37.58 75.3 Favored 'General case' 0 N--CA 1.429 -1.492 0 O-C-N 119.517 -1.99 . . . . 1.0 114.501 174.349 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 18.2 t70 -91.21 28.32 1.67 Allowed 'General case' 0 N--CA 1.43 -1.46 0 C-N-CA 125.643 1.577 . . . . 1.0 113.9 177.201 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 24' ' ' TRP . . . . . . . . . . . . . 14.1 t90 -65.41 -66.81 0.5 Allowed 'General case' 0 N--CA 1.43 -1.47 0 O-C-N 119.51 -1.994 . . . . 1.0 113.356 176.844 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 29.0 t0 83.2 167.71 0.11 Allowed 'General case' 0 N--CA 1.43 -1.452 0 C-N-CA 127.368 2.267 . . . . 1.0 113.841 172.912 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 116.51 -134.59 11.45 Favored Glycine 0 N--CA 1.431 -1.686 0 C-N-CA 124.803 1.192 . . . . 1.0 111.785 177.223 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -80.57 -28.54 37.16 Favored 'General case' 0 N--CA 1.429 -1.519 0 C-N-CA 126.524 1.93 . . . . 1.0 111.054 -174.921 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 81.9 p -77.42 171.51 14.77 Favored 'General case' 0 N--CA 1.432 -1.366 0 C-N-CA 127.176 2.191 . . . . 1.0 115.68 -172.387 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 17.2 t0 -132.32 157.66 43.88 Favored 'General case' 0 N--CA 1.429 -1.478 0 N-CA-C 107.051 -1.462 . . . . 1.0 107.051 166.18 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 16.6 tt -159.62 123.33 0.41 Allowed 'Isoleucine or valine' 0 N--CA 1.43 -1.461 0 CA-C-O 123.088 1.423 . . . . 1.0 107.754 -169.274 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 31.9 t0 -115.7 101.59 8.97 Favored 'General case' 0 N--CA 1.43 -1.472 0 C-N-CA 127.554 2.342 . . . . 1.0 108.212 -179.377 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 21.7 p -89.26 134.48 34.03 Favored 'General case' 0 N--CA 1.43 -1.447 0 O-C-N 120.283 -1.511 . . . . 1.0 110.345 174.841 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 19.5 mt-10 -129.03 130.11 46.19 Favored 'General case' 0 N--CA 1.431 -1.379 0 O-C-N 120.488 -1.383 . . . . 1.0 111.475 -175.996 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 3.3 tp -106.51 110.77 32.71 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.456 0 C-N-CA 127.34 2.256 . . . . 1.0 105.893 178.335 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 62.7 m-80 -115.17 -178.5 3.39 Favored 'General case' 0 N--CA 1.429 -1.503 0 C-N-CA 126.255 1.822 . . . . 1.0 107.786 175.524 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -71.98 92.79 0.56 Allowed Glycine 0 N--CA 1.431 -1.669 0 O-C-N 119.816 -1.803 . . . . 1.0 115.695 -167.031 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 85.76 11.42 74.05 Favored Glycine 0 N--CA 1.429 -1.782 0 C-N-CA 125.898 1.713 . . . . 1.0 113.264 -174.194 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 48.5 t -136.97 125.89 35.8 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.426 0 O-C-N 121.615 -0.932 . . . . 1.0 111.048 -165.429 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 13.5 mt -105.47 126.0 51.63 Favored 'General case' 0 N--CA 1.43 -1.437 0 CA-C-O 124.511 2.101 . . . . 1.0 108.933 161.587 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -126.66 120.73 30.21 Favored 'General case' 0 N--CA 1.43 -1.449 0 N-CA-C 104.412 -2.44 . . . . 1.0 104.412 -178.621 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 4.5 mp -119.09 126.29 75.23 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.484 0 N-CA-C 108.011 -1.107 . . . . 1.0 108.011 -173.676 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 44.0 p -129.88 130.45 45.22 Favored 'General case' 0 N--CA 1.428 -1.547 0 CA-C-O 121.421 0.629 . . . . 1.0 110.932 -171.83 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 43' ' ' PHE . . . . . . . . . . . . . 1.9 p90 -120.02 172.31 7.83 Favored 'General case' 0 N--CA 1.429 -1.494 0 O-C-N 120.552 -1.343 . . . . 1.0 111.343 -176.395 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -64.02 -24.43 67.71 Favored 'General case' 0 N--CA 1.43 -1.466 0 N-CA-C 116.774 2.138 . . . . 1.0 116.774 -160.062 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 31.1 m120 -66.22 -18.17 65.18 Favored 'General case' 0 N--CA 1.429 -1.489 0 N-CA-C 115.369 1.618 . . . . 1.0 115.369 173.848 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 83.57 43.69 7.23 Favored Glycine 0 N--CA 1.429 -1.774 0 N-CA-C 109.898 -1.281 . . . . 1.0 109.898 -169.929 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 57.8 m -123.94 158.71 31.38 Favored 'General case' 0 N--CA 1.43 -1.468 0 C-N-CA 126.336 1.855 . . . . 1.0 107.213 -177.382 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 22.1 ptmt -151.35 142.3 23.0 Favored 'General case' 0 N--CA 1.43 -1.442 0 N-CA-C 115.21 1.559 . . . . 1.0 115.21 -160.985 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 4.7 mm -109.18 132.71 56.53 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.433 0 N-CA-C 106.136 -1.801 . . . . 1.0 106.136 166.651 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 2.7 tp -125.0 119.75 56.69 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.505 0 CA-C-O 123.116 1.436 . . . . 1.0 109.19 174.243 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 3.0 mt -124.69 96.02 3.58 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.386 0 C-N-CA 126.229 1.812 . . . . 1.0 110.769 -179.035 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 27.2 m120 -94.68 150.77 19.88 Favored 'General case' 0 N--CA 1.43 -1.473 0 CA-C-O 123.864 1.792 . . . . 1.0 108.469 166.97 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 5.8 tmm_? -153.51 141.6 20.38 Favored 'General case' 0 N--CA 1.429 -1.495 0 CA-C-O 123.237 1.494 . . . . 1.0 110.933 -163.977 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -111.57 132.02 54.84 Favored 'General case' 0 N--CA 1.428 -1.541 0 C-N-CA 127.484 2.314 . . . . 1.0 107.352 178.047 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 56.0 mt-10 -67.33 -48.88 45.5 Favored Pre-proline 0 N--CA 1.43 -1.44 0 CA-C-O 115.687 -2.101 . . . . 1.0 115.295 165.573 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 92.4 Cg_endo -77.29 -172.31 1.41 Allowed 'Trans proline' 0 N--CA 1.434 -2.004 0 CA-C-N 126.449 3.339 . . . . 1.0 112.586 172.401 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 22.3 mt 77.7 -44.54 0.42 Allowed 'General case' 0 N--CA 1.43 -1.45 0 C-N-CA 127.419 2.288 . . . . 1.0 114.609 173.989 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 3.8 m170 91.15 47.0 0.01 OUTLIER 'General case' 0 N--CA 1.43 -1.458 0 C-N-CA 128.865 2.866 . . . . 1.0 112.673 169.035 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -150.49 161.86 41.72 Favored 'General case' 0 N--CA 1.43 -1.454 0 O-C-N 120.403 -1.435 . . . . 1.0 107.169 174.984 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 91.3 t -123.14 154.5 28.77 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.403 0 N-CA-C 108.126 -1.064 . . . . 1.0 108.126 173.166 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 61' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -90.1 153.67 20.36 Favored 'General case' 0 N--CA 1.43 -1.451 0 CA-C-N 120.91 1.687 . . . . 1.0 110.376 176.665 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 2.1 tm? -147.61 103.93 3.57 Favored 'General case' 0 N--CA 1.429 -1.477 0 O-C-N 119.144 -2.222 . . . . 1.0 111.035 178.761 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -123.97 136.07 54.06 Favored 'General case' 0 N--CA 1.43 -1.433 0 O-C-N 120.818 -1.176 . . . . 1.0 113.742 172.915 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 64' ' ' THR . . . . . . . . . . . . 0.258 0.1 OUTLIER -134.66 -80.84 0.44 Allowed 'General case' 0 N--CA 1.429 -1.475 0 N-CA-C 107.415 -1.328 . . . . 1.0 107.415 171.456 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 6.1 tmtm? -82.31 -83.69 0.12 Allowed 'General case' 0 N--CA 1.43 -1.442 0 O-C-N 120.242 -1.536 . . . . 1.0 113.161 -175.84 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 20.9 tt0 -128.51 -26.38 2.77 Favored 'General case' 0 N--CA 1.43 -1.464 0 O-C-N 120.218 -1.551 . . . . 1.0 111.733 -175.357 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . -92.19 71.25 1.67 Allowed Glycine 0 N--CA 1.431 -1.689 0 O-C-N 120.692 -1.255 . . . . 1.0 110.839 -179.466 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . -77.97 94.78 1.23 Allowed Glycine 0 N--CA 1.43 -1.759 0 C-N-CA 123.382 0.515 . . . . 1.0 112.522 168.831 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 15.5 m-85 -126.45 151.53 47.62 Favored 'General case' 0 N--CA 1.43 -1.447 0 N-CA-C 107.699 -1.223 . . . . 1.0 107.699 -171.625 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 12.8 p80 -92.71 158.17 16.06 Favored 'General case' 0 N--CA 1.431 -1.392 0 O-C-N 120.187 -1.571 . . . . 1.0 111.063 169.411 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 47.1 p90 -130.01 143.32 50.73 Favored 'General case' 0 N--CA 1.431 -1.423 0 N-CA-C 114.379 1.252 . . . . 1.0 114.379 -162.503 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 30.8 m-20 -125.02 154.35 41.41 Favored 'General case' 0 N--CA 1.43 -1.464 0 C-N-CA 125.74 1.616 . . . . 1.0 110.496 -177.729 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 64.2 tp -87.07 137.48 32.31 Favored 'General case' 0 N--CA 1.43 -1.433 0 C-N-CA 125.625 1.57 . . . . 1.0 111.555 -178.397 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 2.5 mmmp? -101.46 -76.15 0.57 Allowed 'General case' 0 N--CA 1.43 -1.471 0 O-C-N 120.694 -1.254 . . . . 1.0 109.279 165.076 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -146.12 -76.35 0.02 OUTLIER Glycine 0 N--CA 1.43 -1.741 0 O-C-N 121.133 -0.98 . . . . 1.0 112.062 -178.674 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 37.8 m-20 -113.99 39.7 2.65 Favored 'General case' 0 N--CA 1.429 -1.502 0 C-N-CA 124.695 1.198 . . . . 1.0 109.382 170.637 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 15.0 tp10 -168.63 138.0 2.3 Favored 'General case' 0 N--CA 1.43 -1.453 0 N-CA-C 103.624 -2.732 . . . . 1.0 103.624 -178.81 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 78' ' ' TRP . . . . . . . . . . . . . 45.1 m95 -101.65 141.55 34.34 Favored 'General case' 0 N--CA 1.429 -1.477 0 N-CA-C 104.984 -2.228 . . . . 1.0 104.984 165.51 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 9.9 pt -105.11 160.6 5.21 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.432 0 O-C-N 120.527 -1.358 . . . . 1.0 107.93 176.744 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 39.0 m -82.74 133.54 35.15 Favored 'General case' 0 N--CA 1.43 -1.431 0 O-C-N 121.041 -1.037 . . . . 1.0 108.674 167.765 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 29.0 t70 -65.25 -43.29 91.84 Favored 'General case' 0 N--CA 1.43 -1.469 0 CA-C-N 120.577 1.535 . . . . 1.0 112.774 -178.092 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 29.2 tpt85 -66.63 101.79 0.83 Allowed 'General case' 0 N--CA 1.43 -1.428 0 C-N-CA 126.822 2.049 . . . . 1.0 111.38 -179.054 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 83' ' ' SER . . . . . . . . . . . . 0.279 15.4 m 80.52 -43.49 0.23 Allowed 'General case' 0 N--CA 1.43 -1.433 0 C-N-CA 128.619 2.767 . . . . 1.0 114.931 -171.87 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 110.86 81.78 1.23 Allowed Glycine 0 N--CA 1.43 -1.751 0 N-CA-C 109.71 -1.356 . . . . 1.0 109.71 -176.181 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 85' ' ' GLU . . . . . . . . . . . . 0.264 16.0 mt-10 -124.72 -140.5 0.29 Allowed 'General case' 0 N--CA 1.43 -1.455 0 CA-C-N 118.19 0.995 . . . . 1.0 109.535 -172.0 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 62.9 m -146.04 129.2 16.63 Favored 'General case' 0 N--CA 1.43 -1.461 0 O-C-N 119.592 -1.942 . . . . 1.0 110.004 -169.388 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 15.0 t80 -58.86 -81.87 0.02 OUTLIER 'General case' 0 N--CA 1.429 -1.481 0 N-CA-C 117.11 2.263 . . . . 1.0 117.11 -171.277 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 88' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -66.94 -34.38 77.65 Favored 'General case' 0 N--CA 1.429 -1.487 0 O-C-N 120.608 -1.307 . . . . 1.0 112.958 -170.697 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 35.5 t70 -59.93 -47.51 85.47 Favored 'General case' 0 N--CA 1.43 -1.458 0 C-N-CA 126.233 1.813 . . . . 1.0 114.62 173.074 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 49.3 tp -69.81 -41.42 75.05 Favored 'General case' 0 N--CA 1.429 -1.524 0 O-C-N 119.541 -1.974 . . . . 1.0 111.981 178.521 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 45.3 tp -50.58 -44.27 56.78 Favored 'General case' 0 N--CA 1.429 -1.519 0 C-N-CA 126.584 1.954 . . . . 1.0 113.763 167.698 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 2.7 tm-20 -59.55 -50.36 74.21 Favored 'General case' 0 N--CA 1.429 -1.504 0 C-N-CA 125.329 1.452 . . . . 1.0 113.122 172.324 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 37.5 mt-30 -53.33 -45.55 69.1 Favored 'General case' 0 N--CA 1.43 -1.446 0 CA-C-N 120.188 1.358 . . . . 1.0 114.373 173.693 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -62.71 -44.47 96.14 Favored 'General case' 0 N--CA 1.43 -1.461 0 O-C-N 120.219 -1.551 . . . . 1.0 115.133 175.024 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -71.21 -45.23 63.77 Favored 'General case' 0 N--CA 1.43 -1.426 0 O-C-N 119.692 -1.88 . . . . 1.0 113.808 178.233 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 63.0 m -57.46 -30.83 65.36 Favored 'General case' 0 N--CA 1.431 -1.409 0 C-N-CA 127.764 2.425 . . . . 1.0 112.521 174.631 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -63.54 -72.36 0.14 Allowed 'General case' 0 N--CA 1.429 -1.507 0 C-N-CA 125.004 1.321 . . . . 1.0 112.098 168.711 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 3.2 pt20 -70.5 -12.17 61.4 Favored 'General case' 0 N--CA 1.43 -1.425 0 N-CA-C 116.756 2.132 . . . . 1.0 116.756 -169.76 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -90.51 -48.2 7.24 Favored 'General case' 0 N--CA 1.43 -1.446 0 C-N-CA 124.854 1.261 . . . . 1.0 112.139 164.643 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . 110.62 4.33 28.38 Favored Glycine 0 N--CA 1.43 -1.702 0 O-C-N 121.037 -1.039 . . . . 1.0 114.379 -178.614 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 11.2 pt-20 -162.91 165.87 24.61 Favored 'General case' 0 N--CA 1.429 -1.511 0 N-CA-C 106.754 -1.573 . . . . 1.0 106.754 -177.087 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 96.4 m -70.83 121.66 18.45 Favored 'General case' 0 N--CA 1.431 -1.424 0 CA-C-N 120.313 1.415 . . . . 1.0 113.424 -173.342 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 76.6 t -98.62 121.36 49.1 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.493 0 C-N-CA 127.272 2.229 . . . . 1.0 109.421 -179.625 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 29.6 m -67.27 124.07 22.09 Favored 'General case' 0 N--CA 1.43 -1.457 0 C-N-CA 128.845 2.858 . . . . 1.0 115.557 -172.721 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 1.6 p90 -140.85 -56.12 0.5 Allowed 'General case' 0 N--CA 1.429 -1.482 0 O-C-N 120.196 -1.565 . . . . 1.0 112.174 -156.032 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 17.6 ttt180 . . . . . 0 C--O 1.262 1.723 0 C-N-CA 125.346 1.459 . . . . 1.0 111.13 -171.938 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 2.2 m120 . . . . . 0 N--CA 1.431 -1.406 0 N-CA-C 118.876 2.917 . . . . 1.0 118.876 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 11.0 p-10 -71.51 -25.34 62.21 Favored 'General case' 0 N--CA 1.43 -1.436 0 O-C-N 120.181 -1.574 . . . . 1.0 114.129 -175.989 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 28.2 m -71.3 -53.65 13.54 Favored 'General case' 0 N--CA 1.43 -1.451 0 C-N-CA 124.877 1.271 . . . . 1.0 110.338 175.943 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 44.6 mm-40 -57.55 -51.17 70.59 Favored 'General case' 0 N--CA 1.429 -1.483 0 C-N-CA 126.622 1.969 . . . . 1.0 113.509 175.778 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 5.1 t80 -56.42 -39.73 73.54 Favored 'General case' 0 CA--C 1.489 -1.4 0 N-CA-C 114.833 1.42 . . . . 1.0 114.833 172.768 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . 0.31 0.2 OUTLIER -67.61 -40.42 84.69 Favored 'General case' 0 N--CA 1.43 -1.429 0 O-C-N 119.543 -1.973 . . . . 1.0 115.009 173.015 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 81.5 mtt180 -56.4 -53.96 51.26 Favored 'General case' 0 N--CA 1.429 -1.476 0 C-N-CA 125.28 1.432 . . . . 1.0 113.832 177.957 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 3.4 pp -62.0 -42.28 98.98 Favored 'General case' 0 N--CA 1.429 -1.504 0 C-N-CA 124.042 0.937 . . . . 1.0 112.865 176.936 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -56.92 -47.06 81.48 Favored 'General case' 0 N--CA 1.431 -1.419 0 C-N-CA 124.927 1.291 . . . . 1.0 113.996 172.598 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 58.7 m-20 -58.85 -41.7 87.6 Favored 'General case' 0 N--CA 1.43 -1.447 0 C-N-CA 125.484 1.514 . . . . 1.0 113.07 176.265 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . 0.26 15.6 pt20 -70.83 -39.24 73.12 Favored 'General case' 0 N--CA 1.431 -1.42 0 O-C-N 119.696 -1.877 . . . . 1.0 115.859 175.405 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 4.2 pp -73.01 -34.58 66.46 Favored 'General case' 0 N--CA 1.431 -1.376 0 O-C-N 119.183 -2.198 . . . . 1.0 114.028 175.128 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -51.73 -52.05 51.48 Favored 'General case' 0 N--CA 1.43 -1.47 0 C-N-CA 126.257 1.823 . . . . 1.0 112.438 166.434 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 50.8 tp -58.69 -45.83 88.6 Favored 'General case' 0 N--CA 1.429 -1.5 0 C-N-CA 124.643 1.177 . . . . 1.0 113.65 175.088 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 75.3 m -57.0 -59.81 4.51 Favored 'General case' 0 N--CA 1.43 -1.435 0 C-N-CA 125.699 1.6 . . . . 1.0 113.063 175.858 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 84.4 mt -50.15 -45.43 23.7 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.449 0 C-N-CA 126.515 1.926 . . . . 1.0 114.765 172.218 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 10.7 mt-10 -55.57 -63.83 1.04 Allowed 'General case' 0 N--CA 1.43 -1.459 0 O-C-N 119.901 -1.749 . . . . 1.0 113.15 173.65 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 95.2 mt-10 -62.53 -46.55 87.9 Favored 'General case' 0 N--CA 1.43 -1.449 0 C-N-CA 124.998 1.319 . . . . 1.0 113.736 -175.448 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 3.3 tpt180 -73.9 -24.03 59.65 Favored 'General case' 0 N--CA 1.43 -1.447 0 N-CA-C 114.372 1.249 . . . . 1.0 114.372 -174.553 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -88.01 -48.25 7.9 Favored 'General case' 0 N--CA 1.43 -1.43 0 O-C-N 120.742 -1.224 . . . . 1.0 112.088 172.895 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 26.2 t70 -60.33 -50.31 74.14 Favored 'General case' 0 N--CA 1.431 -1.408 0 O-C-N 120.25 -1.531 . . . . 1.0 114.531 -179.244 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 15.5 t70 -93.68 106.99 18.92 Favored 'General case' 0 N--CA 1.429 -1.499 0 O-C-N 119.88 -1.762 . . . . 1.0 109.441 171.047 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 24' ' ' TRP . . . . . . . . . . . . . 14.4 t90 -146.47 175.48 10.53 Favored 'General case' 0 N--CA 1.43 -1.471 0 C-N-CA 126.019 1.728 . . . . 1.0 108.335 -179.165 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 61.0 m-20 -100.48 112.15 24.49 Favored 'General case' 0 N--CA 1.432 -1.351 0 O-C-N 120.356 -1.465 . . . . 1.0 108.502 173.335 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -173.71 167.81 40.49 Favored Glycine 0 N--CA 1.429 -1.797 0 C-N-CA 119.136 -1.506 . . . . 1.0 112.892 176.85 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 31.2 m-20 -88.92 -34.21 17.01 Favored 'General case' 0 N--CA 1.43 -1.475 0 C-N-CA 126.837 2.055 . . . . 1.0 110.607 177.593 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 58.5 p -75.79 147.43 39.22 Favored 'General case' 0 CA--C 1.488 -1.42 0 C-N-CA 124.776 1.23 . . . . 1.0 113.302 -178.717 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 3.3 t0 -90.5 170.58 10.08 Favored 'General case' 0 N--CA 1.431 -1.416 0 O-C-N 120.453 -1.404 . . . . 1.0 111.127 -175.555 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 6.9 mm -152.5 122.59 0.87 Allowed 'Isoleucine or valine' 0 N--CA 1.429 -1.485 0 C-N-CA 128.473 2.709 . . . . 1.0 105.623 -171.288 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 60.6 m-20 -111.39 101.72 10.16 Favored 'General case' 0 N--CA 1.429 -1.513 0 C-N-CA 124.146 0.978 . . . . 1.0 108.803 158.419 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 14.3 p -85.08 124.83 32.22 Favored 'General case' 0 N--CA 1.43 -1.463 0 O-C-N 120.57 -1.331 . . . . 1.0 111.666 173.213 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 36.0 mm-40 -99.4 139.4 35.11 Favored 'General case' 0 N--CA 1.43 -1.429 0 O-C-N 119.781 -1.824 . . . . 1.0 109.534 -174.688 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 4.0 mp -127.2 112.53 28.85 Favored 'Isoleucine or valine' 0 N--CA 1.432 -1.366 0 N-CA-C 105.7 -1.963 . . . . 1.0 105.7 174.437 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 48.5 m-80 -123.8 175.26 6.99 Favored 'General case' 0 N--CA 1.43 -1.455 0 C-N-CA 126.918 2.087 . . . . 1.0 108.244 173.104 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -68.07 86.87 0.18 Allowed Glycine 0 N--CA 1.429 -1.781 0 N-CA-C 116.455 1.342 . . . . 1.0 116.455 -170.615 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 85.86 16.6 63.1 Favored Glycine 0 N--CA 1.43 -1.758 0 C-N-CA 125.29 1.424 . . . . 1.0 112.584 -174.152 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 94.7 t -136.54 122.98 30.13 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.395 0 C-N-CA 124.549 1.139 . . . . 1.0 109.162 -169.828 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 98.9 mt -112.91 140.72 47.47 Favored 'General case' 0 N--CA 1.431 -1.386 0 O-C-N 120.411 -1.431 . . . . 1.0 109.064 168.822 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -134.45 121.06 20.54 Favored 'General case' 0 N--CA 1.43 -1.442 0 O-C-N 120.361 -1.462 . . . . 1.0 108.204 179.229 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 96.4 mt -97.02 115.26 36.14 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.483 0 N-CA-C 106.784 -1.561 . . . . 1.0 106.784 -177.882 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 2.9 m -124.77 122.71 38.2 Favored 'General case' 0 N--CA 1.43 -1.472 0 N-CA-C 108.698 -0.853 . . . . 1.0 108.698 -177.354 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 43' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -115.07 173.28 6.57 Favored 'General case' 0 N--CA 1.429 -1.522 0 C-N-CA 124.339 1.055 . . . . 1.0 110.611 179.882 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -68.89 -23.27 64.18 Favored 'General case' 0 N--CA 1.43 -1.471 0 N-CA-C 116.474 2.027 . . . . 1.0 116.474 -161.017 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 8.4 t-20 -66.85 -18.56 65.44 Favored 'General case' 0 N--CA 1.429 -1.484 0 C-N-CA 124.81 1.244 . . . . 1.0 112.925 169.07 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 99.71 5.06 55.59 Favored Glycine 0 N--CA 1.429 -1.768 0 O-C-N 120.603 -1.311 . . . . 1.0 113.49 172.776 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 1.3 t -89.9 171.83 9.31 Favored 'General case' 0 N--CA 1.431 -1.379 0 CA-C-N 118.277 1.038 . . . . 1.0 112.795 -177.293 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 73.7 tttt -138.17 129.38 27.41 Favored 'General case' 0 N--CA 1.43 -1.468 0 N-CA-C 113.816 1.043 . . . . 1.0 113.816 -157.301 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 1.4 mm -112.32 127.14 69.7 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.39 0 N-CA-C 105.242 -2.133 . . . . 1.0 105.242 161.528 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 3.0 tp -123.07 117.89 53.08 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.464 0 CA-C-O 123.67 1.7 . . . . 1.0 109.311 -178.803 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 6.6 mt -121.13 131.64 72.52 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.472 0 C-N-CA 125.703 1.601 . . . . 1.0 109.976 -170.127 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 52' ' ' ASN . . . . . 0.474 ' H ' ' HD1' ' A' ' 61' ' ' TRP . 6.8 t-20 -162.91 163.8 26.17 Favored 'General case' 0 N--CA 1.43 -1.439 0 CA-C-O 124.049 1.881 . . . . 1.0 107.108 -170.993 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 2.6 ttp180 -156.81 117.37 3.62 Favored 'General case' 0 N--CA 1.43 -1.456 0 CA-C-N 114.204 -1.362 . . . . 1.0 109.337 -156.098 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 32.2 mm-40 -104.55 122.29 45.27 Favored 'General case' 0 N--CA 1.43 -1.473 0 C-N-CA 126.562 1.945 . . . . 1.0 106.876 -179.342 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 23.5 mt-10 -55.72 -39.77 79.79 Favored Pre-proline 0 N--CA 1.43 -1.473 0 N-CA-C 119.332 3.086 . . . . 1.0 119.332 -175.505 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 50.1 Cg_exo -67.44 114.01 3.11 Favored 'Trans proline' 0 N--CA 1.434 -1.997 0 CA-C-N 126.107 3.217 . . . . 1.0 113.051 172.752 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . 0.389 5.3 mp 76.89 132.84 0.05 Allowed 'General case' 0 N--CA 1.429 -1.499 0 C-N-CA 126.83 2.052 . . . . 1.0 114.376 -166.872 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 35.4 m170 -73.78 43.65 0.16 Allowed 'General case' 0 N--CA 1.43 -1.451 0 C-N-CA 127.191 2.196 . . . . 1.0 114.48 -175.29 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 85.5 mt-30 -116.98 134.57 54.58 Favored 'General case' 0 N--CA 1.43 -1.474 0 O-C-N 119.877 -1.765 . . . . 1.0 110.321 -172.618 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 59.3 t -105.83 156.26 6.67 Favored 'Isoleucine or valine' 0 N--CA 1.427 -1.591 0 N-CA-C 106.173 -1.788 . . . . 1.0 106.173 177.91 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 61' ' ' TRP . . . . . 0.474 ' HD1' ' H ' ' A' ' 52' ' ' ASN . 0.0 OUTLIER -104.29 144.55 31.47 Favored 'General case' 0 N--CA 1.431 -1.394 0 O-C-N 119.788 -1.82 . . . . 1.0 111.447 170.82 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 13.1 mt -112.86 95.34 5.36 Favored 'General case' 0 N--CA 1.431 -1.392 0 N-CA-C 104.578 -2.379 . . . . 1.0 104.578 163.873 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -90.79 125.91 35.86 Favored 'General case' 0 N--CA 1.43 -1.444 0 CA-C-O 123.174 1.464 . . . . 1.0 109.224 169.655 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 64' ' ' THR . . . . . . . . . . . . . 9.4 t -152.55 -169.44 3.34 Favored 'General case' 0 N--CA 1.43 -1.453 0 N-CA-C 107.414 -1.328 . . . . 1.0 107.414 -154.9 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 2.3 tptm -56.25 -44.44 79.67 Favored 'General case' 0 N--CA 1.43 -1.466 0 N-CA-C 115.778 1.77 . . . . 1.0 115.778 -178.326 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 82.1 mt-30 -71.66 -24.14 61.79 Favored 'General case' 0 N--CA 1.431 -1.418 0 N-CA-C 115.229 1.566 . . . . 1.0 115.229 -177.313 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 147.25 -46.78 0.71 Allowed Glycine 0 N--CA 1.43 -1.708 0 O-C-N 120.595 -1.315 . . . . 1.0 113.299 175.213 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 125.88 116.77 2.11 Favored Glycine 0 N--CA 1.431 -1.686 0 N-CA-C 117.816 1.886 . . . . 1.0 117.816 178.755 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 20.1 m-30 -123.59 131.99 53.76 Favored 'General case' 0 N--CA 1.431 -1.398 0 C-N-CA 124.791 1.237 . . . . 1.0 109.219 -178.912 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 70' ' ' HIS . . . . . 0.441 ' HE1' ' OD2' ' A' ' 81' ' ' ASP . 17.6 p80 -88.7 158.18 18.29 Favored 'General case' 0 N--CA 1.429 -1.487 0 O-C-N 120.372 -1.455 . . . . 1.0 114.024 173.502 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 48.0 p90 -148.19 148.8 30.94 Favored 'General case' 0 N--CA 1.431 -1.406 0 N-CA-C 115.469 1.655 . . . . 1.0 115.469 -161.369 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 6.2 m-20 -116.46 175.23 5.66 Favored 'General case' 0 N--CA 1.431 -1.414 0 C-N-CA 127.349 2.26 . . . . 1.0 111.808 -172.648 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 50.2 tp -111.3 116.74 31.51 Favored 'General case' 0 N--CA 1.431 -1.416 0 C-N-CA 125.723 1.609 . . . . 1.0 112.039 -178.998 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -72.91 -42.35 63.62 Favored 'General case' 0 N--CA 1.429 -1.495 0 O-C-N 121.14 -0.975 . . . . 1.0 112.476 163.375 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . 166.63 -66.64 0.2 Allowed Glycine 0 N--CA 1.431 -1.694 0 O-C-N 121.035 -1.04 . . . . 1.0 111.815 178.003 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 18.0 p-10 -110.45 6.07 21.86 Favored 'General case' 0 N--CA 1.43 -1.458 0 C-N-CA 124.888 1.275 . . . . 1.0 111.716 -179.108 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 20.2 tt0 -151.72 132.58 14.15 Favored 'General case' 0 N--CA 1.43 -1.44 0 N-CA-C 103.921 -2.622 . . . . 1.0 103.921 -177.574 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 78' ' ' TRP . . . . . . . . . . . . . 71.3 m95 -89.12 135.54 33.51 Favored 'General case' 0 N--CA 1.43 -1.441 0 N-CA-C 105.667 -1.975 . . . . 1.0 105.667 173.495 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -133.96 136.92 53.13 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.452 0 N-CA-C 104.992 -2.225 . . . . 1.0 104.992 -161.737 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 60.5 m -78.69 137.42 37.79 Favored 'General case' 0 N--CA 1.431 -1.384 0 O-C-N 120.089 -1.632 . . . . 1.0 111.957 -173.194 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 81' ' ' ASP . . . . . 0.441 ' OD2' ' HE1' ' A' ' 70' ' ' HIS . 23.8 t0 -72.78 -56.82 4.68 Favored 'General case' 0 N--CA 1.43 -1.428 0 CA-C-O 123.12 1.438 . . . . 1.0 109.548 177.311 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 1.9 tpt85 -72.73 128.59 36.0 Favored 'General case' 0 N--CA 1.43 -1.449 0 C-N-CA 125.535 1.534 . . . . 1.0 110.076 178.59 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 11.0 t 77.86 -63.2 0.34 Allowed 'General case' 0 N--CA 1.43 -1.471 0 C-N-CA 127.33 2.252 . . . . 1.0 112.916 -170.773 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 110.67 71.68 0.66 Allowed Glycine 0 N--CA 1.429 -1.779 0 C-N-CA 124.62 1.105 . . . . 1.0 110.813 -176.774 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 59.6 mt-10 -136.05 -146.36 0.24 Allowed 'General case' 0 N--CA 1.43 -1.441 0 C-N-CA 125.023 1.329 . . . . 1.0 109.444 -170.246 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 88.7 m -143.32 134.8 26.22 Favored 'General case' 0 N--CA 1.43 -1.464 0 O-C-N 120.427 -1.42 . . . . 1.0 109.998 -156.789 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 31.1 t80 -61.03 -76.85 0.05 OUTLIER 'General case' 0 N--CA 1.43 -1.444 0 N-CA-C 117.353 2.353 . . . . 1.0 117.353 -177.535 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 88' ' ' TRP . . . . . . . . . . . . . 55.0 m95 -60.77 -31.88 71.21 Favored 'General case' 0 N--CA 1.431 -1.425 0 O-C-N 120.032 -1.668 . . . . 1.0 114.727 -169.674 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 6.1 t70 -78.14 -36.2 48.04 Favored 'General case' 0 N--CA 1.43 -1.441 0 C-N-CA 125.83 1.652 . . . . 1.0 113.16 177.721 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 50.5 tp -70.63 -41.39 72.26 Favored 'General case' 0 N--CA 1.431 -1.409 0 O-C-N 118.679 -2.513 . . . . 1.0 110.989 175.591 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 31.6 tp -55.46 -37.8 68.23 Favored 'General case' 0 N--CA 1.431 -1.383 0 C-N-CA 126.554 1.942 . . . . 1.0 114.074 169.614 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 35.0 tt0 -60.66 -54.23 47.84 Favored 'General case' 0 N--CA 1.43 -1.434 0 C-N-CA 125.454 1.502 . . . . 1.0 113.028 169.804 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 10.9 tm0? -51.71 -53.81 35.22 Favored 'General case' 0 N--CA 1.43 -1.438 0 C-N-CA 125.995 1.718 . . . . 1.0 114.268 175.133 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -52.21 -55.56 20.36 Favored 'General case' 0 N--CA 1.431 -1.408 0 C-N-CA 127.721 2.408 . . . . 1.0 113.954 176.053 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -61.58 -44.9 96.16 Favored 'General case' 0 N--CA 1.429 -1.49 0 N-CA-C 114.528 1.307 . . . . 1.0 114.528 177.066 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 93.4 m -64.71 -21.21 66.69 Favored 'General case' 0 N--CA 1.429 -1.478 0 O-C-N 119.634 -1.916 . . . . 1.0 113.779 175.324 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 7.5 tp60 -74.45 -65.13 0.89 Allowed 'General case' 0 N--CA 1.429 -1.496 0 O-C-N 120.345 -1.472 . . . . 1.0 110.927 171.749 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 13.3 pt20 -77.38 -28.37 52.81 Favored 'General case' 0 N--CA 1.429 -1.486 0 N-CA-C 115.478 1.658 . . . . 1.0 115.478 -170.963 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -85.6 -46.2 11.02 Favored 'General case' 0 N--CA 1.43 -1.447 0 O-C-N 120.667 -1.271 . . . . 1.0 112.866 171.602 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . 95.61 32.46 6.91 Favored Glycine 0 N--CA 1.43 -1.742 0 O-C-N 120.878 -1.139 . . . . 1.0 114.655 -178.848 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 14.1 pt-20 -158.37 163.1 37.6 Favored 'General case' 0 N--CA 1.43 -1.433 0 O-C-N 120.955 -1.321 . . . . 1.0 108.987 179.57 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 92.6 m -77.9 85.38 4.16 Favored 'General case' 0 N--CA 1.429 -1.502 0 O-C-N 119.862 -1.774 . . . . 1.0 112.58 -178.937 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 47.8 t -85.12 100.38 8.27 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.42 0 C-N-CA 126.914 2.085 . . . . 1.0 106.617 168.378 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 34.9 t -143.09 154.72 44.23 Favored 'General case' 0 N--CA 1.431 -1.415 0 C-N-CA 125.261 1.424 . . . . 1.0 107.93 -174.78 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -110.98 -16.77 13.44 Favored 'General case' 0 N--CA 1.43 -1.456 0 O-C-N 120.437 -1.415 . . . . 1.0 112.217 176.262 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 16.1 mtp180 . . . . . 0 C--O 1.259 1.574 0 N-CA-C 115.519 1.674 . . . . 1.0 115.519 -167.16 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 18.8 m120 . . . . . 0 N--CA 1.43 -1.46 0 N-CA-C 114.02 1.119 . . . . 1.0 114.02 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -57.3 -47.61 81.04 Favored 'General case' 0 CA--C 1.49 -1.361 0 C-N-CA 127.493 2.317 . . . . 1.0 113.197 -173.235 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 10.5 m -60.07 -42.5 94.67 Favored 'General case' 0 N--CA 1.43 -1.43 0 C-N-CA 125.743 1.617 . . . . 1.0 113.567 177.106 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 9.0 tp10 -70.6 -46.47 63.35 Favored 'General case' 0 N--CA 1.43 -1.426 0 C-N-CA 125.083 1.353 . . . . 1.0 111.729 -178.732 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 4.4 t80 -50.36 -54.69 19.83 Favored 'General case' 0 N--CA 1.429 -1.5 0 C-N-CA 125.802 1.641 . . . . 1.0 114.63 166.572 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 30.4 m170 -59.47 -45.16 92.42 Favored 'General case' 0 N--CA 1.43 -1.454 0 N-CA-C 115.475 1.657 . . . . 1.0 115.475 178.434 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 73.4 mtp85 -56.52 -56.27 23.34 Favored 'General case' 0 N--CA 1.43 -1.433 0 N-CA-C 113.338 0.866 . . . . 1.0 113.338 173.282 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 82.7 mt -66.23 -40.59 90.37 Favored 'General case' 0 N--CA 1.43 -1.441 0 N-CA-C 114.676 1.361 . . . . 1.0 114.676 -179.161 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -62.79 -48.5 78.87 Favored 'General case' 0 N--CA 1.43 -1.468 0 C-N-CA 124.905 1.282 . . . . 1.0 113.383 178.509 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 58.7 m-20 -66.22 -36.33 82.77 Favored 'General case' 0 N--CA 1.429 -1.485 0 O-C-N 120.829 -1.17 . . . . 1.0 113.071 175.812 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 29.1 mm100 -61.65 -46.73 88.52 Favored 'General case' 0 N--CA 1.43 -1.461 0 O-C-N 120.116 -1.615 . . . . 1.0 114.845 170.398 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 1.2 pp -70.05 -37.18 75.48 Favored 'General case' 0 N--CA 1.43 -1.451 0 O-C-N 119.942 -1.724 . . . . 1.0 114.503 -179.688 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 0.1 OUTLIER -43.82 -62.09 1.22 Allowed 'General case' 0 N--CA 1.43 -1.459 0 C-N-CA 127.786 2.434 . . . . 1.0 112.411 163.348 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 44.7 tp -60.06 -47.85 84.15 Favored 'General case' 0 N--CA 1.43 -1.44 0 C-N-CA 124.738 1.215 . . . . 1.0 113.499 177.88 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 32.6 m -57.33 -50.83 71.71 Favored 'General case' 0 N--CA 1.43 -1.474 0 C-N-CA 125.743 1.617 . . . . 1.0 113.686 179.482 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 95.9 mt -65.32 -45.45 93.37 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.465 0 O-C-N 120.353 -1.467 . . . . 1.0 111.554 179.718 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -57.65 -55.05 39.89 Favored 'General case' 0 N--CA 1.428 -1.532 0 O-C-N 121.774 -0.579 . . . . 1.0 112.542 176.26 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 5.5 tm-20 -58.21 -49.7 76.14 Favored 'General case' 0 N--CA 1.43 -1.467 0 C-N-CA 126.103 1.761 . . . . 1.0 114.591 178.008 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.28 -38.54 77.19 Favored 'General case' 0 N--CA 1.43 -1.471 0 C-N-CA 124.72 1.208 . . . . 1.0 113.912 -179.388 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 2.7 tp -86.08 -38.32 17.92 Favored 'General case' 0 N--CA 1.429 -1.495 0 N-CA-C 113.877 1.065 . . . . 1.0 113.877 177.914 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 37.3 t70 -61.23 -26.41 67.72 Favored 'General case' 0 N--CA 1.43 -1.469 0 O-C-N 119.281 -2.137 . . . . 1.0 113.969 173.709 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 29.8 t70 -59.85 -35.51 74.93 Favored 'General case' 0 N--CA 1.429 -1.478 0 C-N-CA 126.247 1.819 . . . . 1.0 114.506 171.02 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 24' ' ' TRP . . . . . . . . . . . . . 48.7 t90 -83.93 138.78 32.98 Favored 'General case' 0 N--CA 1.43 -1.46 0 CA-C-O 122.062 0.934 . . . . 1.0 113.124 -167.349 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 24.0 t70 -133.64 131.46 39.59 Favored 'General case' 0 N--CA 1.431 -1.393 0 O-C-N 121.236 -0.915 . . . . 1.0 109.298 -179.661 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -125.88 -141.35 5.52 Favored Glycine 0 N--CA 1.43 -1.74 0 N-CA-C 109.843 -1.303 . . . . 1.0 109.843 177.272 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -89.07 -26.83 21.18 Favored 'General case' 0 N--CA 1.43 -1.438 0 O-C-N 120.825 -1.397 . . . . 1.0 109.134 165.632 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 88.1 p -82.12 163.98 21.63 Favored 'General case' 0 N--CA 1.431 -1.4 0 O-C-N 120.375 -1.453 . . . . 1.0 111.935 165.448 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 9.4 t70 -117.48 175.48 5.61 Favored 'General case' 0 N--CA 1.43 -1.448 0 N-CA-C 107.442 -1.318 . . . . 1.0 107.442 177.653 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 9.1 tp -159.08 114.24 0.15 Allowed 'Isoleucine or valine' 0 N--CA 1.429 -1.499 0 CA-C-O 123.81 1.767 . . . . 1.0 109.502 -159.884 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 25.1 t0 -131.21 102.47 6.01 Favored 'General case' 0 N--CA 1.43 -1.44 0 C-N-CA 125.501 1.52 . . . . 1.0 110.247 -168.079 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 28.2 t -85.57 135.22 33.9 Favored 'General case' 0 N--CA 1.429 -1.509 0 O-C-N 118.899 -2.376 . . . . 1.0 111.976 176.631 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 38.5 mt-10 -85.11 139.59 31.6 Favored 'General case' 0 N--CA 1.43 -1.44 0 O-C-N 120.953 -1.092 . . . . 1.0 110.856 171.538 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 7.9 mm -111.85 105.39 18.7 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.419 0 N-CA-C 104.927 -2.249 . . . . 1.0 104.927 166.859 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 8.0 t30 -122.95 68.25 0.98 Allowed 'General case' 0 N--CA 1.431 -1.413 0 C-N-CA 125.696 1.599 . . . . 1.0 108.208 -176.58 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . 66.61 -88.48 0.13 Allowed Glycine 0 N--CA 1.429 -1.771 0 O-C-N 120.524 -1.36 . . . . 1.0 115.986 176.584 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -113.88 4.57 24.18 Favored Glycine 0 N--CA 1.43 -1.708 0 C-N-CA 124.866 1.222 . . . . 1.0 112.955 177.953 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 40.3 t -117.54 131.17 71.04 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.483 0 C-N-CA 124.786 1.234 . . . . 1.0 107.679 176.919 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 40.1 mt -110.82 131.05 55.38 Favored 'General case' 0 N--CA 1.429 -1.478 0 O-C-N 120.702 -1.249 . . . . 1.0 108.14 166.771 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -130.6 111.69 12.46 Favored 'General case' 0 N--CA 1.431 -1.423 0 CA-C-O 123.119 1.438 . . . . 1.0 108.003 -174.245 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 69.9 mt -89.66 114.83 28.2 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.421 0 O-C-N 120.762 -1.211 . . . . 1.0 108.023 -170.153 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 6.4 m -111.99 128.87 56.3 Favored 'General case' 0 N--CA 1.43 -1.451 0 CA-C-O 121.694 0.759 . . . . 1.0 111.295 -170.631 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 43' ' ' PHE . . . . . . . . . . . . . 2.7 m-85 -114.74 149.42 36.89 Favored 'General case' 0 N--CA 1.43 -1.445 0 O-C-N 120.437 -1.414 . . . . 1.0 107.731 -175.408 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 4.5 mt-10 -65.8 -17.01 64.34 Favored 'General case' 0 N--CA 1.43 -1.458 0 N-CA-C 116.304 1.965 . . . . 1.0 116.304 176.248 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 3.6 m-20 -64.7 -17.76 64.39 Favored 'General case' 0 N--CA 1.429 -1.478 0 O-C-N 120.66 -1.275 . . . . 1.0 113.538 172.771 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 104.45 -4.46 43.75 Favored Glycine 0 N--CA 1.429 -1.792 0 O-C-N 120.996 -1.065 . . . . 1.0 111.092 -177.861 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 69.0 m -73.92 164.57 26.47 Favored 'General case' 0 N--CA 1.43 -1.442 0 C-N-CA 129.115 2.966 . . . . 1.0 113.458 -179.865 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 81.8 tttt -168.48 132.25 1.54 Allowed 'General case' 0 N--CA 1.43 -1.466 0 O-C-N 120.778 -1.201 . . . . 1.0 114.088 -167.799 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 5.5 mm -112.98 144.4 20.71 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.471 0 C-N-CA 125.082 1.353 . . . . 1.0 108.401 174.417 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 3.6 mm -120.0 119.39 60.0 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.483 0 C-N-CA 125.494 1.517 . . . . 1.0 109.942 -178.979 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 3.7 mt -126.99 125.6 66.84 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.474 0 O-C-N 120.304 -1.498 . . . . 1.0 111.357 -178.894 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 52' ' ' ASN . . . . . 0.441 ' H ' ' HD1' ' A' ' 61' ' ' TRP . 45.7 t-20 -160.56 166.39 29.12 Favored 'General case' 0 N--CA 1.429 -1.477 0 C-N-CA 126.759 2.024 . . . . 1.0 105.833 -177.206 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 11.1 ptm180 -133.61 145.09 49.71 Favored 'General case' 0 N--CA 1.43 -1.442 0 C-N-CA 125.513 1.525 . . . . 1.0 110.996 -162.49 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 6.2 mm-40 -128.45 -72.61 0.61 Allowed 'General case' 0 N--CA 1.429 -1.476 0 O-C-N 120.728 -1.232 . . . . 1.0 112.623 -175.052 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 54.1 mm-40 -74.12 121.64 85.68 Favored Pre-proline 0 N--CA 1.429 -1.488 0 CA-C-O 117.329 -1.32 . . . . 1.0 112.765 -165.809 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 38.4 Cg_endo -81.13 36.55 0.63 Allowed 'Trans proline' 0 C--N 1.3 -1.998 0 C-N-CA 123.877 3.051 . . . . 1.0 112.918 -174.006 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 57' ' ' LEU . . . . . 0.418 ' O ' ' HD2' ' A' ' 58' ' ' HIS . 55.4 mt -109.79 -100.42 0.39 Allowed 'General case' 0 N--CA 1.431 -1.413 0 N-CA-C 104.354 -2.462 . . . . 1.0 104.354 171.754 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 58' ' ' HIS . . . . . 0.418 ' HD2' ' O ' ' A' ' 57' ' ' LEU . 56.1 m170 -137.52 79.0 1.72 Allowed 'General case' 0 N--CA 1.43 -1.427 0 C-N-CA 125.57 1.548 . . . . 1.0 111.182 170.22 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 17.9 tt0 -155.5 132.75 10.89 Favored 'General case' 0 N--CA 1.43 -1.451 0 CA-C-N 121.84 2.109 . . . . 1.0 113.155 173.24 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 85.0 t -135.82 164.15 33.03 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.454 0 N-CA-C 107.339 -1.356 . . . . 1.0 107.339 179.933 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 61' ' ' TRP . . . . . 0.441 ' HD1' ' H ' ' A' ' 52' ' ' ASN . 0.1 OUTLIER -105.59 153.97 21.05 Favored 'General case' 0 N--CA 1.43 -1.441 0 O-C-N 119.971 -1.706 . . . . 1.0 114.127 178.298 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 68.9 mt -123.19 97.39 5.4 Favored 'General case' 0 N--CA 1.43 -1.446 0 N-CA-C 107.229 -1.397 . . . . 1.0 107.229 162.605 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -98.24 139.11 34.52 Favored 'General case' 0 N--CA 1.431 -1.417 0 O-C-N 120.811 -1.18 . . . . 1.0 108.744 172.959 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 64' ' ' THR . . . . . . . . . . . . . 6.6 t -152.68 -158.52 0.9 Allowed 'General case' 0 N--CA 1.431 -1.405 0 O-C-N 120.595 -1.316 . . . . 1.0 111.39 -158.794 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 41.3 tptt -57.2 -62.85 1.47 Allowed 'General case' 0 N--CA 1.43 -1.473 0 C-N-CA 127.391 2.276 . . . . 1.0 114.373 178.762 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 31.3 tt0 -76.63 -23.56 53.35 Favored 'General case' 0 N--CA 1.429 -1.51 0 CA-C-O 122.489 1.138 . . . . 1.0 112.933 -171.605 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 155.73 -67.16 0.3 Allowed Glycine 0 N--CA 1.43 -1.704 0 N-CA-C 108.014 -2.034 . . . . 1.0 108.014 -178.398 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 85.92 170.92 47.55 Favored Glycine 0 N--CA 1.43 -1.712 0 C-N-CA 124.245 0.926 . . . . 1.0 114.971 -177.689 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -155.95 164.89 37.91 Favored 'General case' 0 N--CA 1.429 -1.509 0 C-N-CA 123.732 0.813 . . . . 1.0 110.7 -166.375 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 28.2 p80 -82.77 157.76 23.1 Favored 'General case' 0 N--CA 1.431 -1.422 0 N-CA-C 114.952 1.464 . . . . 1.0 114.952 177.518 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 42.6 p90 -121.02 134.42 55.29 Favored 'General case' 0 N--CA 1.431 -1.423 0 CA-C-N 114.835 -1.075 . . . . 1.0 113.55 -175.076 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -131.4 147.33 52.55 Favored 'General case' 0 N--CA 1.43 -1.451 0 C-N-CA 125.207 1.403 . . . . 1.0 108.203 -177.604 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 1.5 tt -85.76 114.0 22.37 Favored 'General case' 0 N--CA 1.43 -1.461 0 O-C-N 119.695 -1.878 . . . . 1.0 112.0 -169.468 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 32.3 mmtp -115.51 72.5 0.8 Allowed 'General case' 0 N--CA 1.43 -1.472 0 O-C-N 120.639 -1.288 . . . . 1.0 111.705 177.944 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . 97.84 -100.27 2.35 Favored Glycine 0 N--CA 1.43 -1.735 0 O-C-N 120.198 -1.564 . . . . 1.0 112.716 175.631 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 34.2 m-20 -115.74 11.09 15.59 Favored 'General case' 0 N--CA 1.431 -1.399 0 C-N-CA 124.436 1.094 . . . . 1.0 111.731 179.908 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 5.3 tp10 -151.44 146.32 25.86 Favored 'General case' 0 N--CA 1.43 -1.467 0 N-CA-C 105.418 -2.068 . . . . 1.0 105.418 -179.957 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 78' ' ' TRP . . . . . 0.444 ' HB2' ' HB2' ' A' ' 87' ' ' PHE . 23.7 m95 -90.25 125.63 35.56 Favored 'General case' 0 N--CA 1.429 -1.499 0 N-CA-C 107.159 -1.423 . . . . 1.0 107.159 176.266 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 2.4 mt -89.44 137.98 20.23 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.469 0 C-N-CA 127.191 2.196 . . . . 1.0 109.396 178.272 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 20.8 m -82.05 141.6 33.05 Favored 'General case' 0 N--CA 1.431 -1.425 0 N-CA-C 108.073 -1.084 . . . . 1.0 108.073 175.655 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 24.7 t70 -78.39 -1.54 33.94 Favored 'General case' 0 N--CA 1.43 -1.426 0 CA-C-N 120.201 1.364 . . . . 1.0 114.555 -175.834 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 2.0 ptt180 -82.29 176.79 9.17 Favored 'General case' 0 N--CA 1.43 -1.446 0 O-C-N 119.171 -2.206 . . . . 1.0 112.312 170.56 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 52.5 m -76.09 65.01 2.03 Favored 'General case' 0 N--CA 1.431 -1.375 0 O-C-N 119.899 -1.751 . . . . 1.0 113.051 170.878 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 170.44 103.14 0.16 Allowed Glycine 0 N--CA 1.43 -1.717 0 N-CA-C 105.577 -3.009 . . . . 1.0 105.577 170.486 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 3.2 pt-20 -116.44 82.08 1.73 Allowed 'General case' 0 N--CA 1.43 -1.444 0 N-CA-C 114.521 1.304 . . . . 1.0 114.521 -146.324 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -162.41 129.41 3.7 Favored 'General case' 0 N--CA 1.431 -1.399 0 N-CA-C 115.545 1.683 . . . . 1.0 115.545 -173.329 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 87' ' ' PHE . . . . . 0.444 ' HB2' ' HB2' ' A' ' 78' ' ' TRP . 4.4 t80 -63.63 -89.24 0.01 OUTLIER 'General case' 0 N--CA 1.43 -1.463 0 N-CA-C 116.432 2.012 . . . . 1.0 116.432 173.048 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 88' ' ' TRP . . . . . . . . . . . . . 68.5 m95 -62.1 -27.31 68.83 Favored 'General case' 0 N--CA 1.429 -1.476 0 C-N-CA 125.313 1.445 . . . . 1.0 113.217 -173.022 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . 0.276 0.6 OUTLIER -78.1 -39.41 41.5 Favored 'General case' 0 N--CA 1.429 -1.479 0 C-N-CA 126.291 1.836 . . . . 1.0 112.916 178.683 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 26.5 tp -72.08 -37.66 69.56 Favored 'General case' 0 N--CA 1.43 -1.436 0 O-C-N 118.419 -2.676 . . . . 1.0 111.784 171.15 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 18.5 tp -54.37 -40.33 68.03 Favored 'General case' 0 N--CA 1.43 -1.435 0 C-N-CA 125.43 1.492 . . . . 1.0 114.144 170.325 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 31.4 tt0 -55.71 -56.23 22.87 Favored 'General case' 0 N--CA 1.431 -1.385 0 C-N-CA 124.535 1.134 . . . . 1.0 112.88 165.908 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 60.7 mt-30 -61.25 -39.38 90.12 Favored 'General case' 0 N--CA 1.43 -1.428 0 N-CA-C 115.14 1.533 . . . . 1.0 115.14 -177.736 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -62.51 -46.7 87.21 Favored 'General case' 0 N--CA 1.43 -1.469 0 O-C-N 119.402 -2.061 . . . . 1.0 112.91 170.622 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -67.59 -36.57 81.14 Favored 'General case' 0 N--CA 1.429 -1.501 0 O-C-N 119.566 -1.959 . . . . 1.0 114.263 176.678 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -57.72 -38.67 75.68 Favored 'General case' 0 N--CA 1.43 -1.448 0 C-N-CA 127.033 2.133 . . . . 1.0 112.474 173.617 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 8.2 pt20 -78.15 -37.11 46.74 Favored 'General case' 0 N--CA 1.431 -1.41 0 O-C-N 121.097 -1.002 . . . . 1.0 113.455 174.963 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 6.9 mm-40 -72.69 -41.91 64.8 Favored 'General case' 0 N--CA 1.43 -1.467 0 N-CA-C 115.308 1.596 . . . . 1.0 115.308 -177.486 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -84.91 -39.15 18.55 Favored 'General case' 0 N--CA 1.429 -1.494 0 C-N-CA 124.804 1.242 . . . . 1.0 112.136 174.255 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . 105.61 12.56 26.24 Favored Glycine 0 N--CA 1.43 -1.715 0 O-C-N 121.004 -1.06 . . . . 1.0 114.256 176.105 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 8.4 pt-20 -165.2 163.44 20.25 Favored 'General case' 0 N--CA 1.43 -1.435 0 N-CA-C 105.439 -2.059 . . . . 1.0 105.439 -175.486 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 94.9 m -67.47 114.06 5.83 Favored 'General case' 0 N--CA 1.43 -1.472 0 CA-C-N 120.286 1.403 . . . . 1.0 113.717 -172.09 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 76.1 t -95.6 122.61 47.23 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.448 0 C-N-CA 126.899 2.08 . . . . 1.0 106.325 171.694 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 59.5 m -103.16 102.63 12.63 Favored 'General case' 0 N--CA 1.43 -1.461 0 C-N-CA 124.556 1.142 . . . . 1.0 112.66 -162.363 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 45.7 m-85 -95.57 -36.67 11.18 Favored 'General case' 0 N--CA 1.43 -1.45 0 O-C-N 120.317 -1.489 . . . . 1.0 111.825 177.363 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 11.7 mmt85 . . . . . 0 C--O 1.26 1.658 0 C-N-CA 124.174 0.99 . . . . 1.0 110.778 -179.42 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 19.6 m120 . . . . . 0 N--CA 1.43 -1.45 0 N-CA-C 109.235 -0.654 . . . . 1.0 109.235 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 25.7 t70 -56.84 -50.35 72.68 Favored 'General case' 0 N--CA 1.43 -1.47 0 C-N-CA 128.239 2.616 . . . . 1.0 112.321 178.947 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 41.9 t -44.7 -50.23 10.07 Favored 'General case' 0 N--CA 1.429 -1.488 0 C-N-CA 128.253 2.621 . . . . 1.0 114.181 170.086 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 14.5 tt0 -74.04 -51.41 15.9 Favored 'General case' 0 N--CA 1.43 -1.457 0 C-N-CA 125.33 1.452 . . . . 1.0 113.024 -177.0 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 11.1 t80 -49.95 -43.51 50.07 Favored 'General case' 0 N--CA 1.431 -1.409 0 N-CA-C 115.753 1.76 . . . . 1.0 115.753 170.698 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 35.2 m170 -69.9 -33.65 72.47 Favored 'General case' 0 N--CA 1.43 -1.425 0 N-CA-C 114.664 1.357 . . . . 1.0 114.664 175.458 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -66.0 -46.39 78.14 Favored 'General case' 0 N--CA 1.43 -1.458 0 O-C-N 120.731 -1.23 . . . . 1.0 112.96 169.742 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 97.7 mt -60.3 -34.73 74.18 Favored 'General case' 0 N--CA 1.43 -1.438 0 O-C-N 120.57 -1.331 . . . . 1.0 113.745 173.647 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -59.05 -46.69 87.62 Favored 'General case' 0 N--CA 1.43 -1.473 0 C-N-CA 125.692 1.597 . . . . 1.0 113.245 170.307 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -58.28 -41.49 84.46 Favored 'General case' 0 N--CA 1.429 -1.482 0 C-N-CA 124.658 1.183 . . . . 1.0 113.11 172.359 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 55.1 mt-30 -58.13 -58.43 8.47 Favored 'General case' 0 N--CA 1.431 -1.42 0 N-CA-C 115.166 1.543 . . . . 1.0 115.166 172.092 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 3.7 pp -66.36 -40.15 89.58 Favored 'General case' 0 N--CA 1.43 -1.433 0 O-C-N 120.15 -1.594 . . . . 1.0 114.996 -176.483 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 33.7 m0 -64.6 -44.19 91.42 Favored 'General case' 0 N--CA 1.429 -1.487 0 C-N-CA 124.814 1.246 . . . . 1.0 112.948 174.548 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 63.0 tp -58.6 -54.77 43.29 Favored 'General case' 0 N--CA 1.431 -1.417 0 O-C-N 120.564 -1.335 . . . . 1.0 112.506 171.533 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 29.4 m -57.42 -53.39 58.66 Favored 'General case' 0 N--CA 1.43 -1.451 0 C-N-CA 125.492 1.517 . . . . 1.0 113.228 -174.381 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 14.4 mt -68.22 -44.24 84.2 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.44 0 O-C-N 120.499 -1.376 . . . . 1.0 113.846 178.826 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 32.3 tt0 -60.86 -47.57 85.78 Favored 'General case' 0 N--CA 1.431 -1.399 0 CA-C-N 120.641 1.564 . . . . 1.0 112.883 179.09 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 34.0 tt0 -58.75 -55.0 40.69 Favored 'General case' 0 N--CA 1.43 -1.438 0 C-N-CA 125.109 1.364 . . . . 1.0 113.551 174.381 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 16.3 tpt180 -58.39 -44.06 88.81 Favored 'General case' 0 N--CA 1.43 -1.462 0 C-N-CA 124.798 1.239 . . . . 1.0 114.11 -176.084 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 84.8 mt -74.83 -43.38 54.88 Favored 'General case' 0 N--CA 1.43 -1.436 0 O-C-N 121.0 -1.062 . . . . 1.0 113.845 179.013 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 21.1 t70 -64.09 -35.14 79.77 Favored 'General case' 0 CA--C 1.488 -1.434 0 O-C-N 120.527 -1.358 . . . . 1.0 114.433 176.092 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 29.4 t70 -71.8 -43.36 65.78 Favored 'General case' 0 N--CA 1.431 -1.404 0 O-C-N 120.33 -1.481 . . . . 1.0 113.84 179.715 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 24' ' ' TRP . . . . . . . . . . . . . 68.8 t-105 -78.71 154.45 30.07 Favored 'General case' 0 N--CA 1.43 -1.474 0 CA-C-O 122.342 1.068 . . . . 1.0 113.523 -173.304 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 52.5 m-20 -96.93 -153.76 0.43 Allowed 'General case' 0 N--CA 1.431 -1.419 0 O-C-N 120.384 -1.447 . . . . 1.0 111.381 -176.165 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 153.16 -173.68 31.99 Favored Glycine 0 N--CA 1.431 -1.639 0 N-CA-C 109.003 -1.639 . . . . 1.0 109.003 -178.275 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 6.6 t70 -78.06 -44.64 25.77 Favored 'General case' 0 N--CA 1.432 -1.351 0 O-C-N 121.418 -1.048 . . . . 1.0 108.322 170.326 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 21.9 t -68.31 156.4 37.79 Favored 'General case' 0 N--CA 1.43 -1.469 0 C-N-CA 125.912 1.685 . . . . 1.0 113.743 172.661 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 4.6 t70 -86.52 175.45 8.34 Favored 'General case' 0 N--CA 1.429 -1.475 0 C-N-CA 125.833 1.653 . . . . 1.0 107.735 164.471 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -162.89 119.63 0.16 Allowed 'Isoleucine or valine' 0 N--CA 1.43 -1.436 0 O-C-N 120.223 -1.548 . . . . 1.0 107.508 -172.051 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 26.3 t70 -131.93 111.26 11.41 Favored 'General case' 0 N--CA 1.43 -1.458 0 O-C-N 120.189 -1.569 . . . . 1.0 108.743 174.258 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 96.3 m -90.25 134.93 33.99 Favored 'General case' 0 N--CA 1.431 -1.385 0 O-C-N 119.231 -2.168 . . . . 1.0 109.857 174.399 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 37.0 mt-10 -101.97 132.78 47.59 Favored 'General case' 0 N--CA 1.431 -1.419 0 C-N-CA 125.012 1.325 . . . . 1.0 109.157 -178.605 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 3.6 tp -112.48 113.59 44.57 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.449 0 CA-C-O 123.792 1.758 . . . . 1.0 106.379 175.756 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -136.42 99.08 3.99 Favored 'General case' 0 N--CA 1.43 -1.45 0 CA-C-N 114.578 -1.192 . . . . 1.0 111.219 -177.849 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . 71.77 26.24 73.25 Favored Glycine 0 N--CA 1.429 -1.774 0 O-C-N 120.251 -1.531 . . . . 1.0 116.34 164.395 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 86.95 20.71 52.76 Favored Glycine 0 N--CA 1.43 -1.752 0 C-N-CA 123.798 0.713 . . . . 1.0 112.889 -173.785 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 84.9 t -125.08 131.48 72.45 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.394 0 N-CA-C 105.815 -1.921 . . . . 1.0 105.815 173.068 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 42.5 mt -102.6 132.25 48.82 Favored 'General case' 0 N--CA 1.431 -1.398 0 CA-C-O 122.56 1.172 . . . . 1.0 109.615 165.785 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -118.13 124.62 48.45 Favored 'General case' 0 N--CA 1.43 -1.427 0 N-CA-C 106.724 -1.584 . . . . 1.0 106.724 171.392 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 69.7 mt -101.42 121.57 52.48 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.475 0 N-CA-C 108.406 -0.961 . . . . 1.0 108.406 -173.626 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 20.2 p -123.72 118.51 27.38 Favored 'General case' 0 N--CA 1.431 -1.397 0 N-CA-C 113.942 1.09 . . . . 1.0 113.942 -173.439 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 43' ' ' PHE . . . . . . . . . . . . . 3.0 p90 -123.32 169.82 10.93 Favored 'General case' 0 N--CA 1.43 -1.44 0 C-N-CA 126.015 1.726 . . . . 1.0 114.088 174.674 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 7.5 mm-40 -53.34 -32.71 50.42 Favored 'General case' 0 N--CA 1.43 -1.441 0 N-CA-C 118.129 2.64 . . . . 1.0 118.129 -174.44 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -66.78 -12.99 60.89 Favored 'General case' 0 N--CA 1.43 -1.449 0 O-C-N 120.478 -1.389 . . . . 1.0 113.527 -179.715 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 100.96 -14.37 58.68 Favored Glycine 0 N--CA 1.43 -1.755 0 O-C-N 120.791 -1.193 . . . . 1.0 113.425 166.008 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 4.3 m -77.09 168.75 19.55 Favored 'General case' 0 N--CA 1.43 -1.451 0 C-N-CA 124.615 1.166 . . . . 1.0 111.661 176.918 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 93.1 mttt -142.91 135.48 27.64 Favored 'General case' 0 N--CA 1.43 -1.451 0 O-C-N 121.03 -1.044 . . . . 1.0 111.154 -172.266 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 4.2 mm -101.36 137.31 29.46 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.414 0 N-CA-C 105.922 -1.881 . . . . 1.0 105.922 175.671 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 2.5 tp -128.06 124.83 63.44 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.469 0 CA-C-O 123.078 1.418 . . . . 1.0 109.687 -176.778 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 2.3 mt -127.45 118.03 48.47 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.496 0 C-N-CA 126.316 1.846 . . . . 1.0 111.906 -172.858 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 48.6 t30 -157.75 171.42 20.34 Favored 'General case' 0 N--CA 1.431 -1.418 0 C-N-CA 127.022 2.129 . . . . 1.0 107.792 -176.305 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -136.74 161.17 36.68 Favored 'General case' 0 N--CA 1.43 -1.474 0 C-N-CA 125.722 1.609 . . . . 1.0 114.547 -167.668 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 13.3 mm100 -108.09 129.03 55.17 Favored 'General case' 0 N--CA 1.429 -1.493 0 C-N-CA 125.998 1.719 . . . . 1.0 106.59 169.572 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 47.1 tt0 -60.69 -38.21 53.96 Favored Pre-proline 0 N--CA 1.428 -1.536 0 CA-C-O 117.132 -1.413 . . . . 1.0 114.528 164.481 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 51.9 Cg_exo -66.55 121.57 8.84 Favored 'Trans proline' 0 C--N 1.299 -2.056 0 CA-C-N 124.97 2.811 . . . . 1.0 113.745 160.716 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . 0.381 5.0 mp 75.3 131.9 0.05 OUTLIER 'General case' 0 N--CA 1.43 -1.43 0 CA-C-O 124.944 2.306 . . . . 1.0 116.336 -179.041 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 29.1 m80 -79.98 55.85 2.22 Favored 'General case' 0 N--CA 1.429 -1.502 0 C-N-CA 126.358 1.863 . . . . 1.0 114.144 -172.661 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -144.06 147.37 33.71 Favored 'General case' 0 N--CA 1.43 -1.453 0 C-N-CA 126.112 1.765 . . . . 1.0 110.528 -178.279 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 43.3 t -121.09 151.16 24.1 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.431 0 O-C-N 120.484 -1.385 . . . . 1.0 109.457 -175.372 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 61' ' ' TRP . . . . . 0.422 ' HA ' ' HA ' ' A' ' 70' ' ' HIS . 0.0 OUTLIER -88.77 152.87 21.51 Favored 'General case' 0 N--CA 1.43 -1.461 0 O-C-N 119.65 -1.906 . . . . 1.0 114.533 -178.565 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 80.6 mt -116.17 93.89 4.42 Favored 'General case' 0 N--CA 1.43 -1.444 0 N-CA-C 106.594 -1.632 . . . . 1.0 106.594 162.422 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -92.96 100.18 12.68 Favored 'General case' 0 N--CA 1.43 -1.429 0 CA-C-O 123.26 1.505 . . . . 1.0 109.872 169.016 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 64' ' ' THR . . . . . . . . . . . . . 3.0 m -111.33 -113.51 0.32 Allowed 'General case' 0 N--CA 1.429 -1.509 0 N-CA-C 106.691 -1.596 . . . . 1.0 106.691 -171.909 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 13.3 tmtt? -82.81 -45.59 14.13 Favored 'General case' 0 N--CA 1.43 -1.45 0 O-C-N 119.745 -1.847 . . . . 1.0 111.01 174.452 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 17.5 mp0 -74.59 -27.02 60.3 Favored 'General case' 0 N--CA 1.43 -1.469 0 N-CA-C 116.099 1.888 . . . . 1.0 116.099 -166.475 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 117.48 26.24 2.94 Favored Glycine 0 N--CA 1.43 -1.752 0 N-CA-C 117.133 1.613 . . . . 1.0 117.133 166.074 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 115.51 74.59 0.58 Allowed Glycine 0 N--CA 1.43 -1.752 0 CA-C-N 119.569 1.685 . . . . 1.0 115.735 165.185 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 18.2 m-30 -102.07 116.67 33.18 Favored 'General case' 0 N--CA 1.43 -1.468 0 N-CA-C 106.858 -1.534 . . . . 1.0 106.858 178.299 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 70' ' ' HIS . . . . . 0.422 ' HA ' ' HA ' ' A' ' 61' ' ' TRP . 40.8 p-80 -81.68 157.51 24.59 Favored 'General case' 0 N--CA 1.43 -1.468 0 O-C-N 119.802 -1.811 . . . . 1.0 113.891 -179.33 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -116.09 129.76 56.49 Favored 'General case' 0 N--CA 1.43 -1.45 0 N-CA-C 113.375 0.879 . . . . 1.0 113.375 -176.193 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 7.1 m-20 -112.32 179.39 4.0 Favored 'General case' 0 N--CA 1.431 -1.382 0 N-CA-C 107.28 -1.378 . . . . 1.0 107.28 172.483 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 26.3 tp -113.3 106.93 15.2 Favored 'General case' 0 N--CA 1.43 -1.45 0 O-C-N 119.117 -2.239 . . . . 1.0 112.079 -174.957 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 2.8 ttpm? -70.81 -45.18 65.07 Favored 'General case' 0 N--CA 1.431 -1.421 0 O-C-N 119.647 -1.908 . . . . 1.0 113.3 168.024 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -170.51 -103.06 0.16 Allowed Glycine 0 N--CA 1.43 -1.735 0 O-C-N 120.365 -1.459 . . . . 1.0 112.184 177.996 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 40.7 m-20 -89.74 17.94 6.06 Favored 'General case' 0 N--CA 1.431 -1.42 0 O-C-N 120.676 -1.485 . . . . 1.0 111.623 179.698 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 9.2 tt0 -168.13 137.12 2.42 Favored 'General case' 0 N--CA 1.43 -1.467 0 N-CA-C 102.864 -3.013 . . . . 1.0 102.864 -163.676 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 78' ' ' TRP . . . . . . . . . . . . . 33.0 m95 -88.53 145.83 25.51 Favored 'General case' 0 N--CA 1.43 -1.469 0 CA-C-O 122.195 0.998 . . . . 1.0 108.822 -177.131 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 2.1 tt -114.1 130.79 67.7 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.47 0 C-N-CA 129.394 3.078 . . . . 1.0 104.587 -168.818 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 81.3 m -89.4 146.13 24.87 Favored 'General case' 0 N--CA 1.43 -1.472 0 O-C-N 120.679 -1.263 . . . . 1.0 113.483 -172.674 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 22.0 t70 -45.0 -53.69 7.44 Favored 'General case' 0 N--CA 1.431 -1.383 0 C-N-CA 128.27 2.628 . . . . 1.0 115.871 174.263 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 16.1 ptm180 -149.65 177.43 9.77 Favored 'General case' 0 N--CA 1.43 -1.431 0 O-C-N 120.677 -1.265 . . . . 1.0 110.19 -174.007 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 3.4 t 78.58 -73.47 0.07 Allowed 'General case' 0 N--CA 1.43 -1.439 0 C-N-CA 126.802 2.041 . . . . 1.0 113.026 -175.701 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -170.89 104.1 0.2 Allowed Glycine 0 N--CA 1.43 -1.719 0 N-CA-C 108.845 -1.702 . . . . 1.0 108.845 -176.131 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -63.41 105.26 0.73 Allowed 'General case' 0 N--CA 1.429 -1.513 0 N-CA-C 119.86 3.281 . . . . 1.0 119.86 -166.807 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -173.81 127.01 0.39 Allowed 'General case' 0 N--CA 1.43 -1.472 0 C-N-CA 124.718 1.207 . . . . 1.0 112.604 166.522 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 1.2 t80 -45.53 -89.5 0.0 OUTLIER 'General case' 0 N--CA 1.43 -1.44 0 N-CA-C 119.059 2.985 . . . . 1.0 119.059 178.187 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 88' ' ' TRP . . . . . . . . . . . . . 85.7 m95 -72.38 -26.07 61.75 Favored 'General case' 0 N--CA 1.43 -1.436 0 O-C-N 120.07 -1.644 . . . . 1.0 111.546 -166.702 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 6.8 m-20 -69.87 -45.73 67.07 Favored 'General case' 0 N--CA 1.43 -1.451 0 C-N-CA 125.476 1.51 . . . . 1.0 113.283 177.578 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 35.3 tp -69.66 -41.83 75.0 Favored 'General case' 0 N--CA 1.429 -1.521 0 O-C-N 119.557 -1.964 . . . . 1.0 111.523 176.278 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 33.5 tp -56.21 -40.75 74.53 Favored 'General case' 0 N--CA 1.429 -1.52 0 C-N-CA 124.846 1.258 . . . . 1.0 114.26 169.384 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 42.2 tt0 -55.24 -49.87 70.92 Favored 'General case' 0 N--CA 1.43 -1.461 0 C-N-CA 126.711 2.004 . . . . 1.0 112.021 172.379 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 2.1 mp0 -59.96 -46.88 87.98 Favored 'General case' 0 N--CA 1.43 -1.431 0 O-C-N 120.205 -1.559 . . . . 1.0 114.649 173.773 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -62.87 -42.18 99.67 Favored 'General case' 0 N--CA 1.43 -1.456 0 N-CA-C 115.068 1.507 . . . . 1.0 115.068 177.833 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -80.2 -37.37 33.32 Favored 'General case' 0 N--CA 1.429 -1.497 0 O-C-N 120.268 -1.52 . . . . 1.0 114.043 -179.472 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 23.2 p -58.52 -38.51 77.87 Favored 'General case' 0 N--CA 1.43 -1.452 0 CA-C-N 120.663 1.574 . . . . 1.0 112.335 170.574 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 34.1 tp60 -59.44 -61.58 2.52 Favored 'General case' 0 N--CA 1.429 -1.484 0 C-N-CA 124.837 1.255 . . . . 1.0 113.354 172.425 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 4.4 mm-40 -64.25 -43.4 95.01 Favored 'General case' 0 N--CA 1.429 -1.496 0 N-CA-C 116.145 1.906 . . . . 1.0 116.145 -179.038 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -77.45 -31.82 54.08 Favored 'General case' 0 CA--C 1.489 -1.386 0 O-C-N 120.644 -1.285 . . . . 1.0 113.427 -178.017 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . 98.26 16.63 31.81 Favored Glycine 0 N--CA 1.428 -1.857 0 C-N-CA 124.568 1.08 . . . . 1.0 115.537 169.735 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 16.4 pt-20 -168.05 174.86 7.01 Favored 'General case' 0 N--CA 1.428 -1.562 0 N-CA-C 108.204 -1.036 . . . . 1.0 108.204 -172.403 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 25.8 m -66.35 121.73 15.91 Favored 'General case' 0 N--CA 1.431 -1.385 0 O-C-N 120.645 -1.285 . . . . 1.0 112.569 -177.268 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 4.7 p -97.83 137.14 26.25 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.508 0 N-CA-C 106.046 -1.835 . . . . 1.0 106.046 179.391 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 2.8 t -117.07 78.88 1.26 Allowed 'General case' 0 N--CA 1.431 -1.396 0 O-C-N 121.181 -0.949 . . . . 1.0 112.161 -162.638 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 61.9 m-85 -103.03 -35.55 8.5 Favored 'General case' 0 N--CA 1.429 -1.486 0 O-C-N 120.06 -1.65 . . . . 1.0 110.306 174.458 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 22.6 mtm180 . . . . . 0 C--O 1.259 1.598 0 C-N-CA 123.411 0.685 . . . . 1.0 110.043 -172.597 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 56.0 m-80 . . . . . 0 N--CA 1.43 -1.471 0 CA-C-O 122.491 1.139 . . . . 1.0 112.647 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 8.3 p-10 -73.48 -29.2 62.37 Favored 'General case' 0 N--CA 1.43 -1.474 0 C-N-CA 125.19 1.396 . . . . 1.0 112.433 175.786 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 48.3 p -58.66 -52.17 66.84 Favored 'General case' 0 N--CA 1.43 -1.459 0 C-N-CA 125.762 1.625 . . . . 1.0 113.151 168.752 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 95.6 mt-10 -54.31 -54.07 45.34 Favored 'General case' 0 N--CA 1.428 -1.555 0 C-N-CA 126.822 2.049 . . . . 1.0 112.573 172.037 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 43.0 t80 -48.69 -46.94 41.14 Favored 'General case' 0 N--CA 1.429 -1.49 0 N-CA-C 115.343 1.609 . . . . 1.0 115.343 172.728 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 18.0 m170 -60.98 -51.54 68.83 Favored 'General case' 0 N--CA 1.43 -1.428 0 N-CA-C 113.838 1.051 . . . . 1.0 113.838 175.884 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 94.7 mtt180 -61.45 -40.61 95.12 Favored 'General case' 0 N--CA 1.429 -1.493 0 O-C-N 120.542 -1.349 . . . . 1.0 113.92 -179.724 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 72.5 mt -64.33 -45.35 88.23 Favored 'General case' 0 N--CA 1.43 -1.469 0 C-N-CA 125.402 1.481 . . . . 1.0 112.795 173.107 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -60.3 -51.04 71.23 Favored 'General case' 0 N--CA 1.43 -1.459 0 C-N-CA 125.898 1.679 . . . . 1.0 113.641 -179.407 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 -56.64 -49.21 75.68 Favored 'General case' 0 N--CA 1.429 -1.487 0 C-N-CA 124.267 1.027 . . . . 1.0 112.207 172.818 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . 0.315 5.9 pt20 -63.82 -44.73 92.38 Favored 'General case' 0 N--CA 1.431 -1.408 0 O-C-N 120.091 -1.631 . . . . 1.0 115.108 178.705 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 4.2 pp -65.34 -36.7 84.84 Favored 'General case' 0 N--CA 1.43 -1.469 0 CA-C-N 121.375 1.898 . . . . 1.0 115.019 -179.011 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 29.6 m0 -54.9 -60.41 3.4 Favored 'General case' 0 N--CA 1.43 -1.461 0 N-CA-C 113.507 0.929 . . . . 1.0 113.507 166.683 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 35.2 mt -63.67 -33.75 76.32 Favored 'General case' 0 N--CA 1.431 -1.413 0 CA-C-N 120.561 1.528 . . . . 1.0 114.593 -178.416 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 86.0 m -54.86 -59.98 3.99 Favored 'General case' 0 N--CA 1.431 -1.416 0 C-N-CA 125.475 1.51 . . . . 1.0 111.98 173.771 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 38.9 mm -62.12 -39.12 82.71 Favored 'Isoleucine or valine' 0 CA--C 1.489 -1.374 0 N-CA-C 114.596 1.332 . . . . 1.0 114.596 176.844 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 95.4 mt-10 -51.55 -52.33 48.05 Favored 'General case' 0 N--CA 1.43 -1.434 0 CA-C-N 121.434 1.925 . . . . 1.0 113.281 171.529 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 2.4 tp10 -65.4 -36.58 84.38 Favored 'General case' 0 N--CA 1.429 -1.489 0 N-CA-C 114.246 1.202 . . . . 1.0 114.246 -179.819 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 49.8 ttt-85 -54.0 -51.03 65.24 Favored 'General case' 0 N--CA 1.43 -1.465 0 O-C-N 120.793 -1.192 . . . . 1.0 113.053 170.521 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -70.07 -45.05 67.85 Favored 'General case' 0 N--CA 1.43 -1.436 0 N-CA-C 113.085 0.772 . . . . 1.0 113.085 178.302 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 34.8 t0 -55.18 -44.56 75.36 Favored 'General case' 0 N--CA 1.43 -1.449 0 C-N-CA 125.122 1.369 . . . . 1.0 114.075 178.987 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 32.1 t70 -71.04 -28.73 64.6 Favored 'General case' 0 N--CA 1.431 -1.409 0 O-C-N 120.052 -1.655 . . . . 1.0 113.472 177.678 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 24' ' ' TRP . . . . . . . . . . . . . 37.3 t-105 -71.28 149.33 46.26 Favored 'General case' 0 N--CA 1.43 -1.462 0 O-C-N 120.063 -1.648 . . . . 1.0 112.897 -177.831 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 6.8 m-20 -151.66 163.02 40.02 Favored 'General case' 0 N--CA 1.429 -1.488 0 N-CA-C 104.002 -2.592 . . . . 1.0 104.002 163.543 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -161.27 -132.6 1.36 Allowed Glycine 0 N--CA 1.43 -1.72 0 O-C-N 120.622 -1.299 . . . . 1.0 111.417 176.565 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -68.3 -32.6 72.86 Favored 'General case' 0 N--CA 1.43 -1.437 0 O-C-N 121.466 -1.02 . . . . 1.0 110.347 171.743 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 79.9 p -112.86 172.48 6.91 Favored 'General case' 0 N--CA 1.43 -1.452 0 C-N-CA 124.347 1.059 . . . . 1.0 111.212 177.046 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 2.9 t70 -96.12 -168.94 1.83 Allowed 'General case' 0 N--CA 1.43 -1.462 0 C-N-CA 124.811 1.244 . . . . 1.0 110.28 179.091 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 7.1 tp -163.37 119.73 0.15 Allowed 'Isoleucine or valine' 0 N--CA 1.43 -1.456 0 O-C-N 120.502 -1.374 . . . . 1.0 110.652 -169.19 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 37.7 t0 -135.84 108.25 7.35 Favored 'General case' 0 N--CA 1.43 -1.432 0 O-C-N 119.86 -1.775 . . . . 1.0 110.533 169.407 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 33.7 t -81.33 143.97 31.83 Favored 'General case' 0 N--CA 1.43 -1.438 0 O-C-N 119.033 -2.292 . . . . 1.0 112.049 173.012 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 33.4 mt-10 -90.16 139.22 30.84 Favored 'General case' 0 N--CA 1.43 -1.445 0 O-C-N 120.403 -1.436 . . . . 1.0 109.13 168.765 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 3.9 mp -126.28 105.68 14.75 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.425 0 N-CA-C 104.853 -2.277 . . . . 1.0 104.853 173.927 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 48.6 t30 -132.75 76.64 1.7 Allowed 'General case' 0 N--CA 1.429 -1.48 0 C-N-CA 124.882 1.273 . . . . 1.0 110.849 -167.171 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . 78.75 -73.15 2.31 Favored Glycine 0 N--CA 1.43 -1.754 0 O-C-N 120.963 -1.086 . . . . 1.0 115.453 167.343 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -142.93 27.53 2.17 Favored Glycine 0 N--CA 1.431 -1.684 0 C-N-CA 124.906 1.241 . . . . 1.0 110.432 172.116 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 76.4 t -125.44 136.22 61.54 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.419 0 C-N-CA 125.313 1.445 . . . . 1.0 107.198 177.216 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 72.7 mt -109.62 136.66 48.63 Favored 'General case' 0 N--CA 1.43 -1.431 0 N-CA-C 107.084 -1.45 . . . . 1.0 107.084 155.684 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -138.55 111.04 7.51 Favored 'General case' 0 N--CA 1.431 -1.393 0 N-CA-C 106.035 -1.839 . . . . 1.0 106.035 178.368 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 67.9 mt -89.74 126.35 42.65 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.432 0 O-C-N 120.32 -1.488 . . . . 1.0 109.684 -171.097 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 28.3 p -119.85 126.35 50.76 Favored 'General case' 0 N--CA 1.43 -1.435 0 CA-C-O 121.728 0.775 . . . . 1.0 113.004 179.896 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 43' ' ' PHE . . . . . . . . . . . . . 1.0 OUTLIER -122.96 170.27 10.3 Favored 'General case' 0 N--CA 1.43 -1.444 0 O-C-N 120.27 -1.519 . . . . 1.0 112.302 169.909 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 4.4 mm-40 -48.41 -36.75 15.38 Favored 'General case' 0 N--CA 1.429 -1.488 0 N-CA-C 118.557 2.799 . . . . 1.0 118.557 -171.439 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 47.1 m-80 -68.86 -6.0 24.52 Favored 'General case' 0 N--CA 1.43 -1.474 0 N-CA-C 115.535 1.68 . . . . 1.0 115.535 179.716 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 80.24 30.54 41.27 Favored Glycine 0 N--CA 1.43 -1.757 0 O-C-N 120.579 -1.325 . . . . 1.0 112.791 172.142 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 51.0 m -127.12 149.52 49.91 Favored 'General case' 0 N--CA 1.43 -1.46 0 N-CA-C 105.168 -2.16 . . . . 1.0 105.168 -177.571 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 22.8 pttm -140.53 159.07 43.0 Favored 'General case' 0 N--CA 1.431 -1.404 0 N-CA-C 113.826 1.047 . . . . 1.0 113.826 -165.136 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 12.7 mm -110.61 138.56 38.1 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.471 0 N-CA-C 106.195 -1.78 . . . . 1.0 106.195 177.1 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 5.5 mm -120.77 114.91 45.3 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.414 0 CA-C-N 119.937 1.244 . . . . 1.0 110.787 -173.562 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER -125.68 89.26 1.39 Allowed 'Isoleucine or valine' 0 N--CA 1.43 -1.459 0 C-N-CA 126.187 1.795 . . . . 1.0 110.468 -172.565 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 51.3 m-20 -114.25 161.74 17.46 Favored 'General case' 0 N--CA 1.43 -1.448 0 C-N-CA 128.725 2.81 . . . . 1.0 110.239 178.545 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -154.31 151.54 29.22 Favored 'General case' 0 N--CA 1.43 -1.455 0 O-C-N 119.91 -1.744 . . . . 1.0 112.319 -168.666 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -100.33 144.17 29.65 Favored 'General case' 0 N--CA 1.43 -1.433 0 CA-C-O 123.426 1.584 . . . . 1.0 108.192 174.977 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 54.3 mt-10 -70.75 -63.55 1.56 Allowed Pre-proline 0 N--CA 1.431 -1.418 0 CA-C-O 116.034 -1.936 . . . . 1.0 114.479 172.163 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 87.3 Cg_endo -78.85 157.9 27.58 Favored 'Trans proline' 0 C--N 1.3 -1.984 0 CA-C-N 126.135 3.227 . . . . 1.0 112.622 169.959 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . 0.409 5.1 mp 72.18 134.94 0.04 OUTLIER 'General case' 0 N--CA 1.43 -1.456 0 C-N-CA 127.266 2.226 . . . . 1.0 113.588 -165.616 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 17.5 m170 -83.8 50.77 1.88 Allowed 'General case' 0 N--CA 1.431 -1.411 0 O-C-N 120.668 -1.27 . . . . 1.0 112.853 -172.596 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -152.28 158.95 43.51 Favored 'General case' 0 N--CA 1.43 -1.428 0 O-C-N 120.382 -1.449 . . . . 1.0 109.43 -178.401 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 38.2 t -126.5 161.63 32.28 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.438 0 C-N-CA 125.528 1.531 . . . . 1.0 108.55 -169.182 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 61' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -93.52 154.78 17.7 Favored 'General case' 0 N--CA 1.431 -1.413 0 O-C-N 118.792 -2.443 . . . . 1.0 111.028 177.3 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -142.5 101.41 3.88 Favored 'General case' 0 N--CA 1.431 -1.409 0 O-C-N 118.362 -2.711 . . . . 1.0 112.687 169.55 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -112.22 149.62 32.03 Favored 'General case' 0 N--CA 1.43 -1.467 0 O-C-N 119.494 -2.003 . . . . 1.0 114.61 174.313 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 64' ' ' THR . . . . . . . . . . . . . 95.1 m -151.89 -87.12 0.07 Allowed 'General case' 0 N--CA 1.43 -1.436 0 C-N-CA 126.186 1.794 . . . . 1.0 109.977 -179.891 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -131.23 -54.77 1.04 Allowed 'General case' 0 N--CA 1.43 -1.445 0 O-C-N 121.139 -0.976 . . . . 1.0 113.184 -170.556 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 58.8 mt-30 -71.08 -24.75 62.38 Favored 'General case' 0 N--CA 1.431 -1.418 0 N-CA-C 114.639 1.348 . . . . 1.0 114.639 -171.003 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 177.09 -40.42 0.1 OUTLIER Glycine 0 N--CA 1.429 -1.811 0 C-N-CA 117.753 -2.165 . . . . 1.0 115.588 174.207 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 98.8 106.62 2.65 Favored Glycine 0 N--CA 1.43 -1.745 0 CA-C-O 122.557 1.087 . . . . 1.0 111.978 -173.96 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 69' ' ' TYR . . . . . 0.415 ' CD1' ' HG3' ' A' ' 82' ' ' ARG . 14.8 m-85 -128.5 135.77 49.89 Favored 'General case' 0 N--CA 1.43 -1.459 0 N-CA-C 105.802 -1.925 . . . . 1.0 105.802 -167.939 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 70' ' ' HIS . . . . . 0.466 ' HE1' ' OD2' ' A' ' 81' ' ' ASP . 27.2 p80 -83.42 159.8 21.71 Favored 'General case' 0 N--CA 1.43 -1.467 0 O-C-N 119.826 -1.796 . . . . 1.0 112.881 179.905 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 71' ' ' PHE . . . . . . . . . . . . 0.321 24.5 t80 -117.9 112.46 20.37 Favored 'General case' 0 N--CA 1.43 -1.428 0 C-N-CA 127.653 2.381 . . . . 1.0 105.185 -156.875 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -126.45 165.55 18.88 Favored 'General case' 0 N--CA 1.431 -1.394 0 N-CA-C 107.574 -1.269 . . . . 1.0 107.574 -169.689 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 51.4 tp -112.06 124.81 53.21 Favored 'General case' 0 N--CA 1.43 -1.451 0 O-C-N 119.528 -1.982 . . . . 1.0 110.434 -169.963 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 6.2 tmtt? -74.64 -58.73 3.1 Favored 'General case' 0 N--CA 1.429 -1.478 0 O-C-N 121.322 -0.861 . . . . 1.0 109.599 162.277 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -179.3 -61.65 0.07 OUTLIER Glycine 0 N--CA 1.43 -1.716 0 O-C-N 121.098 -1.001 . . . . 1.0 111.551 179.033 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 24.1 t0 -99.32 -18.21 17.66 Favored 'General case' 0 N--CA 1.43 -1.425 0 C-N-CA 126.108 1.763 . . . . 1.0 110.141 179.075 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 1.1 tp10 -130.09 128.43 41.86 Favored 'General case' 0 N--CA 1.431 -1.415 0 N-CA-C 103.377 -2.823 . . . . 1.0 103.377 -170.711 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 78' ' ' TRP . . . . . . . . . . . . . 91.7 m95 -77.47 129.55 35.87 Favored 'General case' 0 N--CA 1.429 -1.481 0 N-CA-C 105.364 -2.088 . . . . 1.0 105.364 162.498 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -131.34 153.24 38.65 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.377 0 O-C-N 119.976 -1.703 . . . . 1.0 106.865 -173.876 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 5.2 m -80.55 132.37 35.65 Favored 'General case' 0 N--CA 1.429 -1.488 0 O-C-N 119.873 -1.767 . . . . 1.0 112.922 -172.378 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 81' ' ' ASP . . . . . 0.466 ' OD2' ' HE1' ' A' ' 70' ' ' HIS . 24.0 t70 -86.61 62.8 7.63 Favored 'General case' 0 N--CA 1.431 -1.42 0 O-C-N 118.928 -2.357 . . . . 1.0 110.932 177.32 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 82' ' ' ARG . . . . . 0.415 ' HG3' ' CD1' ' A' ' 69' ' ' TYR . 0.2 OUTLIER -155.71 -135.73 0.05 OUTLIER 'General case' 0 N--CA 1.43 -1.441 0 O-C-N 120.608 -1.307 . . . . 1.0 111.858 -176.027 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 35.1 p -86.0 -12.44 50.32 Favored 'General case' 0 N--CA 1.428 -1.551 0 O-C-N 119.347 -2.096 . . . . 1.0 113.887 -170.524 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -161.93 92.32 0.11 Allowed Glycine 0 N--CA 1.429 -1.768 0 O-C-N 120.684 -1.26 . . . . 1.0 113.331 -177.534 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 8.2 pt-20 -77.55 113.41 15.35 Favored 'General case' 0 N--CA 1.431 -1.398 0 N-CA-C 119.014 2.968 . . . . 1.0 119.014 -169.845 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 86.1 m -174.46 125.25 0.31 Allowed 'General case' 0 N--CA 1.431 -1.422 0 C-N-CA 126.315 1.846 . . . . 1.0 110.574 161.775 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 2.0 t80 -52.77 -84.21 0.01 OUTLIER 'General case' 0 N--CA 1.429 -1.508 0 N-CA-C 115.378 1.621 . . . . 1.0 115.378 170.265 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 88' ' ' TRP . . . . . . . . . . . . . 56.0 m95 -58.95 -29.43 67.15 Favored 'General case' 0 N--CA 1.43 -1.445 0 N-CA-C 116.283 1.957 . . . . 1.0 116.283 -166.1 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 24.0 m-20 -76.99 -41.35 43.25 Favored 'General case' 0 N--CA 1.429 -1.479 0 C-N-CA 124.489 1.116 . . . . 1.0 112.254 175.668 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 41.9 tp -69.65 -43.23 73.03 Favored 'General case' 0 N--CA 1.43 -1.425 0 O-C-N 119.521 -1.987 . . . . 1.0 111.88 176.249 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 2.6 tm? -48.38 -50.69 29.71 Favored 'General case' 0 N--CA 1.43 -1.471 0 C-N-CA 128.941 2.896 . . . . 1.0 113.08 172.608 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 37.5 tt0 -51.66 -54.44 27.96 Favored 'General case' 0 N--CA 1.431 -1.423 0 C-N-CA 125.823 1.649 . . . . 1.0 114.547 166.852 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 4.1 tt0 -58.5 -44.73 89.54 Favored 'General case' 0 N--CA 1.43 -1.471 0 N-CA-C 114.372 1.249 . . . . 1.0 114.372 179.929 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -58.75 -48.49 81.03 Favored 'General case' 0 N--CA 1.431 -1.412 0 C-N-CA 127.53 2.332 . . . . 1.0 113.554 174.895 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -64.89 -46.56 81.24 Favored 'General case' 0 N--CA 1.429 -1.483 0 O-C-N 119.426 -2.046 . . . . 1.0 113.131 176.191 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 96.5 m -53.61 -48.89 68.87 Favored 'General case' 0 N--CA 1.431 -1.409 0 C-N-CA 127.224 2.21 . . . . 1.0 114.176 174.037 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 2.1 pt20 -70.18 -28.02 64.98 Favored 'General case' 0 N--CA 1.43 -1.45 0 O-C-N 121.061 -1.025 . . . . 1.0 113.607 -178.911 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 15.7 mm-40 -75.91 -39.02 57.13 Favored 'General case' 0 N--CA 1.43 -1.459 0 N-CA-C 114.309 1.226 . . . . 1.0 114.309 171.988 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -85.85 -46.58 10.49 Favored 'General case' 0 N--CA 1.43 -1.461 0 O-C-N 120.229 -1.545 . . . . 1.0 114.963 -176.436 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . 91.28 43.25 4.7 Favored Glycine 0 N--CA 1.43 -1.745 0 O-C-N 120.418 -1.426 . . . . 1.0 112.55 -170.825 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 18.6 tt0 -170.04 145.75 2.93 Favored 'General case' 0 N--CA 1.43 -1.455 0 N-CA-C 103.712 -2.699 . . . . 1.0 103.712 -172.865 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 13.4 m -74.49 99.95 3.72 Favored 'General case' 0 N--CA 1.429 -1.484 0 CA-C-N 121.792 2.087 . . . . 1.0 111.033 179.282 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 12.2 t -95.36 84.1 1.55 Allowed 'Isoleucine or valine' 0 N--CA 1.432 -1.362 0 CA-C-O 124.231 1.967 . . . . 1.0 107.953 178.769 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 8.2 t -92.36 177.07 6.25 Favored 'General case' 0 N--CA 1.43 -1.438 0 C-N-CA 125.718 1.607 . . . . 1.0 112.695 -168.259 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 30.8 t80 -138.58 -29.32 0.8 Allowed 'General case' 0 N--CA 1.43 -1.434 0 O-C-N 120.83 -1.169 . . . . 1.0 111.04 156.83 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 89.1 mtt180 . . . . . 0 C--O 1.26 1.634 0 O-C-N 120.368 -1.457 . . . . 1.0 110.437 179.27 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 91.9 m-20 . . . . . 0 N--CA 1.431 -1.416 0 CA-C-O 121.843 0.83 . . . . 1.0 109.995 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 22.5 m-20 -65.78 -39.16 90.72 Favored 'General case' 0 N--CA 1.429 -1.477 0 C-N-CA 125.272 1.429 . . . . 1.0 113.581 179.131 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 8.6 t -65.07 -43.29 92.7 Favored 'General case' 0 N--CA 1.43 -1.473 0 O-C-N 120.951 -1.093 . . . . 1.0 111.786 -178.854 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 14.0 mt-10 -58.36 -60.83 3.16 Favored 'General case' 0 N--CA 1.429 -1.483 0 C-N-CA 124.694 1.197 . . . . 1.0 112.364 171.148 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 1.1 t80 -53.26 -38.48 63.06 Favored 'General case' 0 N--CA 1.43 -1.425 0 N-CA-C 115.911 1.819 . . . . 1.0 115.911 179.229 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 2.5 m-70 -61.18 -50.56 72.66 Favored 'General case' 0 N--CA 1.43 -1.439 0 N-CA-C 115.524 1.676 . . . . 1.0 115.524 170.224 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 23.1 ttm180 -67.81 -45.38 74.91 Favored 'General case' 0 N--CA 1.43 -1.47 0 C-N-CA 124.17 0.988 . . . . 1.0 112.207 -176.106 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 83.4 mt -55.26 -45.59 76.12 Favored 'General case' 0 N--CA 1.43 -1.464 0 C-N-CA 126.507 1.923 . . . . 1.0 113.611 172.367 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -56.84 -55.49 33.77 Favored 'General case' 0 N--CA 1.43 -1.467 0 C-N-CA 125.27 1.428 . . . . 1.0 113.152 173.949 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -56.3 -43.53 79.01 Favored 'General case' 0 N--CA 1.431 -1.415 0 C-N-CA 124.228 1.011 . . . . 1.0 112.617 -176.05 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 28.3 mm100 -63.4 -53.86 45.76 Favored 'General case' 0 N--CA 1.43 -1.441 0 N-CA-C 115.165 1.542 . . . . 1.0 115.165 173.846 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 2.4 pp -65.2 -47.18 77.79 Favored 'General case' 0 N--CA 1.43 -1.443 0 O-C-N 120.387 -1.446 . . . . 1.0 114.272 -177.697 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 39.8 m0 -52.87 -50.04 64.61 Favored 'General case' 0 N--CA 1.43 -1.468 0 C-N-CA 126.953 2.101 . . . . 1.0 113.447 174.256 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 44.0 tp -60.79 -49.34 77.87 Favored 'General case' 0 N--CA 1.429 -1.517 0 C-N-CA 123.651 0.78 . . . . 1.0 112.719 177.49 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 36.5 m -59.11 -53.15 61.63 Favored 'General case' 0 N--CA 1.431 -1.398 0 C-N-CA 125.818 1.647 . . . . 1.0 113.276 -178.676 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 78.8 mt -57.64 -54.1 35.87 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.464 0 C-N-CA 125.839 1.656 . . . . 1.0 114.169 174.989 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 31.8 tt0 -60.18 -48.42 81.82 Favored 'General case' 0 N--CA 1.429 -1.496 0 CA-C-N 120.072 1.306 . . . . 1.0 113.117 -177.774 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 42.9 tt0 -57.85 -48.57 79.41 Favored 'General case' 0 N--CA 1.429 -1.511 0 C-N-CA 125.102 1.361 . . . . 1.0 114.164 178.144 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -71.15 -29.64 65.48 Favored 'General case' 0 N--CA 1.43 -1.456 0 N-CA-C 113.056 0.761 . . . . 1.0 113.056 -177.548 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 5.3 tp -67.14 -50.92 59.59 Favored 'General case' 0 N--CA 1.43 -1.446 0 O-C-N 120.919 -1.113 . . . . 1.0 112.597 171.393 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 11.3 t70 -62.31 -36.42 82.1 Favored 'General case' 0 N--CA 1.429 -1.507 0 O-C-N 121.023 -1.048 . . . . 1.0 112.889 -177.425 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 21.2 t0 -90.81 21.89 3.88 Favored 'General case' 0 N--CA 1.43 -1.438 0 O-C-N 120.486 -1.384 . . . . 1.0 113.847 177.515 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 24' ' ' TRP . . . . . . . . . . . . . 47.0 t-105 -84.56 -59.7 2.29 Favored 'General case' 0 N--CA 1.43 -1.452 0 O-C-N 119.025 -2.297 . . . . 1.0 113.691 -179.445 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 7.0 t70 67.03 -132.0 0.14 Allowed 'General case' 0 N--CA 1.43 -1.453 0 C-N-CA 126.784 2.034 . . . . 1.0 112.603 -176.32 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 93.1 -138.38 14.09 Favored Glycine 0 N--CA 1.43 -1.709 0 O-C-N 120.737 -1.227 . . . . 1.0 112.691 176.116 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -82.23 -26.27 33.4 Favored 'General case' 0 N--CA 1.429 -1.489 0 O-C-N 120.592 -1.534 . . . . 1.0 109.79 172.589 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 4.4 p -75.36 144.27 42.4 Favored 'General case' 0 N--CA 1.429 -1.498 0 C-N-CA 126.506 1.923 . . . . 1.0 114.434 174.642 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 13.8 t70 -104.36 138.43 40.8 Favored 'General case' 0 N--CA 1.43 -1.469 0 N-CA-C 104.137 -2.542 . . . . 1.0 104.137 162.925 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -146.15 115.48 1.47 Allowed 'Isoleucine or valine' 0 N--CA 1.429 -1.481 0 CA-C-O 122.84 1.305 . . . . 1.0 108.62 -157.653 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 13.8 m-20 -126.47 143.3 51.24 Favored 'General case' 0 N--CA 1.429 -1.493 0 C-N-CA 124.103 0.961 . . . . 1.0 109.291 168.625 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 17.8 t -109.67 149.9 29.05 Favored 'General case' 0 N--CA 1.43 -1.432 0 O-C-N 119.832 -1.793 . . . . 1.0 108.203 164.627 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 17.2 mt-10 -113.65 142.39 46.06 Favored 'General case' 0 N--CA 1.429 -1.511 0 O-C-N 120.829 -1.169 . . . . 1.0 108.113 176.822 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 3.3 tp -122.47 110.34 26.62 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.484 0 CA-C-O 124.086 1.898 . . . . 1.0 107.259 -178.099 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 48.3 m-80 -108.95 73.75 0.87 Allowed 'General case' 0 N--CA 1.431 -1.396 0 CA-C-N 114.477 -1.238 . . . . 1.0 109.088 176.677 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . 73.35 -7.65 11.3 Favored Glycine 0 N--CA 1.43 -1.761 0 N-CA-C 117.618 1.807 . . . . 1.0 117.618 171.503 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 151.91 -33.7 0.87 Allowed Glycine 0 N--CA 1.43 -1.764 0 N-CA-C 109.127 -1.589 . . . . 1.0 109.127 -168.734 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 64.7 t -79.27 105.94 9.47 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.43 0 O-C-N 120.397 -1.649 . . . . 1.0 109.595 175.5 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 18.5 mt -94.8 129.16 41.87 Favored 'General case' 0 N--CA 1.43 -1.464 0 CA-C-O 123.074 1.416 . . . . 1.0 110.206 175.667 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 18.6 p -126.52 121.89 33.61 Favored 'General case' 0 N--CA 1.43 -1.455 0 N-CA-C 107.358 -1.349 . . . . 1.0 107.358 -179.713 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 74.2 mt -97.2 122.28 48.59 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.479 0 C-N-CA 124.721 1.208 . . . . 1.0 109.32 -169.866 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 21.8 p -123.74 108.38 12.46 Favored 'General case' 0 N--CA 1.431 -1.396 0 N-CA-C 114.863 1.431 . . . . 1.0 114.863 -171.55 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 43' ' ' PHE . . . . . . . . . . . . . 9.0 p90 -114.55 164.86 13.42 Favored 'General case' 0 N--CA 1.429 -1.49 0 O-C-N 119.633 -1.917 . . . . 1.0 113.894 178.75 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -61.76 -20.18 63.27 Favored 'General case' 0 N--CA 1.43 -1.442 0 C-N-CA 128.77 2.828 . . . . 1.0 118.371 -166.779 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 22.5 t30 -66.69 -15.08 63.26 Favored 'General case' 0 N--CA 1.429 -1.491 0 C-N-CA 124.674 1.19 . . . . 1.0 113.618 173.583 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 101.48 -5.25 54.72 Favored Glycine 0 N--CA 1.431 -1.686 0 O-C-N 120.508 -1.37 . . . . 1.0 113.066 171.197 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 70.0 m -93.73 159.28 15.28 Favored 'General case' 0 N--CA 1.43 -1.425 0 O-C-N 121.467 -1.02 . . . . 1.0 111.33 178.493 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 24.0 pttm -142.29 140.08 32.08 Favored 'General case' 0 N--CA 1.429 -1.497 0 O-C-N 121.526 -0.734 . . . . 1.0 111.566 -178.784 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -108.45 143.95 17.88 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.453 0 C-N-CA 126.701 2.0 . . . . 1.0 107.572 179.549 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 9.7 mm -126.38 122.43 61.21 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.458 0 C-N-CA 124.227 1.011 . . . . 1.0 110.816 -163.33 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 3.7 mt -124.61 108.18 19.79 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.428 0 CA-C-O 123.328 1.537 . . . . 1.0 112.874 -179.77 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 52' ' ' ASN . . . . . 0.476 ' H ' ' HD1' ' A' ' 61' ' ' TRP . 29.1 m-80 -120.44 160.63 22.73 Favored 'General case' 0 N--CA 1.429 -1.481 0 C-N-CA 128.224 2.61 . . . . 1.0 108.445 173.497 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 10.3 ptt180 -141.68 140.21 33.15 Favored 'General case' 0 N--CA 1.43 -1.453 0 C-N-CA 124.713 1.205 . . . . 1.0 111.737 174.083 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 24.6 mm100 -110.02 114.46 28.01 Favored 'General case' 0 N--CA 1.431 -1.406 0 C-N-CA 126.004 1.722 . . . . 1.0 108.522 174.558 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 54.8 mt-10 -48.09 -47.48 65.37 Favored Pre-proline 0 N--CA 1.431 -1.414 0 N-CA-C 119.479 3.14 . . . . 1.0 119.479 -175.548 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 50.9 Cg_exo -73.01 -11.41 25.4 Favored 'Trans proline' 0 N--CA 1.434 -2.021 0 CA-C-N 126.022 3.186 . . . . 1.0 114.829 -175.468 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 38.5 mt -84.18 -39.67 19.09 Favored 'General case' 0 N--CA 1.43 -1.443 0 CA-C-N 119.269 0.941 . . . . 1.0 111.191 -174.977 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 19.8 m80 71.33 23.73 3.91 Favored 'General case' 0 CA--C 1.488 -1.433 0 C-N-CA 125.448 1.499 . . . . 1.0 113.866 -179.423 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 1.7 pt20 -131.32 156.58 45.24 Favored 'General case' 0 N--CA 1.429 -1.483 0 C-N-CA 127.898 2.479 . . . . 1.0 106.072 172.903 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 48.0 t -116.41 158.19 16.98 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.43 0 O-C-N 121.185 -0.947 . . . . 1.0 108.687 -171.732 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 61' ' ' TRP . . . . . 0.476 ' HD1' ' H ' ' A' ' 52' ' ' ASN . 0.0 OUTLIER -101.67 152.55 20.7 Favored 'General case' 0 N--CA 1.43 -1.436 0 O-C-N 119.831 -1.793 . . . . 1.0 114.194 176.018 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 93.7 mt -125.83 97.99 5.36 Favored 'General case' 0 N--CA 1.428 -1.55 0 C-N-CA 125.957 1.703 . . . . 1.0 109.056 164.71 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -94.49 141.75 28.23 Favored 'General case' 0 N--CA 1.43 -1.44 0 O-C-N 120.285 -1.509 . . . . 1.0 110.478 167.451 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 64' ' ' THR . . . . . . . . . . . . . 74.5 p -142.49 -119.71 0.1 Allowed 'General case' 0 N--CA 1.43 -1.452 0 C-N-CA 124.79 1.236 . . . . 1.0 108.223 -165.43 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 3.5 tmtt? -101.53 -40.83 6.85 Favored 'General case' 0 N--CA 1.431 -1.419 0 O-C-N 120.503 -1.373 . . . . 1.0 109.717 170.134 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 51.2 tt0 -74.22 -25.93 59.95 Favored 'General case' 0 N--CA 1.429 -1.484 0 N-CA-C 116.863 2.171 . . . . 1.0 116.863 -164.101 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 157.7 -34.99 0.54 Allowed Glycine 0 N--CA 1.43 -1.728 0 O-C-N 119.585 -1.947 . . . . 1.0 115.65 175.501 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 117.17 115.05 2.76 Favored Glycine 0 N--CA 1.429 -1.775 0 C-N-CA 125.625 1.583 . . . . 1.0 112.806 -179.19 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -104.34 142.81 33.9 Favored 'General case' 0 N--CA 1.43 -1.445 0 C-N-CA 125.498 1.519 . . . . 1.0 106.963 175.444 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 3.4 p-80 -109.25 152.79 24.74 Favored 'General case' 0 N--CA 1.43 -1.438 0 O-C-N 119.082 -2.262 . . . . 1.0 110.545 165.68 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 48.8 p90 -129.77 131.37 46.21 Favored 'General case' 0 N--CA 1.43 -1.472 0 N-CA-C 113.975 1.102 . . . . 1.0 113.975 -166.068 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 32.7 m-20 -110.01 169.7 8.55 Favored 'General case' 0 N--CA 1.429 -1.49 0 C-N-CA 126.356 1.863 . . . . 1.0 109.21 -176.197 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 50.9 tp -115.97 114.22 24.32 Favored 'General case' 0 N--CA 1.43 -1.447 0 O-C-N 119.984 -1.698 . . . . 1.0 110.584 -178.164 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 18.5 mttm -71.05 -60.21 2.36 Favored 'General case' 0 N--CA 1.431 -1.408 0 O-C-N 120.124 -1.61 . . . . 1.0 112.984 164.729 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -171.56 -73.65 0.04 OUTLIER Glycine 0 N--CA 1.429 -1.775 0 O-C-N 120.622 -1.299 . . . . 1.0 113.518 -179.38 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 4.2 t70 -107.34 26.98 9.54 Favored 'General case' 0 N--CA 1.43 -1.45 0 CA-C-O 123.141 1.448 . . . . 1.0 107.831 174.615 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 1.7 pm0 -161.19 116.71 2.14 Favored 'General case' 0 N--CA 1.43 -1.427 0 N-CA-C 105.205 -2.146 . . . . 1.0 105.205 -168.949 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 78' ' ' TRP . . . . . . . . . . . . . 97.0 m95 -80.95 130.51 35.06 Favored 'General case' 0 N--CA 1.429 -1.505 0 N-CA-C 105.011 -2.218 . . . . 1.0 105.011 162.206 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -126.36 135.32 64.14 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.482 0 O-C-N 119.529 -1.982 . . . . 1.0 108.041 -171.325 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 30.1 m -84.38 122.14 28.52 Favored 'General case' 0 N--CA 1.43 -1.46 0 O-C-N 120.05 -1.656 . . . . 1.0 114.553 -171.275 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 13.2 t70 -84.86 55.21 3.36 Favored 'General case' 0 N--CA 1.429 -1.489 0 O-C-N 119.757 -1.84 . . . . 1.0 112.608 -177.228 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 1.1 tmt_? -148.38 81.7 1.47 Allowed 'General case' 0 N--CA 1.43 -1.428 0 O-C-N 120.36 -1.463 . . . . 1.0 107.347 179.884 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 83' ' ' SER . . . . . . . . . . . . 0.268 16.3 m 79.23 -44.69 0.34 Allowed 'General case' 0 N--CA 1.429 -1.488 0 C-N-CA 127.397 2.279 . . . . 1.0 116.754 175.117 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -159.48 103.19 0.22 Allowed Glycine 0 N--CA 1.431 -1.693 0 N-CA-C 109.128 -1.589 . . . . 1.0 109.128 -167.063 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 1.8 pm0 -87.43 105.97 17.65 Favored 'General case' 0 N--CA 1.429 -1.521 0 N-CA-C 119.424 3.12 . . . . 1.0 119.424 -153.421 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 7.3 m -160.74 122.53 3.08 Favored 'General case' 0 N--CA 1.43 -1.434 0 O-C-N 118.8 -2.438 . . . . 1.0 112.34 174.823 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 41.5 t80 -63.35 -80.17 0.03 OUTLIER 'General case' 0 N--CA 1.43 -1.46 0 N-CA-C 117.254 2.316 . . . . 1.0 117.254 -176.614 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 88' ' ' TRP . . . . . . . . . . . . . 72.6 m95 -63.21 -24.46 67.89 Favored 'General case' 0 N--CA 1.43 -1.432 0 O-C-N 120.442 -1.411 . . . . 1.0 113.892 -169.809 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 1.3 t70 -79.37 -42.76 24.86 Favored 'General case' 0 N--CA 1.428 -1.531 0 C-N-CA 125.87 1.668 . . . . 1.0 113.049 178.568 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 38.5 tp -69.49 -40.2 77.19 Favored 'General case' 0 N--CA 1.431 -1.417 0 O-C-N 119.137 -2.227 . . . . 1.0 111.135 175.514 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 21.4 tp -51.37 -41.4 60.62 Favored 'General case' 0 N--CA 1.43 -1.434 0 C-N-CA 126.926 2.09 . . . . 1.0 114.85 168.049 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 2.0 tm-20 -61.33 -46.42 90.32 Favored 'General case' 0 N--CA 1.43 -1.426 0 C-N-CA 125.627 1.571 . . . . 1.0 113.31 171.085 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 15.4 tt0 -60.96 -46.04 92.31 Favored 'General case' 0 N--CA 1.429 -1.477 0 O-C-N 120.785 -1.197 . . . . 1.0 113.09 176.209 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -58.16 -36.99 73.82 Favored 'General case' 0 N--CA 1.43 -1.425 0 C-N-CA 127.001 2.12 . . . . 1.0 114.703 172.101 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -75.31 -41.34 57.14 Favored 'General case' 0 N--CA 1.428 -1.542 0 O-C-N 119.787 -1.821 . . . . 1.0 113.09 178.42 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 29.8 m -58.23 -28.5 64.92 Favored 'General case' 0 N--CA 1.429 -1.509 0 C-N-CA 126.809 2.044 . . . . 1.0 112.954 169.912 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -69.94 -55.93 8.37 Favored 'General case' 0 N--CA 1.431 -1.413 0 C-N-CA 127.706 2.402 . . . . 1.0 111.891 171.672 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 47.5 mt-30 -75.14 -40.47 59.64 Favored 'General case' 0 N--CA 1.43 -1.453 0 N-CA-C 115.829 1.788 . . . . 1.0 115.829 -175.868 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -81.24 -36.02 30.48 Favored 'General case' 0 N--CA 1.431 -1.402 0 O-C-N 120.376 -1.453 . . . . 1.0 112.619 -179.241 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . 79.44 36.0 27.89 Favored Glycine 0 N--CA 1.429 -1.824 0 O-C-N 120.972 -1.08 . . . . 1.0 111.782 -173.551 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 19.4 tt0 -170.79 145.98 2.52 Favored 'General case' 0 N--CA 1.429 -1.496 0 N-CA-C 103.93 -2.619 . . . . 1.0 103.93 -168.911 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 57.4 m -72.25 97.12 1.93 Allowed 'General case' 0 N--CA 1.429 -1.476 0 CA-C-N 120.851 1.66 . . . . 1.0 111.883 178.957 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 85.6 t -95.91 106.7 18.65 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.434 0 N-CA-C 106.314 -1.735 . . . . 1.0 106.314 171.802 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 35.6 p -132.24 136.89 47.3 Favored 'General case' 0 N--CA 1.429 -1.497 0 C-N-CA 124.171 0.988 . . . . 1.0 109.995 -171.862 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 37.2 m-85 -93.68 -10.35 34.75 Favored 'General case' 0 N--CA 1.43 -1.429 0 C-N-CA 124.265 1.026 . . . . 1.0 112.129 178.904 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 9.7 mmm180 . . . . . 0 C--O 1.26 1.63 0 C-N-CA 124.489 1.116 . . . . 1.0 109.332 177.582 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 7.1 p30 . . . . . 0 N--CA 1.43 -1.458 0 N-CA-C 113.842 1.053 . . . . 1.0 113.842 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 35.3 t70 -55.92 -40.08 72.59 Favored 'General case' 0 N--CA 1.429 -1.479 0 C-N-CA 127.125 2.17 . . . . 1.0 113.46 -178.543 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 5.2 p -68.49 -37.94 80.55 Favored 'General case' 0 N--CA 1.43 -1.467 0 C-N-CA 126.274 1.83 . . . . 1.0 114.359 174.972 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 14.2 tp10 -67.74 -53.06 30.44 Favored 'General case' 0 N--CA 1.43 -1.435 0 C-N-CA 125.226 1.41 . . . . 1.0 110.115 177.925 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 16.3 t80 -47.25 -50.94 20.17 Favored 'General case' 0 N--CA 1.431 -1.425 0 C-N-CA 127.425 2.29 . . . . 1.0 114.821 169.657 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 35.2 m-70 -63.97 -41.43 97.56 Favored 'General case' 0 N--CA 1.43 -1.452 0 N-CA-C 114.907 1.447 . . . . 1.0 114.907 177.989 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -70.76 -37.19 73.38 Favored 'General case' 0 N--CA 1.43 -1.435 0 O-C-N 120.366 -1.459 . . . . 1.0 114.074 178.887 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 79.7 mt -59.58 -51.55 69.37 Favored 'General case' 0 N--CA 1.43 -1.444 0 C-N-CA 124.99 1.316 . . . . 1.0 111.747 168.239 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -54.06 -50.34 66.95 Favored 'General case' 0 N--CA 1.431 -1.416 0 C-N-CA 125.011 1.324 . . . . 1.0 113.458 176.991 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -51.58 -49.71 61.57 Favored 'General case' 0 N--CA 1.43 -1.425 0 N-CA-C 114.783 1.401 . . . . 1.0 114.783 173.136 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 12.2 pt20 -68.9 -33.27 73.49 Favored 'General case' 0 N--CA 1.43 -1.433 0 N-CA-C 115.583 1.697 . . . . 1.0 115.583 179.764 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 84.8 mt -66.74 -59.07 3.89 Favored 'General case' 0 N--CA 1.431 -1.419 0 O-C-N 120.087 -1.633 . . . . 1.0 111.02 174.753 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 1.2 m-90 -50.3 -50.11 51.58 Favored 'General case' 0 N--CA 1.429 -1.487 0 C-N-CA 125.65 1.58 . . . . 1.0 113.27 -179.565 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 41.0 tp -61.85 -59.05 5.71 Favored 'General case' 0 N--CA 1.43 -1.447 0 N-CA-C 113.626 0.973 . . . . 1.0 113.626 175.775 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 59.6 m -64.88 -37.42 87.58 Favored 'General case' 0 N--CA 1.431 -1.4 0 N-CA-C 114.252 1.204 . . . . 1.0 114.252 -173.621 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 93.5 mt -64.63 -54.24 32.7 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.458 0 C-N-CA 124.923 1.289 . . . . 1.0 111.686 174.83 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 1.7 tt0 -55.48 -49.66 71.94 Favored 'General case' 0 N--CA 1.43 -1.473 0 C-N-CA 123.984 0.914 . . . . 1.0 113.386 178.565 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 44.4 tt0 -54.65 -49.1 71.38 Favored 'General case' 0 N--CA 1.429 -1.493 0 C-N-CA 125.966 1.706 . . . . 1.0 114.025 174.173 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 7.4 tpm_? -58.95 -45.92 89.29 Favored 'General case' 0 N--CA 1.431 -1.406 0 O-C-N 120.726 -1.234 . . . . 1.0 114.291 179.818 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 3.8 pp -83.51 -26.97 29.71 Favored 'General case' 0 N--CA 1.431 -1.384 0 N-CA-C 115.097 1.517 . . . . 1.0 115.097 -177.387 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 8.7 t70 -62.71 -34.09 76.44 Favored 'General case' 0 CA--C 1.488 -1.405 0 O-C-N 120.336 -1.478 . . . . 1.0 113.342 163.591 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 19.2 t70 -70.59 -55.08 9.65 Favored 'General case' 0 N--CA 1.43 -1.472 0 C-N-CA 126.201 1.8 . . . . 1.0 114.559 178.405 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 24' ' ' TRP . . . . . . . . . . . . . 32.4 t-105 -73.03 138.68 46.11 Favored 'General case' 0 N--CA 1.43 -1.456 0 O-C-N 120.703 -1.248 . . . . 1.0 113.104 -172.643 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 63.3 m-20 -84.16 -141.33 0.07 Allowed 'General case' 0 N--CA 1.431 -1.408 0 O-C-N 120.327 -1.483 . . . . 1.0 112.054 177.519 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 164.3 -164.8 36.9 Favored Glycine 0 N--CA 1.431 -1.664 0 O-C-N 118.592 -2.568 . . . . 1.0 114.181 -175.221 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 37.4 t70 -86.84 -53.43 4.92 Favored 'General case' 0 N--CA 1.43 -1.463 0 C-N-CA 125.238 1.415 . . . . 1.0 107.911 169.242 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 4.5 t -82.7 -176.48 6.3 Favored 'General case' 0 N--CA 1.431 -1.414 0 C-N-CA 125.728 1.611 . . . . 1.0 109.691 178.94 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 32.9 t0 -99.85 178.63 4.76 Favored 'General case' 0 N--CA 1.43 -1.449 0 O-C-N 120.26 -1.525 . . . . 1.0 108.142 175.218 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 9.3 tp -152.26 126.58 1.41 Allowed 'Isoleucine or valine' 0 N--CA 1.43 -1.431 0 N-CA-C 106.936 -1.505 . . . . 1.0 106.936 -173.974 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 28.4 t70 -131.73 119.07 20.82 Favored 'General case' 0 N--CA 1.43 -1.439 0 CA-C-O 122.956 1.36 . . . . 1.0 109.13 163.299 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 17.3 p -86.21 131.17 34.3 Favored 'General case' 0 N--CA 1.43 -1.445 0 O-C-N 120.088 -1.632 . . . . 1.0 111.228 174.349 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 41.0 mm-40 -100.06 137.5 38.42 Favored 'General case' 0 N--CA 1.429 -1.488 0 C-N-CA 124.708 1.203 . . . . 1.0 108.916 174.651 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 3.5 tp -127.42 114.1 34.79 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.407 0 CA-C-O 124.046 1.879 . . . . 1.0 106.245 178.81 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 35' ' ' ASN . . . . . 0.419 ' HB3' ' HB ' ' A' ' 38' ' ' VAL . 1.6 t-20 -125.81 179.98 4.93 Favored 'General case' 0 N--CA 1.43 -1.427 0 C-N-CA 124.805 1.242 . . . . 1.0 107.828 176.663 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -71.36 87.36 0.41 Allowed Glycine 0 N--CA 1.431 -1.653 0 O-C-N 120.566 -1.334 . . . . 1.0 115.898 -168.657 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 82.2 23.57 56.67 Favored Glycine 0 N--CA 1.429 -1.792 0 C-N-CA 125.379 1.466 . . . . 1.0 112.526 -171.889 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . 0.419 ' HB ' ' HB3' ' A' ' 35' ' ' ASN . 61.8 t -138.84 135.05 42.92 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.475 0 CA-C-N 118.307 1.053 . . . . 1.0 109.109 -173.253 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 31.1 mt -118.07 142.01 47.86 Favored 'General case' 0 N--CA 1.43 -1.427 0 CA-C-O 122.919 1.343 . . . . 1.0 108.799 166.273 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -138.49 111.3 7.71 Favored 'General case' 0 N--CA 1.43 -1.426 0 O-C-N 120.422 -1.424 . . . . 1.0 108.436 178.032 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 70.3 mt -96.83 105.41 17.07 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.467 0 N-CA-C 107.362 -1.347 . . . . 1.0 107.362 -165.859 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 14.0 m -118.44 131.2 56.28 Favored 'General case' 0 N--CA 1.43 -1.457 0 CA-C-N 118.896 0.771 . . . . 1.0 112.994 -163.053 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 43' ' ' PHE . . . . . . . . . . . . . 1.4 m-85 -99.56 173.68 6.61 Favored 'General case' 0 N--CA 1.43 -1.431 0 O-C-N 120.608 -1.308 . . . . 1.0 111.193 -179.381 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -71.77 -19.03 62.08 Favored 'General case' 0 N--CA 1.429 -1.481 0 O-C-N 119.219 -2.175 . . . . 1.0 113.476 -179.466 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 29.0 t-20 -67.21 -17.97 65.05 Favored 'General case' 0 N--CA 1.429 -1.502 0 C-N-CA 126.811 2.044 . . . . 1.0 113.512 170.731 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 92.34 -14.9 63.5 Favored Glycine 0 N--CA 1.43 -1.74 0 O-C-N 119.962 -1.712 . . . . 1.0 113.683 179.666 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 13.8 m -77.8 167.86 20.86 Favored 'General case' 0 N--CA 1.431 -1.425 0 O-C-N 121.082 -1.246 . . . . 1.0 111.077 172.943 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 12.9 ptpt -169.93 157.68 6.82 Favored 'General case' 0 N--CA 1.43 -1.439 0 O-C-N 121.156 -0.965 . . . . 1.0 113.07 -162.668 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 5.3 mm -101.54 137.11 30.39 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.438 0 C-N-CA 125.791 1.636 . . . . 1.0 107.389 171.823 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 16.1 mm -111.17 116.85 53.61 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.437 0 C-N-CA 125.032 1.333 . . . . 1.0 109.382 -178.013 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 3.0 mt -125.43 124.76 67.68 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.506 0 O-C-N 120.717 -1.239 . . . . 1.0 110.695 179.297 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 52' ' ' ASN . . . . . 0.413 ' H ' ' HD1' ' A' ' 61' ' ' TRP . 26.6 t30 -162.52 172.93 14.7 Favored 'General case' 0 N--CA 1.43 -1.471 0 N-CA-C 103.142 -2.91 . . . . 1.0 103.142 -172.815 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 1.9 ptm180 -139.76 150.57 44.93 Favored 'General case' 0 N--CA 1.429 -1.524 0 CA-C-O 122.546 1.165 . . . . 1.0 112.337 -158.913 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 15.8 mm-40 -107.16 -108.42 0.31 Allowed 'General case' 0 N--CA 1.43 -1.448 0 C-N-CA 124.653 1.181 . . . . 1.0 109.562 -167.173 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 33.2 mm-40 -79.23 135.75 57.6 Favored Pre-proline 0 N--CA 1.43 -1.446 0 CA-C-O 117.718 -1.134 . . . . 1.0 112.799 -172.041 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 98.5 Cg_endo -73.45 62.69 4.46 Favored 'Trans proline' 0 N--CA 1.434 -1.999 0 C-N-CA 123.277 2.651 . . . . 1.0 112.319 162.997 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 57' ' ' LEU . . . . . 0.404 ' O ' ' HD2' ' A' ' 58' ' ' HIS . 73.1 mt -120.32 -103.0 0.41 Allowed 'General case' 0 N--CA 1.429 -1.493 0 N-CA-C 102.841 -3.022 . . . . 1.0 102.841 164.483 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 58' ' ' HIS . . . . . 0.404 ' HD2' ' O ' ' A' ' 57' ' ' LEU . 42.0 m170 -132.47 92.02 3.01 Favored 'General case' 0 N--CA 1.429 -1.489 0 N-CA-C 106.622 -1.622 . . . . 1.0 106.622 159.412 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 22.1 tt0 -158.68 122.05 3.84 Favored 'General case' 0 N--CA 1.429 -1.516 0 CA-C-N 121.687 2.04 . . . . 1.0 114.161 173.005 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 86.4 t -133.36 157.57 42.63 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.451 0 C-N-CA 127.031 2.132 . . . . 1.0 109.437 -179.013 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 61' ' ' TRP . . . . . 0.413 ' HD1' ' H ' ' A' ' 52' ' ' ASN . 0.0 OUTLIER -111.36 156.06 22.16 Favored 'General case' 0 N--CA 1.429 -1.505 0 C-N-CA 127.867 2.467 . . . . 1.0 109.755 -174.169 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . 0.277 2.3 pt? -150.91 134.01 16.03 Favored 'General case' 0 N--CA 1.432 -1.364 0 CA-C-N 120.686 1.584 . . . . 1.0 113.916 150.939 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -120.08 147.29 45.03 Favored 'General case' 0 N--CA 1.429 -1.514 0 C-N-CA 125.367 1.467 . . . . 1.0 114.429 -179.557 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 64' ' ' THR . . . . . . . . . . . . . 12.5 t -153.96 -149.52 0.29 Allowed 'General case' 0 N--CA 1.429 -1.509 0 C-N-CA 126.745 2.018 . . . . 1.0 112.388 -172.694 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 5.6 tmtm? -63.56 -53.57 49.64 Favored 'General case' 0 N--CA 1.43 -1.456 0 C-N-CA 130.116 3.366 . . . . 1.0 114.362 -174.404 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 31.3 tt0 -82.24 2.19 33.02 Favored 'General case' 0 N--CA 1.429 -1.492 0 CA-C-O 122.581 1.181 . . . . 1.0 111.602 -177.008 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 117.5 -72.92 0.29 Allowed Glycine 0 N--CA 1.43 -1.732 0 N-CA-C 107.343 -2.303 . . . . 1.0 107.343 -177.4 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 106.06 -173.43 19.85 Favored Glycine 0 N--CA 1.43 -1.733 0 C-N-CA 124.229 0.918 . . . . 1.0 112.486 -176.382 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -162.05 169.83 20.29 Favored 'General case' 0 N--CA 1.431 -1.423 0 N-CA-C 107.284 -1.376 . . . . 1.0 107.284 -173.008 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 19.8 p80 -79.87 159.9 26.25 Favored 'General case' 0 N--CA 1.431 -1.422 0 O-C-N 119.775 -1.828 . . . . 1.0 114.653 174.504 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 71' ' ' PHE . . . . . . . . . . . . 0.3 72.3 t80 -112.21 113.77 26.2 Favored 'General case' 0 N--CA 1.431 -1.402 0 C-N-CA 127.744 2.418 . . . . 1.0 107.019 -158.565 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 5.7 m-20 -134.12 155.1 50.66 Favored 'General case' 0 N--CA 1.43 -1.459 0 CA-C-O 121.851 0.834 . . . . 1.0 110.546 -173.99 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 8.0 tt -97.37 133.53 41.84 Favored 'General case' 0 N--CA 1.431 -1.42 0 O-C-N 119.68 -1.888 . . . . 1.0 111.869 -166.677 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 53.5 tttm -101.81 -56.39 2.29 Favored 'General case' 0 N--CA 1.43 -1.471 0 O-C-N 120.823 -1.173 . . . . 1.0 109.556 174.539 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -157.03 -96.91 0.12 Allowed Glycine 0 N--CA 1.431 -1.677 0 O-C-N 121.035 -1.041 . . . . 1.0 111.346 175.863 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 27.9 m-20 -89.72 16.31 8.17 Favored 'General case' 0 N--CA 1.429 -1.479 0 O-C-N 121.047 -1.266 . . . . 1.0 111.405 179.94 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 32.9 tt0 -166.02 132.83 2.66 Favored 'General case' 0 N--CA 1.43 -1.427 0 N-CA-C 102.046 -3.316 . . . . 1.0 102.046 -161.484 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 78' ' ' TRP . . . . . . . . . . . . . 50.2 m95 -87.75 144.88 26.39 Favored 'General case' 0 N--CA 1.432 -1.37 0 N-CA-C 106.322 -1.732 . . . . 1.0 106.322 175.186 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 9.4 pt -102.35 167.54 2.33 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.485 0 N-CA-C 106.618 -1.623 . . . . 1.0 106.618 174.083 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 1.4 m -89.79 135.65 33.5 Favored 'General case' 0 N--CA 1.429 -1.484 0 O-C-N 120.195 -1.565 . . . . 1.0 107.193 155.29 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 36.8 t70 -59.94 -38.87 83.66 Favored 'General case' 0 N--CA 1.43 -1.447 0 CA-C-N 120.689 1.586 . . . . 1.0 115.069 -174.238 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -9.85 -84.34 0.0 OUTLIER 'General case' 0 N--CA 1.43 -1.467 0 C-N-CA 131.628 3.971 . . . . 1.0 118.457 176.634 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 58.8 m -111.19 -12.79 14.09 Favored 'General case' 0 CA--C 1.489 -1.371 0 O-C-N 120.485 -1.384 . . . . 1.0 109.588 158.126 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 115.85 76.41 0.63 Allowed Glycine 0 N--CA 1.43 -1.763 0 N-CA-C 108.041 -2.023 . . . . 1.0 108.041 -173.509 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 5.2 mm-40 -100.74 -136.4 0.31 Allowed 'General case' 0 N--CA 1.431 -1.419 0 N-CA-C 109.141 -0.688 . . . . 1.0 109.141 -175.583 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 95.5 m -154.2 133.95 12.94 Favored 'General case' 0 N--CA 1.43 -1.445 0 O-C-N 120.156 -1.59 . . . . 1.0 110.402 -171.317 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 1.1 t80 -38.02 -92.13 0.0 OUTLIER 'General case' 0 CA--C 1.489 -1.375 0 C-N-CA 128.432 2.693 . . . . 1.0 115.842 168.895 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 88' ' ' TRP . . . . . . . . . . . . . 50.7 m95 -63.16 -32.69 74.14 Favored 'General case' 0 N--CA 1.431 -1.419 0 C-N-CA 125.649 1.58 . . . . 1.0 113.454 -167.195 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 35.7 t70 -77.96 -42.94 31.24 Favored 'General case' 0 N--CA 1.43 -1.456 0 C-N-CA 125.088 1.355 . . . . 1.0 113.027 -175.898 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 35.0 tp -75.3 -38.9 60.08 Favored 'General case' 0 N--CA 1.43 -1.46 0 O-C-N 119.427 -2.045 . . . . 1.0 111.332 179.335 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 41.9 tp -54.78 -38.64 67.51 Favored 'General case' 0 N--CA 1.43 -1.427 0 C-N-CA 126.33 1.852 . . . . 1.0 113.626 168.106 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 3.4 tm-20 -56.85 -59.9 4.35 Favored 'General case' 0 N--CA 1.429 -1.506 0 C-N-CA 124.611 1.164 . . . . 1.0 112.043 165.875 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 35.9 mt-30 -51.92 -41.81 62.29 Favored 'General case' 0 N--CA 1.43 -1.425 0 N-CA-C 116.28 1.956 . . . . 1.0 116.28 177.394 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -59.19 -58.39 8.84 Favored 'General case' 0 N--CA 1.43 -1.473 0 C-N-CA 126.523 1.929 . . . . 1.0 113.906 172.424 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -62.77 -49.11 76.3 Favored 'General case' 0 N--CA 1.429 -1.507 0 O-C-N 120.41 -1.431 . . . . 1.0 113.446 179.783 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 66.1 m -48.18 -47.55 35.11 Favored 'General case' 0 N--CA 1.43 -1.437 0 C-N-CA 127.859 2.464 . . . . 1.0 114.913 170.501 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 6.6 pt20 -73.4 -30.93 63.59 Favored 'General case' 0 N--CA 1.43 -1.441 0 O-C-N 120.306 -1.496 . . . . 1.0 114.428 -179.222 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 49.7 mt-30 -81.03 -37.93 28.3 Favored 'General case' 0 N--CA 1.431 -1.379 0 O-C-N 120.323 -1.486 . . . . 1.0 113.868 174.715 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -79.42 -42.76 24.73 Favored 'General case' 0 N--CA 1.43 -1.456 0 O-C-N 120.32 -1.488 . . . . 1.0 114.98 -179.686 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . 106.98 17.75 11.35 Favored Glycine 0 N--CA 1.431 -1.695 0 O-C-N 120.683 -1.261 . . . . 1.0 115.762 175.408 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 4.9 tt0 -162.41 152.78 16.81 Favored 'General case' 0 N--CA 1.43 -1.455 0 N-CA-C 104.946 -2.242 . . . . 1.0 104.946 179.527 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 35.1 m -53.48 108.31 0.33 Allowed 'General case' 0 N--CA 1.43 -1.463 0 C-N-CA 125.238 1.415 . . . . 1.0 114.571 175.317 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 49.0 t -89.43 110.49 21.69 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.414 0 CA-C-O 123.258 1.504 . . . . 1.0 108.244 176.892 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 61.5 m -94.19 98.98 11.33 Favored 'General case' 0 N--CA 1.43 -1.46 0 N-CA-C 113.615 0.968 . . . . 1.0 113.615 -162.525 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 88.5 m-85 -89.17 -32.91 17.24 Favored 'General case' 0 N--CA 1.429 -1.485 0 O-C-N 120.961 -1.087 . . . . 1.0 112.884 176.738 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 30.7 mmt180 . . . . . 0 C--O 1.26 1.647 0 N-CA-C 107.3 -1.37 . . . . 1.0 107.3 172.78 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 62.2 t30 . . . . . 0 N--CA 1.43 -1.438 0 CA-C-O 121.068 0.461 . . . . 0.0 109.979 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 31.1 t70 -64.61 -54.92 24.39 Favored 'General case' 0 N--CA 1.429 -1.48 0 C-N-CA 126.701 2.0 . . . . 0.0 113.678 -175.513 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 9.5 t -65.71 -35.25 80.21 Favored 'General case' 0 N--CA 1.429 -1.479 0 O-C-N 120.066 -1.646 . . . . 0.0 112.696 178.392 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 6.6 tp10 -60.51 -54.93 39.61 Favored 'General case' 0 N--CA 1.431 -1.424 0 C-N-CA 125.433 1.493 . . . . 0.0 112.446 175.616 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 23.2 t80 -46.12 -50.46 15.4 Favored 'General case' 0 N--CA 1.428 -1.54 0 C-N-CA 126.504 1.922 . . . . 0.0 115.2 168.89 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 34.1 t60 -67.56 -46.01 73.96 Favored 'General case' 0 N--CA 1.429 -1.5 0 O-C-N 121.189 -0.944 . . . . 0.0 113.125 179.775 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 51.1 ttt180 -63.04 -45.82 90.43 Favored 'General case' 0 N--CA 1.431 -1.384 0 O-C-N 120.872 -1.142 . . . . 0.0 113.268 -178.224 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 76.8 mt -58.66 -48.08 82.29 Favored 'General case' 0 N--CA 1.429 -1.476 0 C-N-CA 124.818 1.247 . . . . 0.0 112.774 172.959 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -58.94 -48.75 80.38 Favored 'General case' 0 N--CA 1.432 -1.368 0 C-N-CA 124.549 1.14 . . . . 0.0 113.712 178.402 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -62.7 -36.45 82.97 Favored 'General case' 0 N--CA 1.431 -1.4 0 C-N-CA 124.776 1.23 . . . . 0.0 114.148 175.967 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 27.1 mm-40 -64.72 -47.93 76.49 Favored 'General case' 0 N--CA 1.43 -1.45 0 O-C-N 120.491 -1.381 . . . . 0.0 114.435 174.218 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 2.9 pp -69.1 -40.34 78.44 Favored 'General case' 0 N--CA 1.43 -1.458 0 O-C-N 120.12 -1.613 . . . . 0.0 113.884 175.969 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 0.3 OUTLIER -40.76 -58.87 1.54 Allowed 'General case' 0 N--CA 1.43 -1.442 0 C-N-CA 127.445 2.298 . . . . 0.0 113.8 164.584 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 41.4 tp -63.89 -43.05 97.16 Favored 'General case' 0 N--CA 1.43 -1.468 0 C-N-CA 126.137 1.775 . . . . 0.0 113.515 -178.462 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 58.5 m -61.03 -49.7 76.32 Favored 'General case' 0 N--CA 1.431 -1.408 0 C-N-CA 125.043 1.337 . . . . 0.0 113.269 175.192 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 93.8 mt -55.99 -54.02 31.79 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.447 0 C-N-CA 126.037 1.735 . . . . 0.0 112.943 173.899 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 2.3 tm-20 -56.5 -55.11 37.82 Favored 'General case' 0 N--CA 1.429 -1.485 0 C-N-CA 124.912 1.285 . . . . 0.0 113.213 -178.042 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 34.3 mt-10 -68.13 -35.2 77.72 Favored 'General case' 0 N--CA 1.43 -1.441 0 N-CA-C 116.099 1.889 . . . . 0.0 116.099 -179.382 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 22.7 tpp180 -65.11 -40.06 93.99 Favored 'General case' 0 N--CA 1.43 -1.45 0 O-C-N 119.839 -1.788 . . . . 0.0 112.503 175.743 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 69.1 mt -74.65 -43.1 57.03 Favored 'General case' 0 N--CA 1.431 -1.397 0 N-CA-C 114.354 1.242 . . . . 0.0 114.354 176.91 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 12.5 t70 -54.42 -31.98 56.37 Favored 'General case' 0 N--CA 1.431 -1.415 0 C-N-CA 125.414 1.485 . . . . 0.0 113.697 171.792 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 32.9 t70 -78.51 -15.08 59.0 Favored 'General case' 0 N--CA 1.431 -1.401 0 O-C-N 119.642 -1.911 . . . . 0.0 116.085 174.33 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 24' ' ' TRP . . . . . . . . . . . . . 14.5 t-105 -90.77 121.42 32.63 Favored 'General case' 0 N--CA 1.43 -1.446 0 O-C-N 118.962 -2.336 . . . . 0.0 112.872 -170.347 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 6.5 t70 -120.76 171.77 8.36 Favored 'General case' 0 N--CA 1.43 -1.454 0 O-C-N 119.987 -1.696 . . . . 0.0 110.744 -175.099 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 171.89 -135.42 3.4 Favored Glycine 0 N--CA 1.43 -1.751 0 O-C-N 119.987 -1.695 . . . . 0.0 114.123 -174.971 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 31.5 t0 -84.39 -39.25 19.27 Favored 'General case' 0 N--CA 1.431 -1.39 0 C-N-CA 125.576 1.55 . . . . 0.0 108.667 177.741 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 68.3 m -101.88 143.39 31.83 Favored 'General case' 0 N--CA 1.431 -1.405 0 C-N-CA 124.714 1.206 . . . . 0.0 111.568 -178.363 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 31.2 t0 -86.03 160.12 19.4 Favored 'General case' 0 N--CA 1.43 -1.445 0 O-C-N 121.295 -0.878 . . . . 0.0 109.428 174.554 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -157.35 114.92 0.22 Allowed 'Isoleucine or valine' 0 N--CA 1.43 -1.46 0 CA-C-O 123.067 1.413 . . . . 0.0 107.932 -168.048 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 11.4 m-20 -123.17 131.41 53.67 Favored 'General case' 0 N--CA 1.429 -1.501 0 N-CA-C 107.042 -1.466 . . . . 0.0 107.042 171.334 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 71.3 m -92.64 148.48 22.03 Favored 'General case' 0 N--CA 1.429 -1.503 0 O-C-N 119.471 -2.018 . . . . 0.0 110.431 171.053 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 50.6 mt-10 -102.5 138.12 39.83 Favored 'General case' 0 N--CA 1.43 -1.455 0 C-N-CA 125.54 1.536 . . . . 0.0 109.329 -176.753 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 3.7 mp -124.8 109.08 21.44 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.416 0 CA-C-O 123.745 1.736 . . . . 0.0 107.472 -176.644 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 47.5 t30 -130.73 71.14 1.46 Allowed 'General case' 0 N--CA 1.43 -1.439 0 C-N-CA 125.812 1.645 . . . . 0.0 110.486 179.981 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . 72.27 -101.42 1.05 Allowed Glycine 0 N--CA 1.43 -1.733 0 O-C-N 119.784 -1.822 . . . . 0.0 114.572 174.571 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -105.9 24.55 26.47 Favored Glycine 0 N--CA 1.43 -1.75 0 O-C-N 121.607 -0.937 . . . . 0.0 111.366 173.489 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 95.9 t -122.04 124.71 71.85 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.43 0 C-N-CA 125.539 1.536 . . . . 0.0 107.775 174.532 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 58.3 mt -111.62 140.75 45.98 Favored 'General case' 0 N--CA 1.429 -1.503 0 N-CA-C 107.604 -1.258 . . . . 0.0 107.604 161.83 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 1.2 m -134.57 125.07 26.52 Favored 'General case' 0 N--CA 1.431 -1.38 0 O-C-N 120.292 -1.505 . . . . 0.0 107.979 175.883 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 36.4 mt -96.32 116.62 38.74 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.437 0 N-CA-C 107.236 -1.394 . . . . 0.0 107.236 -175.601 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 86.4 m -127.6 111.61 13.94 Favored 'General case' 0 N--CA 1.43 -1.434 0 CA-C-O 123.713 1.721 . . . . 0.0 113.107 -169.292 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 43' ' ' PHE . . . . . . . . . . . . . 7.5 p90 -120.31 160.14 23.61 Favored 'General case' 0 N--CA 1.43 -1.461 0 C-N-CA 126.546 1.938 . . . . 0.0 112.209 178.938 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 25.8 mt-10 -52.88 -25.55 12.03 Favored 'General case' 0 N--CA 1.431 -1.421 0 N-CA-C 119.402 3.112 . . . . 0.0 119.402 -165.605 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 2.2 t-20 -66.77 -9.19 34.31 Favored 'General case' 0 N--CA 1.429 -1.495 0 C-N-CA 124.625 1.17 . . . . 0.0 113.998 177.686 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 94.56 25.2 16.21 Favored Glycine 0 N--CA 1.43 -1.747 0 O-C-N 120.506 -1.371 . . . . 0.0 110.712 177.107 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 18.3 m -89.52 163.88 15.03 Favored 'General case' 0 N--CA 1.429 -1.479 0 C-N-CA 125.523 1.529 . . . . 0.0 113.298 -170.528 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 36.5 ttmt -151.58 99.37 2.6 Favored 'General case' 0 N--CA 1.431 -1.401 0 O-C-N 121.549 -0.719 . . . . 0.0 111.237 -170.697 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 4.1 mm -101.58 107.91 22.5 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.457 0 N-CA-C 105.028 -2.212 . . . . 0.0 105.028 174.737 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 3.4 tp -111.49 120.88 62.99 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.478 0 CA-C-O 123.438 1.59 . . . . 0.0 109.246 -169.824 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 2.4 mt -124.26 120.98 60.71 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.474 0 C-N-CA 125.653 1.581 . . . . 0.0 109.766 -173.994 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 7.5 t-20 -158.42 158.8 34.87 Favored 'General case' 0 N--CA 1.431 -1.389 0 CA-C-O 123.681 1.705 . . . . 0.0 106.843 -172.184 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 37.2 ptt180 -133.25 138.25 46.4 Favored 'General case' 0 N--CA 1.43 -1.454 0 C-N-CA 126.546 1.938 . . . . 0.0 111.077 -163.813 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 13.7 pt20 -100.36 137.58 38.59 Favored 'General case' 0 N--CA 1.43 -1.429 0 CA-C-O 122.496 1.141 . . . . 0.0 108.528 176.977 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 15.5 mm-40 -59.72 -49.02 93.87 Favored Pre-proline 0 N--CA 1.428 -1.531 0 CA-C-O 116.166 -1.874 . . . . 0.0 115.916 174.618 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 88.4 Cg_endo -75.21 139.78 24.16 Favored 'Trans proline' 0 C--N 1.301 -1.972 0 CA-C-N 126.04 3.193 . . . . 0.0 112.056 165.058 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . 0.368 5.5 mp 74.65 127.38 0.04 OUTLIER 'General case' 0 N--CA 1.431 -1.387 0 CA-C-O 124.354 2.026 . . . . 0.0 115.927 -176.22 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 24.1 m80 -76.94 40.24 0.25 Allowed 'General case' 0 N--CA 1.43 -1.438 0 C-N-CA 126.712 2.005 . . . . 0.0 115.016 -177.756 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 7.1 mp0 -127.61 132.18 49.82 Favored 'General case' 0 N--CA 1.43 -1.466 0 C-N-CA 128.591 2.756 . . . . 0.0 107.851 -171.567 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 60' ' ' VAL . . . . . 0.466 ' HB ' ' CE1' ' A' ' 71' ' ' PHE . 29.4 t -113.58 154.49 14.96 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.4 0 O-C-N 119.941 -1.724 . . . . 0.0 108.368 177.745 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 61' ' ' TRP . . . . . . . . . . . . 0.28 0.0 OUTLIER -89.3 154.0 20.44 Favored 'General case' 0 N--CA 1.429 -1.477 0 N-CA-C 115.045 1.498 . . . . 0.0 115.045 -178.67 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -117.77 92.31 3.8 Favored 'General case' 0 N--CA 1.43 -1.46 0 N-CA-C 104.916 -2.253 . . . . 0.0 104.916 165.842 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -104.22 100.89 10.63 Favored 'General case' 0 N--CA 1.431 -1.389 0 CA-C-O 123.689 1.709 . . . . 0.0 110.972 177.534 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 64' ' ' THR . . . . . . . . . . . . . 9.2 t -149.74 172.67 14.72 Favored 'General case' 0 N--CA 1.431 -1.4 0 C-N-CA 126.259 1.824 . . . . 0.0 106.893 -171.234 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 42.4 tptt -78.88 53.36 1.37 Allowed 'General case' 0 N--CA 1.43 -1.468 0 C-N-CA 126.579 1.952 . . . . 0.0 114.77 -166.439 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 38.4 tp60 -130.33 -24.33 2.56 Favored 'General case' 0 N--CA 1.43 -1.434 0 O-C-N 119.992 -1.693 . . . . 0.0 109.363 163.5 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 132.21 112.9 1.44 Allowed Glycine 0 N--CA 1.43 -1.71 0 N-CA-C 107.227 -2.349 . . . . 0.0 107.227 -167.199 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . -71.21 120.48 8.5 Favored Glycine 0 N--CA 1.429 -1.789 0 O-C-N 120.695 -1.473 . . . . 0.0 116.105 -177.195 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 18.6 m-30 -118.11 170.79 8.57 Favored 'General case' 0 N--CA 1.43 -1.459 0 C-N-CA 126.265 1.826 . . . . 0.0 108.7 -175.993 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 3.0 p80 -120.74 159.25 25.78 Favored 'General case' 0 N--CA 1.43 -1.465 0 O-C-N 119.226 -2.171 . . . . 0.0 110.93 165.318 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 71' ' ' PHE . . . . . 0.466 ' CE1' ' HB ' ' A' ' 60' ' ' VAL . 0.0 OUTLIER -117.66 153.66 32.94 Favored 'General case' 0 N--CA 1.429 -1.491 0 N-CA-C 117.471 2.397 . . . . 0.0 117.471 -165.43 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 -127.98 145.47 50.96 Favored 'General case' 0 N--CA 1.43 -1.433 0 C-N-CA 124.659 1.184 . . . . 0.0 110.286 178.126 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 60.0 tp -96.1 114.26 25.94 Favored 'General case' 0 N--CA 1.429 -1.477 0 O-C-N 119.883 -1.761 . . . . 0.0 111.609 -178.108 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 74.1 mmtt -82.95 -11.79 57.86 Favored 'General case' 0 N--CA 1.43 -1.451 0 C-N-CA 124.875 1.27 . . . . 0.0 113.185 174.037 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . 121.96 -61.28 0.55 Allowed Glycine 0 N--CA 1.429 -1.768 0 N-CA-C 109.137 -1.585 . . . . 0.0 109.137 178.486 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 6.2 p-10 -89.51 -20.32 23.97 Favored 'General case' 0 N--CA 1.431 -1.392 0 C-N-CA 124.909 1.284 . . . . 0.0 113.162 179.039 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 6.5 tp10 -147.76 136.48 21.86 Favored 'General case' 0 N--CA 1.43 -1.458 0 N-CA-C 107.115 -1.439 . . . . 0.0 107.115 -174.422 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 78' ' ' TRP . . . . . . . . . . . . . 95.7 m95 -80.94 111.22 17.22 Favored 'General case' 0 N--CA 1.431 -1.405 0 N-CA-C 105.927 -1.879 . . . . 0.0 105.927 159.94 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -106.08 155.7 6.96 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.473 0 N-CA-C 105.657 -1.979 . . . . 0.0 105.657 179.658 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 66.4 m -85.4 146.87 26.78 Favored 'General case' 0 N--CA 1.43 -1.457 0 O-C-N 119.597 -1.939 . . . . 0.0 111.946 -175.987 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 51.6 t0 -66.68 -52.07 48.87 Favored 'General case' 0 N--CA 1.43 -1.46 0 C-N-CA 126.011 1.724 . . . . 0.0 112.301 179.261 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 4.4 mmp_? -67.65 129.38 39.73 Favored 'General case' 0 N--CA 1.43 -1.456 0 C-N-CA 124.812 1.245 . . . . 0.0 110.916 173.756 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 71.2 m 70.94 -59.48 0.54 Allowed 'General case' 0 N--CA 1.43 -1.458 0 C-N-CA 126.84 2.056 . . . . 0.0 115.054 -179.175 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 119.99 63.39 0.26 Allowed Glycine 0 N--CA 1.431 -1.665 0 C-N-CA 126.286 1.898 . . . . 0.0 108.751 -172.589 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 15.2 mm-40 -108.64 -152.83 0.5 Allowed 'General case' 0 N--CA 1.43 -1.448 0 N-CA-C 108.092 -1.077 . . . . 0.0 108.092 -170.994 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 8.9 m -150.33 129.83 13.02 Favored 'General case' 0 N--CA 1.431 -1.413 0 O-C-N 119.428 -2.045 . . . . 0.0 109.861 -158.397 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 4.0 t80 -53.12 -81.85 0.01 OUTLIER 'General case' 0 N--CA 1.431 -1.409 0 N-CA-C 119.12 3.008 . . . . 0.0 119.12 -175.945 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 88' ' ' TRP . . . . . . . . . . . . . 84.9 m95 -67.25 -26.43 66.57 Favored 'General case' 0 N--CA 1.43 -1.429 0 O-C-N 119.841 -1.787 . . . . 0.0 113.423 -167.751 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 17.4 t70 -77.94 -36.97 48.65 Favored 'General case' 0 N--CA 1.432 -1.358 0 C-N-CA 126.171 1.788 . . . . 0.0 113.034 179.428 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 42.2 tp -70.76 -44.41 66.79 Favored 'General case' 0 N--CA 1.43 -1.449 0 O-C-N 119.862 -1.774 . . . . 0.0 111.241 173.046 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 9.0 tt -51.03 -48.17 61.53 Favored 'General case' 0 N--CA 1.431 -1.391 0 C-N-CA 127.238 2.215 . . . . 0.0 112.721 171.622 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 23.8 tt0 -53.08 -55.77 21.34 Favored 'General case' 0 N--CA 1.43 -1.438 0 C-N-CA 126.109 1.764 . . . . 0.0 113.468 168.739 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 9.1 tt0 -52.42 -52.91 51.35 Favored 'General case' 0 N--CA 1.428 -1.551 0 C-N-CA 125.424 1.49 . . . . 0.0 113.958 -178.419 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -66.62 -42.45 86.78 Favored 'General case' 0 N--CA 1.43 -1.466 0 N-CA-C 113.926 1.084 . . . . 0.0 113.926 -178.979 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -67.56 -35.82 79.77 Favored 'General case' 0 N--CA 1.43 -1.446 0 O-C-N 120.674 -1.266 . . . . 0.0 113.294 176.516 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 78.9 m -61.05 -47.07 88.07 Favored 'General case' 0 N--CA 1.431 -1.388 0 C-N-CA 125.835 1.654 . . . . 0.0 112.248 174.268 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 16.3 pt20 -78.29 -10.67 59.77 Favored 'General case' 0 N--CA 1.43 -1.456 0 N-CA-C 114.783 1.401 . . . . 0.0 114.783 177.688 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 4.0 mm-40 -76.79 -50.38 13.64 Favored 'General case' 0 N--CA 1.429 -1.495 0 O-C-N 120.261 -1.524 . . . . 0.0 112.913 163.299 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -80.15 -42.97 22.45 Favored 'General case' 0 N--CA 1.43 -1.469 0 N-CA-C 115.493 1.664 . . . . 0.0 115.493 -174.795 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . 95.51 21.43 24.33 Favored Glycine 0 N--CA 1.43 -1.753 0 C-N-CA 124.567 1.08 . . . . 0.0 112.957 -173.713 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 16.4 pt-20 -157.56 164.18 37.59 Favored 'General case' 0 N--CA 1.43 -1.438 0 N-CA-C 105.914 -1.884 . . . . 0.0 105.914 173.399 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 49.1 m -72.43 102.93 3.31 Favored 'General case' 0 N--CA 1.431 -1.4 0 CA-C-N 119.936 1.243 . . . . 0.0 113.053 -173.0 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 4.3 t -98.49 85.68 1.32 Allowed 'Isoleucine or valine' 0 N--CA 1.429 -1.475 0 CA-C-O 123.359 1.552 . . . . 0.0 109.84 -179.024 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 27.9 p -115.84 156.75 25.53 Favored 'General case' 0 N--CA 1.43 -1.454 0 C-N-CA 125.669 1.587 . . . . 0.0 114.064 -170.322 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 29.6 m-85 -102.96 -34.61 8.87 Favored 'General case' 0 N--CA 1.429 -1.493 0 C-N-CA 125.834 1.654 . . . . 0.0 110.011 165.949 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 30.7 mmt180 . . . . . 0 C--O 1.26 1.65 0 O-C-N 121.513 -0.742 . . . . 0.0 109.539 -177.643 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 33.9 p-10 . . . . . 0 N--CA 1.43 -1.465 0 N-CA-C 113.458 0.91 . . . . 1.0 113.458 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 11.2 t70 -56.15 -54.36 46.03 Favored 'General case' 0 N--CA 1.43 -1.458 0 C-N-CA 127.554 2.342 . . . . 1.0 112.862 179.297 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 62.5 m -52.92 -53.64 46.39 Favored 'General case' 0 N--CA 1.43 -1.462 0 C-N-CA 126.516 1.926 . . . . 1.0 113.994 176.237 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 5.8 mm-40 -65.17 -49.04 71.36 Favored 'General case' 0 N--CA 1.43 -1.445 0 C-N-CA 125.616 1.566 . . . . 1.0 113.601 -178.034 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 12.9 t80 -61.96 -38.25 87.81 Favored 'General case' 0 N--CA 1.43 -1.43 0 N-CA-C 114.272 1.212 . . . . 1.0 114.272 173.373 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 23.6 t60 -65.56 -37.53 86.96 Favored 'General case' 0 N--CA 1.43 -1.445 0 O-C-N 119.882 -1.761 . . . . 1.0 113.2 176.422 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 1.7 tpm_? -59.12 -54.5 46.27 Favored 'General case' 0 N--CA 1.431 -1.422 0 C-N-CA 125.565 1.546 . . . . 1.0 112.353 171.796 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 81.5 mt -57.03 -49.13 76.74 Favored 'General case' 0 N--CA 1.429 -1.506 0 C-N-CA 125.043 1.337 . . . . 1.0 113.806 174.629 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -56.67 -48.34 77.82 Favored 'General case' 0 N--CA 1.431 -1.384 0 C-N-CA 127.087 2.155 . . . . 1.0 114.511 -178.283 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -59.78 -52.57 64.89 Favored 'General case' 0 N--CA 1.429 -1.502 0 O-C-N 121.29 -0.881 . . . . 1.0 112.498 171.639 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 39.6 mt-30 -55.2 -45.9 75.86 Favored 'General case' 0 N--CA 1.43 -1.458 0 N-CA-C 117.839 2.533 . . . . 1.0 117.839 177.637 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 4.0 pp -65.67 -38.51 89.52 Favored 'General case' 0 N--CA 1.43 -1.474 0 O-C-N 120.707 -1.246 . . . . 1.0 113.669 175.679 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 0.1 OUTLIER -49.84 -56.52 10.09 Favored 'General case' 0 N--CA 1.429 -1.506 0 N-CA-C 113.988 1.107 . . . . 1.0 113.988 167.894 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 38.1 mt -56.46 -44.21 80.31 Favored 'General case' 0 N--CA 1.43 -1.431 0 CA-C-O 122.183 0.992 . . . . 1.0 113.313 178.743 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 14.9 m -57.56 -54.21 49.44 Favored 'General case' 0 N--CA 1.431 -1.411 0 C-N-CA 125.047 1.339 . . . . 1.0 113.323 178.981 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 80.9 mt -59.62 -46.86 92.79 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.416 0 C-N-CA 126.879 2.072 . . . . 1.0 113.541 177.213 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 26.1 mt-10 -52.67 -57.61 9.52 Favored 'General case' 0 N--CA 1.43 -1.469 0 C-N-CA 126.225 1.81 . . . . 1.0 112.248 176.526 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -53.45 -54.93 29.86 Favored 'General case' 0 CA--C 1.489 -1.391 0 C-N-CA 125.174 1.39 . . . . 1.0 113.545 174.421 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 3.4 tpt180 -57.9 -49.05 78.05 Favored 'General case' 0 N--CA 1.431 -1.42 0 N-CA-C 114.992 1.479 . . . . 1.0 114.992 -171.508 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -80.9 -32.82 34.63 Favored 'General case' 0 N--CA 1.43 -1.458 0 N-CA-C 114.255 1.206 . . . . 1.0 114.255 177.84 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 15.0 t70 -56.02 -49.32 74.0 Favored 'General case' 0 N--CA 1.428 -1.532 0 O-C-N 119.738 -1.851 . . . . 1.0 114.064 172.448 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 13.6 t70 -52.83 -45.41 67.31 Favored 'General case' 0 N--CA 1.43 -1.427 0 C-N-CA 128.081 2.553 . . . . 1.0 117.206 -175.356 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 24' ' ' TRP . . . . . . . . . . . . . 76.9 t-105 -43.9 -65.12 0.54 Allowed 'General case' 0 N--CA 1.43 -1.472 0 C-N-CA 127.677 2.391 . . . . 1.0 116.57 -169.594 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 40.4 t0 59.34 70.03 0.67 Allowed 'General case' 0 N--CA 1.43 -1.46 0 C-N-CA 126.653 1.981 . . . . 1.0 114.161 173.231 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -99.65 -134.29 8.44 Favored Glycine 0 N--CA 1.429 -1.818 0 CA-C-O 122.823 1.235 . . . . 1.0 113.386 -175.45 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -72.69 -34.52 67.22 Favored 'General case' 0 N--CA 1.43 -1.447 0 C-N-CA 125.024 1.329 . . . . 1.0 109.64 174.547 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 36.1 m -89.3 148.84 23.33 Favored 'General case' 0 N--CA 1.43 -1.429 0 CA-C-O 122.899 1.333 . . . . 1.0 113.033 -179.926 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 22.5 t0 -76.84 172.84 12.47 Favored 'General case' 0 N--CA 1.431 -1.381 0 C-N-CA 125.187 1.395 . . . . 1.0 110.135 170.432 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 5.4 tp -157.04 114.78 0.23 Allowed 'Isoleucine or valine' 0 N--CA 1.43 -1.464 0 CA-C-O 123.477 1.608 . . . . 1.0 108.253 -164.78 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 7.5 t0 -131.68 102.31 5.84 Favored 'General case' 0 N--CA 1.431 -1.388 0 O-C-N 120.507 -1.371 . . . . 1.0 108.806 170.767 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 27.3 p -89.58 124.45 34.56 Favored 'General case' 0 N--CA 1.431 -1.424 0 O-C-N 120.241 -1.537 . . . . 1.0 111.669 -178.697 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 5.2 mm-40 -94.34 135.13 36.09 Favored 'General case' 0 N--CA 1.429 -1.478 0 O-C-N 120.087 -1.633 . . . . 1.0 110.623 -177.191 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 1.6 tp -131.42 115.89 30.31 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.422 0 C-N-CA 126.758 2.023 . . . . 1.0 107.357 -176.929 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 4.9 t-20 -147.66 81.42 1.51 Allowed 'General case' 0 N--CA 1.431 -1.423 0 O-C-N 121.62 -0.675 . . . . 1.0 111.374 172.281 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . 68.27 -70.49 0.34 Allowed Glycine 0 N--CA 1.429 -1.808 0 C-N-CA 126.777 2.132 . . . . 1.0 118.221 167.815 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -119.5 -3.07 12.93 Favored Glycine 0 N--CA 1.43 -1.762 0 C-N-CA 126.125 1.821 . . . . 1.0 112.24 179.693 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 21.5 t -120.99 123.78 70.85 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.457 0 CA-C-N 118.538 1.169 . . . . 1.0 109.689 -177.707 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 42.1 mt -110.23 135.67 50.63 Favored 'General case' 0 N--CA 1.431 -1.408 0 O-C-N 120.286 -1.509 . . . . 1.0 108.707 163.254 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -136.91 107.51 6.54 Favored 'General case' 0 N--CA 1.431 -1.407 0 N-CA-C 107.183 -1.414 . . . . 1.0 107.183 -178.329 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 6.5 mt -100.46 114.62 39.8 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.513 0 O-C-N 119.457 -2.027 . . . . 1.0 108.664 -168.075 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 23.0 m -116.03 131.94 56.8 Favored 'General case' 0 N--CA 1.43 -1.436 0 CA-C-O 121.473 0.654 . . . . 1.0 111.265 -167.102 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 43' ' ' PHE . . . . . . . . . . . . 0.263 0.2 OUTLIER -120.55 173.03 7.42 Favored 'General case' 0 N--CA 1.429 -1.486 0 C-N-CA 124.624 1.17 . . . . 1.0 112.481 177.142 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -57.88 -33.32 68.59 Favored 'General case' 0 N--CA 1.431 -1.418 0 N-CA-C 118.256 2.687 . . . . 1.0 118.256 -160.097 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -69.46 -13.78 62.53 Favored 'General case' 0 N--CA 1.43 -1.459 0 C-N-CA 125.543 1.537 . . . . 1.0 113.283 -179.775 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 82.27 38.32 13.12 Favored Glycine 0 N--CA 1.429 -1.772 0 O-C-N 119.868 -1.77 . . . . 1.0 109.228 -168.793 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 68.8 m -120.86 151.61 39.43 Favored 'General case' 0 CA--C 1.489 -1.4 0 N-CA-C 106.145 -1.798 . . . . 1.0 106.145 179.456 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 47.6 pttt -161.3 165.64 28.82 Favored 'General case' 0 N--CA 1.431 -1.411 0 N-CA-C 113.905 1.076 . . . . 1.0 113.905 -165.54 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 5.7 mm -112.86 135.23 52.95 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.506 0 C-N-CA 127.327 2.251 . . . . 1.0 106.269 175.517 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 3.2 mm -117.88 114.46 45.42 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.466 0 C-N-CA 124.577 1.151 . . . . 1.0 108.737 -179.912 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 4.7 mt -128.08 128.25 68.62 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.5 0 CA-C-O 123.006 1.384 . . . . 1.0 111.617 -176.902 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 14.0 t-20 -160.96 174.41 13.83 Favored 'General case' 0 N--CA 1.43 -1.452 0 N-CA-C 102.809 -3.034 . . . . 1.0 102.809 -178.349 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 12.6 ptt180 -142.46 135.26 28.25 Favored 'General case' 0 CA--C 1.489 -1.374 0 N-CA-C 108.66 -0.867 . . . . 1.0 108.66 -169.263 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 55.2 mm-40 -139.46 67.02 1.39 Allowed 'General case' 0 N--CA 1.431 -1.393 0 N-CA-C 106.892 -1.522 . . . . 1.0 106.892 -171.401 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -70.91 126.82 92.17 Favored Pre-proline 0 N--CA 1.43 -1.438 0 N-CA-C 117.24 2.311 . . . . 1.0 117.24 -157.655 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 49.6 Cg_endo -76.63 -55.62 0.06 OUTLIER 'Trans proline' 0 C--N 1.299 -2.069 0 C-N-CA 122.052 1.835 . . . . 1.0 109.812 150.908 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 40.8 mt -115.96 -93.23 0.5 Allowed 'General case' 0 N--CA 1.429 -1.508 0 C-N-CA 124.932 1.293 . . . . 1.0 109.307 -177.692 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 51.4 m170 -132.76 78.96 1.82 Allowed 'General case' 0 N--CA 1.43 -1.436 0 C-N-CA 126.68 1.992 . . . . 1.0 106.604 175.892 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 12.0 tt0 -138.47 140.43 39.23 Favored 'General case' 0 N--CA 1.43 -1.45 0 O-C-N 119.908 -1.745 . . . . 1.0 108.252 -170.389 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 48.9 t -119.85 154.43 22.71 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.381 0 N-CA-C 106.198 -1.778 . . . . 1.0 106.198 -177.611 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 61' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -99.42 148.44 24.21 Favored 'General case' 0 N--CA 1.43 -1.45 0 O-C-N 120.555 -1.341 . . . . 1.0 110.092 178.228 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -133.55 92.21 2.95 Favored 'General case' 0 N--CA 1.429 -1.477 0 O-C-N 120.38 -1.45 . . . . 1.0 111.829 176.862 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -103.71 149.9 24.54 Favored 'General case' 0 N--CA 1.43 -1.429 0 CA-C-O 123.628 1.68 . . . . 1.0 112.011 173.712 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 64' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -151.15 -82.92 0.09 Allowed 'General case' 0 N--CA 1.43 -1.438 0 N-CA-C 107.197 -1.409 . . . . 1.0 107.197 -171.161 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 42.8 tttp -122.88 -59.03 1.63 Allowed 'General case' 0 N--CA 1.43 -1.431 0 C-N-CA 123.696 0.798 . . . . 1.0 111.881 178.432 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 51.7 tt0 -121.1 -23.35 5.83 Favored 'General case' 0 N--CA 1.431 -1.417 0 N-CA-C 112.969 0.729 . . . . 1.0 112.969 -160.066 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . -90.84 -83.79 1.41 Allowed Glycine 0 N--CA 1.431 -1.668 0 O-C-N 120.627 -1.295 . . . . 1.0 114.762 -175.958 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 74.69 51.1 8.37 Favored Glycine 0 N--CA 1.43 -1.748 0 O-C-N 121.375 -1.074 . . . . 1.0 112.845 -166.425 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 11.0 m-30 -99.44 125.78 45.22 Favored 'General case' 0 N--CA 1.429 -1.475 0 O-C-N 121.257 -1.143 . . . . 1.0 108.648 -169.358 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 12.0 p-80 -92.37 156.45 17.22 Favored 'General case' 0 N--CA 1.43 -1.459 0 O-C-N 120.214 -1.554 . . . . 1.0 112.072 179.26 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 50.9 p90 -144.13 142.9 30.85 Favored 'General case' 0 N--CA 1.43 -1.448 0 N-CA-C 115.164 1.542 . . . . 1.0 115.164 -156.381 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -119.54 155.69 31.71 Favored 'General case' 0 N--CA 1.429 -1.476 0 C-N-CA 126.834 2.054 . . . . 1.0 110.866 -172.001 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 58.5 tp -92.35 117.4 29.86 Favored 'General case' 0 N--CA 1.43 -1.426 0 O-C-N 120.318 -1.489 . . . . 1.0 111.427 178.801 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 68.3 mmtt -79.99 -45.74 17.89 Favored 'General case' 0 N--CA 1.43 -1.473 0 O-C-N 120.746 -1.221 . . . . 1.0 113.122 170.034 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -174.92 -76.18 0.05 OUTLIER Glycine 0 N--CA 1.43 -1.73 0 O-C-N 121.001 -1.062 . . . . 1.0 112.453 -179.459 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 4.0 p-10 -101.67 0.33 35.94 Favored 'General case' 0 N--CA 1.429 -1.509 0 C-N-CA 124.876 1.27 . . . . 1.0 112.149 173.675 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 20.6 pt-20 -153.44 148.8 27.08 Favored 'General case' 0 N--CA 1.431 -1.404 0 N-CA-C 106.127 -1.805 . . . . 1.0 106.127 -174.764 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 78' ' ' TRP . . . . . . . . . . . . . 27.4 m95 -97.86 135.36 39.72 Favored 'General case' 0 N--CA 1.43 -1.442 0 N-CA-C 106.982 -1.488 . . . . 1.0 106.982 177.413 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 3.1 mt -104.87 134.38 46.45 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.426 0 C-N-CA 125.502 1.521 . . . . 1.0 107.186 177.832 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 80' ' ' CYS . . . . . 0.46 ' HG ' ' CD2' ' A' ' 90' ' ' LEU . 75.4 m -82.58 127.6 33.51 Favored 'General case' 0 N--CA 1.432 -1.368 0 CA-C-N 115.403 -0.817 . . . . 1.0 108.841 -179.376 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 30.1 t70 -70.08 -37.9 75.57 Favored 'General case' 0 N--CA 1.43 -1.438 0 C-N-CA 124.16 0.984 . . . . 1.0 112.827 -166.894 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -75.51 121.0 21.71 Favored 'General case' 0 N--CA 1.43 -1.461 0 O-C-N 121.234 -0.916 . . . . 1.0 110.017 176.743 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 83' ' ' SER . . . . . . . . . . . . 0.378 80.2 p 72.59 -53.2 0.7 Allowed 'General case' 0 N--CA 1.43 -1.449 0 C-N-CA 128.065 2.546 . . . . 1.0 115.954 -173.028 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 116.54 80.12 0.79 Allowed Glycine 0 N--CA 1.43 -1.719 0 N-CA-C 109.123 -1.591 . . . . 1.0 109.123 -176.375 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 4.6 mm-40 -135.11 -156.02 0.69 Allowed 'General case' 0 N--CA 1.43 -1.458 0 N-CA-C 105.467 -2.049 . . . . 1.0 105.467 -172.158 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 18.8 m -145.71 137.64 25.31 Favored 'General case' 0 N--CA 1.431 -1.413 0 O-C-N 119.866 -1.771 . . . . 1.0 109.087 -154.267 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 1.3 t80 -30.72 -91.23 0.0 OUTLIER 'General case' 0 N--CA 1.43 -1.447 0 C-N-CA 128.702 2.801 . . . . 1.0 118.309 176.551 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 88' ' ' TRP . . . . . . . . . . . . . 56.0 m95 -73.72 -28.09 61.53 Favored 'General case' 0 N--CA 1.43 -1.463 0 O-C-N 120.794 -1.191 . . . . 1.0 111.499 -169.653 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 59.3 m-20 -74.75 -38.82 62.13 Favored 'General case' 0 N--CA 1.429 -1.506 0 C-N-CA 124.603 1.161 . . . . 1.0 114.06 -178.636 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 90' ' ' LEU . . . . . 0.46 ' CD2' ' HG ' ' A' ' 80' ' ' CYS . 58.2 tp -69.64 -45.5 68.32 Favored 'General case' 0 N--CA 1.43 -1.435 0 O-C-N 119.611 -1.931 . . . . 1.0 109.79 174.338 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 60.9 tp -50.93 -44.84 60.36 Favored 'General case' 0 N--CA 1.43 -1.469 0 C-N-CA 125.678 1.591 . . . . 1.0 114.35 170.278 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 2.9 tm-20 -55.78 -49.04 74.24 Favored 'General case' 0 N--CA 1.431 -1.384 0 C-N-CA 126.495 1.918 . . . . 1.0 113.505 172.193 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 1.8 tm0? -61.27 -50.92 71.08 Favored 'General case' 0 N--CA 1.429 -1.499 0 N-CA-C 114.253 1.205 . . . . 1.0 114.253 176.288 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -54.43 -44.26 72.29 Favored 'General case' 0 N--CA 1.431 -1.41 0 C-N-CA 128.019 2.528 . . . . 1.0 115.256 174.544 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -72.97 -45.82 55.82 Favored 'General case' 0 N--CA 1.431 -1.418 0 O-C-N 120.299 -1.5 . . . . 1.0 113.868 178.203 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 91.9 m -50.52 -45.77 56.85 Favored 'General case' 0 N--CA 1.428 -1.549 0 C-N-CA 127.125 2.17 . . . . 1.0 112.891 168.997 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 2.7 tp60 -57.28 -54.75 43.29 Favored 'General case' 0 N--CA 1.432 -1.371 0 C-N-CA 126.31 1.844 . . . . 1.0 113.188 172.795 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 10.1 mm100 -58.41 -45.18 88.91 Favored 'General case' 0 N--CA 1.43 -1.449 0 N-CA-C 116.345 1.98 . . . . 1.0 116.345 176.648 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -78.51 -43.21 27.43 Favored 'General case' 0 N--CA 1.429 -1.481 0 O-C-N 120.302 -1.499 . . . . 1.0 113.402 -178.926 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . 97.27 13.69 44.45 Favored Glycine 0 N--CA 1.431 -1.699 0 C-N-CA 125.085 1.326 . . . . 1.0 111.7 -172.98 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 8.0 tt0 -157.13 144.99 19.12 Favored 'General case' 0 N--CA 1.43 -1.455 0 N-CA-C 106.226 -1.768 . . . . 1.0 106.226 -174.665 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 57.0 m -58.86 119.2 6.74 Favored 'General case' 0 N--CA 1.429 -1.515 0 C-N-CA 125.078 1.351 . . . . 1.0 114.51 -178.726 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 92.2 t -96.19 130.42 44.88 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.45 0 C-N-CA 125.53 1.532 . . . . 1.0 108.816 -179.025 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 7.5 t -93.2 96.76 10.21 Favored 'General case' 0 N--CA 1.429 -1.487 0 C-N-CA 125.449 1.5 . . . . 1.0 114.448 -170.346 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 14.9 m-85 -118.23 -18.97 9.16 Favored 'General case' 0 N--CA 1.431 -1.421 0 C-N-CA 124.87 1.268 . . . . 1.0 111.278 172.17 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.26 1.658 0 O-C-N 120.965 -1.085 . . . . 1.0 113.849 -168.911 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 80.6 m-20 . . . . . 0 N--CA 1.431 -1.413 0 CA-C-O 121.814 0.816 . . . . 1.0 111.081 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 9.0 t70 -68.5 -42.31 78.79 Favored 'General case' 0 N--CA 1.429 -1.52 0 C-N-CA 124.635 1.174 . . . . 1.0 114.08 -172.328 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 15.9 t -64.17 -43.63 94.53 Favored 'General case' 0 N--CA 1.429 -1.478 0 O-C-N 120.473 -1.392 . . . . 1.0 112.904 175.846 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 9.4 mm-40 -55.02 -58.32 8.12 Favored 'General case' 0 N--CA 1.43 -1.433 0 C-N-CA 124.893 1.277 . . . . 1.0 113.168 172.908 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 31.3 t80 -50.59 -57.65 7.68 Favored 'General case' 0 N--CA 1.43 -1.426 0 N-CA-C 114.625 1.343 . . . . 1.0 114.625 172.873 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 37.4 m80 -65.07 -38.98 92.54 Favored 'General case' 0 N--CA 1.43 -1.436 0 N-CA-C 115.759 1.763 . . . . 1.0 115.759 -175.588 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 47.6 mtt-85 -62.79 -53.5 53.29 Favored 'General case' 0 N--CA 1.43 -1.432 0 CA-C-N 120.239 1.381 . . . . 1.0 112.972 172.14 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 98.2 mt -62.11 -42.86 99.65 Favored 'General case' 0 N--CA 1.43 -1.465 0 O-C-N 120.752 -1.217 . . . . 1.0 113.571 -178.394 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -62.78 -36.27 82.54 Favored 'General case' 0 N--CA 1.431 -1.424 0 N-CA-C 114.424 1.268 . . . . 1.0 114.424 174.965 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 10.8 t70 -61.17 -45.18 95.66 Favored 'General case' 0 N--CA 1.429 -1.491 0 O-C-N 120.569 -1.332 . . . . 1.0 111.762 172.741 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 29.4 mm100 -57.19 -39.85 76.2 Favored 'General case' 0 N--CA 1.429 -1.49 0 N-CA-C 115.019 1.488 . . . . 1.0 115.019 173.759 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 28.5 mt -59.78 -52.49 65.24 Favored 'General case' 0 N--CA 1.43 -1.452 0 O-C-N 120.312 -1.493 . . . . 1.0 112.942 171.436 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 0.7 OUTLIER -42.67 -56.11 3.28 Favored 'General case' 0 N--CA 1.43 -1.466 0 C-N-CA 127.028 2.131 . . . . 1.0 114.305 174.606 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 44.1 mt -60.32 -48.8 80.19 Favored 'General case' 0 N--CA 1.429 -1.51 0 C-N-CA 124.437 1.095 . . . . 1.0 113.701 176.279 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 24.1 m -64.67 -45.88 84.84 Favored 'General case' 0 N--CA 1.43 -1.43 0 C-N-CA 124.831 1.253 . . . . 1.0 113.539 -175.132 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 65.7 mt -59.53 -51.23 75.17 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.499 0 C-N-CA 126.018 1.727 . . . . 1.0 111.024 175.821 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 4.8 tt0 -55.62 -51.2 67.99 Favored 'General case' 0 N--CA 1.43 -1.438 0 N-CA-C 112.972 0.731 . . . . 1.0 112.972 176.064 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 13.0 tt0 -60.49 -44.75 95.61 Favored 'General case' 0 N--CA 1.429 -1.522 0 N-CA-C 115.3 1.592 . . . . 1.0 115.3 -178.493 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -67.54 -39.14 85.01 Favored 'General case' 0 N--CA 1.431 -1.42 0 O-C-N 119.925 -1.734 . . . . 1.0 112.465 178.113 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 15.2 mt -62.1 -57.11 12.78 Favored 'General case' 0 N--CA 1.431 -1.393 0 N-CA-C 114.628 1.344 . . . . 1.0 114.628 170.724 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 7.6 t70 -52.92 -37.99 61.35 Favored 'General case' 0 N--CA 1.432 -1.368 0 C-N-CA 127.092 2.157 . . . . 1.0 114.962 179.441 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 29.0 t70 -74.96 -0.42 18.66 Favored 'General case' 0 N--CA 1.429 -1.485 0 O-C-N 120.102 -1.624 . . . . 1.0 115.109 179.81 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 24' ' ' TRP . . . . . . . . . . . . . 68.4 t-105 -75.27 129.38 37.34 Favored 'General case' 0 N--CA 1.431 -1.385 0 O-C-N 118.433 -2.667 . . . . 1.0 112.496 172.237 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 34.3 m-20 -117.74 136.5 53.33 Favored 'General case' 0 N--CA 1.43 -1.465 0 N-CA-C 106.788 -1.56 . . . . 1.0 106.788 167.814 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -172.31 -149.01 6.46 Favored Glycine 0 N--CA 1.431 -1.672 0 N-CA-C 110.043 -1.223 . . . . 1.0 110.043 178.724 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 1.5 t70 -79.36 -28.8 41.98 Favored 'General case' 0 N--CA 1.43 -1.462 0 CA-C-O 122.293 1.044 . . . . 1.0 110.694 179.867 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 96.1 p -86.31 -164.41 1.04 Allowed 'General case' 0 N--CA 1.43 -1.465 0 C-N-CA 127.873 2.469 . . . . 1.0 113.749 -179.677 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 3.4 t70 -142.29 179.09 7.13 Favored 'General case' 0 N--CA 1.43 -1.444 0 O-C-N 120.313 -1.492 . . . . 1.0 109.851 176.21 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 7.4 tp -162.77 113.82 0.09 OUTLIER 'Isoleucine or valine' 0 N--CA 1.431 -1.411 0 CA-C-O 123.247 1.498 . . . . 1.0 110.626 -175.149 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -121.36 107.27 12.3 Favored 'General case' 0 N--CA 1.43 -1.458 0 O-C-N 120.363 -1.46 . . . . 1.0 108.991 169.593 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 91.2 m -87.03 139.02 30.99 Favored 'General case' 0 N--CA 1.43 -1.425 0 O-C-N 119.588 -1.945 . . . . 1.0 109.224 164.752 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -105.93 140.13 39.41 Favored 'General case' 0 N--CA 1.43 -1.429 0 C-N-CA 126.083 1.753 . . . . 1.0 110.85 -171.249 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 5.0 mm -115.32 106.85 21.35 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.453 0 C-N-CA 125.333 1.453 . . . . 1.0 107.796 -170.758 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 69.2 m-80 -128.36 -179.37 4.99 Favored 'General case' 0 N--CA 1.429 -1.481 0 O-C-N 120.465 -1.397 . . . . 1.0 110.636 176.069 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -73.22 94.86 0.73 Allowed Glycine 0 N--CA 1.431 -1.666 0 O-C-N 120.112 -1.618 . . . . 1.0 114.326 -167.174 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 78.19 25.33 61.89 Favored Glycine 0 N--CA 1.43 -1.741 0 C-N-CA 125.855 1.693 . . . . 1.0 112.675 -173.067 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 54.8 t -139.82 129.37 28.95 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.454 0 C-N-CA 124.176 0.99 . . . . 1.0 110.45 -167.139 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 14.4 mt -111.69 132.41 54.63 Favored 'General case' 0 N--CA 1.43 -1.445 0 N-CA-C 108.159 -1.052 . . . . 1.0 108.159 154.814 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 2.7 m -124.99 119.89 30.02 Favored 'General case' 0 N--CA 1.429 -1.481 0 N-CA-C 106.989 -1.486 . . . . 1.0 106.989 178.644 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 73.7 mt -93.92 120.53 43.47 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.437 0 O-C-N 120.767 -1.208 . . . . 1.0 108.206 -168.919 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 43.4 p -126.64 129.11 47.85 Favored 'General case' 0 N--CA 1.43 -1.438 0 CA-C-O 122.183 0.992 . . . . 1.0 111.619 178.577 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 43' ' ' PHE . . . . . . . . . . . . . 7.2 p90 -120.28 168.41 11.29 Favored 'General case' 0 N--CA 1.431 -1.424 0 O-C-N 120.372 -1.455 . . . . 1.0 109.57 172.563 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -64.52 -28.88 69.95 Favored 'General case' 0 N--CA 1.431 -1.423 0 N-CA-C 116.16 1.911 . . . . 1.0 116.16 -166.981 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 15.8 m-80 -66.82 -4.94 10.4 Favored 'General case' 0 N--CA 1.43 -1.461 0 C-N-CA 126.068 1.747 . . . . 1.0 114.824 173.181 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 103.23 15.74 22.69 Favored Glycine 0 N--CA 1.43 -1.717 0 O-C-N 120.063 -1.648 . . . . 1.0 116.894 158.874 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 3.2 t -91.86 -175.77 4.23 Favored 'General case' 0 N--CA 1.431 -1.404 0 CA-C-N 118.54 1.17 . . . . 1.0 113.639 -178.072 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -160.81 99.44 1.24 Allowed 'General case' 0 N--CA 1.43 -1.461 0 CA-C-O 122.967 1.365 . . . . 1.0 110.938 -174.401 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -107.58 119.95 58.08 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.443 0 N-CA-C 105.798 -1.927 . . . . 1.0 105.798 -174.468 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 3.7 tp -112.95 128.65 69.58 Favored 'Isoleucine or valine' 0 CA--C 1.488 -1.408 0 O-C-N 119.611 -1.931 . . . . 1.0 111.789 -165.897 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 4.1 mt -124.99 127.59 72.5 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.489 0 C-N-CA 126.749 2.02 . . . . 1.0 110.558 -179.173 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 52' ' ' ASN . . . . . 0.444 ' H ' ' HD1' ' A' ' 61' ' ' TRP . 6.8 t-20 -162.47 169.71 19.92 Favored 'General case' 0 N--CA 1.431 -1.416 0 N-CA-C 105.347 -2.094 . . . . 1.0 105.347 -165.706 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 34.4 ttp180 -155.03 136.17 13.91 Favored 'General case' 0 N--CA 1.431 -1.418 0 O-C-N 120.761 -1.212 . . . . 1.0 110.754 -156.651 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 4.7 mm100 -97.26 127.59 43.35 Favored 'General case' 0 N--CA 1.429 -1.512 0 N-CA-C 107.115 -1.439 . . . . 1.0 107.115 177.673 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 87.4 mt-10 -58.58 -37.62 56.32 Favored Pre-proline 0 N--CA 1.429 -1.502 0 CA-C-O 114.812 -2.518 . . . . 1.0 117.004 167.132 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 68.5 Cg_endo -79.33 155.85 25.34 Favored 'Trans proline' 0 N--CA 1.434 -2.025 0 CA-C-N 127.694 3.783 . . . . 1.0 111.793 161.379 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . 0.361 5.5 mp 67.06 134.94 0.02 OUTLIER 'General case' 0 N--CA 1.431 -1.411 0 CA-C-O 124.553 2.12 . . . . 1.0 115.95 -174.213 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 22.0 m170 -76.15 41.72 0.24 Allowed 'General case' 0 N--CA 1.429 -1.51 0 C-N-CA 126.416 1.886 . . . . 1.0 114.869 -176.23 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 2.1 pt20 -146.91 158.34 43.89 Favored 'General case' 0 N--CA 1.431 -1.379 0 O-C-N 119.402 -2.061 . . . . 1.0 110.073 -171.657 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 93.0 t -118.28 162.28 16.48 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.402 0 N-CA-C 107.03 -1.47 . . . . 1.0 107.03 -177.305 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 61' ' ' TRP . . . . . 0.444 ' HD1' ' H ' ' A' ' 52' ' ' ASN . 0.0 OUTLIER -104.17 153.24 21.19 Favored 'General case' 0 N--CA 1.43 -1.453 0 O-C-N 119.654 -1.904 . . . . 1.0 109.907 178.963 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 2.0 pt? -143.68 126.39 16.08 Favored 'General case' 0 N--CA 1.431 -1.408 0 O-C-N 120.24 -1.538 . . . . 1.0 108.564 158.897 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -120.18 146.79 45.67 Favored 'General case' 0 N--CA 1.429 -1.499 0 CA-C-O 122.46 1.124 . . . . 1.0 112.486 176.09 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 64' ' ' THR . . . . . . . . . . . . . 72.0 p -136.52 -148.99 0.3 Allowed 'General case' 0 N--CA 1.429 -1.513 0 C-N-CA 125.702 1.601 . . . . 1.0 110.503 -152.206 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 12.2 tmtt? -60.7 -67.5 0.39 Allowed 'General case' 0 N--CA 1.429 -1.498 0 C-N-CA 126.654 1.982 . . . . 1.0 112.675 173.817 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 13.1 tt0 -131.0 -22.04 2.62 Favored 'General case' 0 N--CA 1.43 -1.433 0 O-C-N 121.098 -1.001 . . . . 1.0 113.458 176.97 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . -82.98 -99.29 0.52 Allowed Glycine 0 N--CA 1.43 -1.719 0 O-C-N 119.838 -1.789 . . . . 1.0 114.033 -176.397 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 69.3 149.01 0.29 Allowed Glycine 0 N--CA 1.43 -1.72 0 N-CA-C 116.261 1.264 . . . . 1.0 116.261 -171.951 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 1.4 t80 -166.44 169.19 14.16 Favored 'General case' 0 N--CA 1.43 -1.448 0 N-CA-C 107.408 -1.33 . . . . 1.0 107.408 168.262 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 3.7 p-80 -95.23 159.29 15.08 Favored 'General case' 0 N--CA 1.429 -1.492 0 O-C-N 120.17 -1.582 . . . . 1.0 111.811 172.817 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 43.5 p90 -138.48 133.49 32.78 Favored 'General case' 0 N--CA 1.43 -1.471 0 N-CA-C 114.817 1.414 . . . . 1.0 114.817 -158.825 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 43.0 m-20 -105.43 176.28 5.22 Favored 'General case' 0 N--CA 1.431 -1.422 0 C-N-CA 126.361 1.865 . . . . 1.0 109.445 -176.403 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 45.8 tp -110.6 125.46 53.43 Favored 'General case' 0 N--CA 1.431 -1.397 0 O-C-N 119.588 -1.945 . . . . 1.0 110.551 177.974 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 94.5 mttt -73.91 -99.13 0.01 OUTLIER 'General case' 0 N--CA 1.43 -1.472 0 O-C-N 120.645 -1.285 . . . . 1.0 112.238 154.3 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -131.46 -57.51 0.09 OUTLIER Glycine 0 N--CA 1.43 -1.74 0 O-C-N 120.165 -1.584 . . . . 1.0 113.544 -174.547 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 48.6 m-20 -111.34 3.63 18.41 Favored 'General case' 0 N--CA 1.43 -1.469 0 C-N-CA 125.724 1.609 . . . . 1.0 109.99 178.535 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -147.91 120.89 8.79 Favored 'General case' 0 N--CA 1.429 -1.522 0 N-CA-C 105.484 -2.043 . . . . 1.0 105.484 -162.038 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 78' ' ' TRP . . . . . . . . . . . . . 71.5 m95 -84.41 124.39 31.27 Favored 'General case' 0 N--CA 1.431 -1.406 0 N-CA-C 104.099 -2.556 . . . . 1.0 104.099 168.435 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -126.01 139.17 52.29 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.474 0 O-C-N 119.92 -1.738 . . . . 1.0 110.304 -166.589 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 79.9 m -78.09 134.79 37.67 Favored 'General case' 0 N--CA 1.429 -1.488 0 O-C-N 119.837 -1.789 . . . . 1.0 113.306 -174.767 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 25.7 t0 -81.86 55.07 2.62 Favored 'General case' 0 N--CA 1.431 -1.413 0 O-C-N 120.145 -1.597 . . . . 1.0 113.532 -174.401 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -149.82 -152.1 0.42 Allowed 'General case' 0 N--CA 1.43 -1.466 0 O-C-N 120.126 -1.609 . . . . 1.0 108.381 -175.7 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 58.2 p -72.62 -19.74 61.4 Favored 'General case' 0 N--CA 1.43 -1.451 0 O-C-N 119.909 -1.745 . . . . 1.0 114.582 -175.216 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -132.36 78.98 0.35 Allowed Glycine 0 N--CA 1.432 -1.628 0 N-CA-C 109.189 -1.564 . . . . 1.0 109.189 -173.93 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 11.8 pt-20 -73.42 88.38 1.59 Allowed 'General case' 0 N--CA 1.431 -1.411 0 N-CA-C 116.334 1.976 . . . . 1.0 116.334 -174.566 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 24.8 m -166.63 124.52 1.37 Allowed 'General case' 0 N--CA 1.429 -1.498 0 C-N-CA 125.245 1.418 . . . . 1.0 111.485 172.942 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 3.0 t80 -53.63 -81.97 0.01 OUTLIER 'General case' 0 N--CA 1.43 -1.449 0 C-N-CA 127.031 2.133 . . . . 1.0 116.129 176.617 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 88' ' ' TRP . . . . . . . . . . . . . 0.3 OUTLIER -64.38 -35.11 79.83 Favored 'General case' 0 N--CA 1.43 -1.458 0 O-C-N 120.343 -1.473 . . . . 1.0 114.095 -170.344 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -68.01 -33.1 73.96 Favored 'General case' 0 N--CA 1.429 -1.476 0 C-N-CA 125.136 1.374 . . . . 1.0 114.64 175.577 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 52.8 tp -71.78 -44.44 63.99 Favored 'General case' 0 N--CA 1.429 -1.478 0 O-C-N 119.387 -2.071 . . . . 1.0 110.791 173.204 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 8.1 tt -52.54 -43.12 64.98 Favored 'General case' 0 N--CA 1.43 -1.474 0 C-N-CA 126.571 1.948 . . . . 1.0 113.575 170.985 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 4.9 tt0 -53.09 -60.31 3.45 Favored 'General case' 0 N--CA 1.429 -1.488 0 C-N-CA 126.503 1.921 . . . . 1.0 112.548 168.216 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 20.1 tt0 -52.28 -48.26 65.39 Favored 'General case' 0 N--CA 1.431 -1.414 0 C-N-CA 125.032 1.333 . . . . 1.0 114.314 -177.51 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -55.92 -57.53 11.69 Favored 'General case' 0 N--CA 1.429 -1.519 0 C-N-CA 127.961 2.504 . . . . 1.0 116.16 171.246 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -73.79 -37.0 65.1 Favored 'General case' 0 N--CA 1.43 -1.44 0 O-C-N 118.945 -2.347 . . . . 1.0 112.891 -173.964 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 3.1 m -62.35 -40.12 95.36 Favored 'General case' 0 N--CA 1.43 -1.465 0 C-N-CA 125.141 1.376 . . . . 1.0 112.533 170.8 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 3.0 pt20 -67.59 -30.85 70.56 Favored 'General case' 0 N--CA 1.429 -1.502 0 O-C-N 120.424 -1.422 . . . . 1.0 113.989 178.05 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 15.9 mm-40 -74.07 -47.43 36.62 Favored 'General case' 0 N--CA 1.43 -1.469 0 N-CA-C 114.816 1.413 . . . . 1.0 114.816 168.729 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -72.19 -42.45 65.8 Favored 'General case' 0 N--CA 1.429 -1.502 0 N-CA-C 115.933 1.827 . . . . 1.0 115.933 -176.502 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . 92.31 29.07 11.7 Favored Glycine 0 N--CA 1.43 -1.766 0 C-N-CA 125.078 1.323 . . . . 1.0 113.159 -177.442 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 11.9 pt-20 -167.95 171.65 9.58 Favored 'General case' 0 N--CA 1.43 -1.432 0 O-C-N 121.514 -0.992 . . . . 1.0 110.372 -170.256 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 16.5 m -67.48 121.46 15.86 Favored 'General case' 0 N--CA 1.43 -1.433 0 O-C-N 120.827 -1.171 . . . . 1.0 111.144 176.531 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 9.8 p -98.39 160.42 3.15 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.492 0 C-N-CA 125.107 1.363 . . . . 1.0 107.984 -178.799 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 11.5 t -109.08 107.51 17.85 Favored 'General case' 0 N--CA 1.429 -1.513 0 O-C-N 121.025 -1.047 . . . . 1.0 112.875 -165.706 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 34.5 p90 -138.95 -37.54 0.52 Allowed 'General case' 0 N--CA 1.431 -1.398 0 O-C-N 120.515 -1.365 . . . . 1.0 113.056 -172.232 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 4.9 mtm180 . . . . . 0 C--O 1.259 1.595 0 C-N-CA 124.857 1.263 . . . . 1.0 110.034 177.484 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 48.8 m-80 . . . . . 0 N--CA 1.43 -1.46 0 N-CA-C 117.309 2.337 . . . . 1.0 117.309 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 30.4 t70 -56.26 -49.4 74.3 Favored 'General case' 0 N--CA 1.43 -1.433 0 C-N-CA 125.978 1.711 . . . . 1.0 113.189 -178.225 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 12.9 m -58.95 -38.15 78.38 Favored 'General case' 0 N--CA 1.43 -1.462 0 N-CA-C 114.598 1.333 . . . . 1.0 114.598 -179.812 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 29.0 tt0 -67.67 -54.44 19.52 Favored 'General case' 0 N--CA 1.431 -1.411 0 C-N-CA 125.04 1.336 . . . . 1.0 111.907 176.051 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 1.1 t80 -49.23 -47.79 46.09 Favored 'General case' 0 N--CA 1.431 -1.4 0 C-N-CA 125.93 1.692 . . . . 1.0 113.94 170.182 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 1.0 OUTLIER -57.12 -50.17 73.62 Favored 'General case' 0 N--CA 1.431 -1.392 0 O-C-N 120.239 -1.538 . . . . 1.0 114.231 173.905 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 26.3 ttm-85 -62.24 -47.67 83.38 Favored 'General case' 0 N--CA 1.431 -1.407 0 CA-C-N 119.463 1.028 . . . . 1.0 112.406 -179.376 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 90.6 mt -55.17 -57.53 11.37 Favored 'General case' 0 N--CA 1.429 -1.481 0 C-N-CA 126.534 1.933 . . . . 1.0 112.167 173.172 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -53.52 -47.36 69.99 Favored 'General case' 0 N--CA 1.429 -1.516 0 O-C-N 120.563 -1.335 . . . . 1.0 114.024 178.863 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -61.85 -40.69 96.22 Favored 'General case' 0 N--CA 1.43 -1.437 0 N-CA-C 113.942 1.089 . . . . 1.0 113.942 178.643 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . 0.25 11.6 pt20 -71.87 -38.41 70.04 Favored 'General case' 0 N--CA 1.43 -1.467 0 N-CA-C 114.833 1.42 . . . . 1.0 114.833 175.452 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 82.8 mt -62.13 -50.5 71.66 Favored 'General case' 0 N--CA 1.43 -1.452 0 O-C-N 120.186 -1.572 . . . . 1.0 111.171 174.67 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 0.1 OUTLIER -52.25 -49.97 62.99 Favored 'General case' 0 N--CA 1.43 -1.445 0 C-N-CA 126.079 1.752 . . . . 1.0 111.903 177.264 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 55.2 tp -58.79 -54.01 51.95 Favored 'General case' 0 N--CA 1.431 -1.395 0 C-N-CA 125.441 1.496 . . . . 1.0 113.554 174.413 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 75.0 m -58.68 -57.16 14.22 Favored 'General case' 0 N--CA 1.431 -1.404 0 C-N-CA 124.716 1.207 . . . . 1.0 113.296 178.442 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 29.8 mt -50.74 -52.9 15.25 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.402 0 C-N-CA 125.711 1.604 . . . . 1.0 114.32 176.072 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 29.9 tt0 -57.96 -54.09 50.9 Favored 'General case' 0 N--CA 1.43 -1.429 0 O-C-N 120.709 -1.244 . . . . 1.0 113.639 178.169 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 7.0 tp10 -75.42 -32.45 60.72 Favored 'General case' 0 N--CA 1.431 -1.415 0 N-CA-C 114.838 1.422 . . . . 1.0 114.838 -172.142 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 20.0 tpt180 -75.87 -33.48 59.99 Favored 'General case' 0 N--CA 1.43 -1.434 0 O-C-N 119.943 -1.723 . . . . 1.0 112.981 175.686 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -76.66 -31.83 57.58 Favored 'General case' 0 N--CA 1.43 -1.428 0 O-C-N 120.269 -1.519 . . . . 1.0 110.927 175.659 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 19.7 t70 -58.86 -65.39 0.67 Allowed 'General case' 0 N--CA 1.43 -1.434 0 C-N-CA 125.959 1.704 . . . . 1.0 113.976 168.38 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 32.3 t70 -84.92 112.31 20.45 Favored 'General case' 0 N--CA 1.43 -1.433 0 CA-C-O 123.11 1.433 . . . . 1.0 111.426 178.826 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 24' ' ' TRP . . . . . . . . . . . . . 51.8 t-105 -132.95 -166.1 1.71 Allowed 'General case' 0 N--CA 1.431 -1.412 0 C-N-CA 125.429 1.492 . . . . 1.0 108.108 -174.167 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 5.7 t0 -138.86 85.59 2.09 Favored 'General case' 0 N--CA 1.429 -1.481 0 N-CA-C 106.006 -1.85 . . . . 1.0 106.006 172.211 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -161.12 -159.83 10.29 Favored Glycine 0 N--CA 1.43 -1.74 0 O-C-N 120.428 -1.42 . . . . 1.0 112.916 -173.315 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 9.1 t0 -113.1 -34.59 5.65 Favored 'General case' 0 N--CA 1.431 -1.397 0 C-N-CA 125.387 1.475 . . . . 1.0 111.096 -177.705 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 49.3 m -60.28 149.82 32.26 Favored 'General case' 0 N--CA 1.43 -1.43 0 C-N-CA 125.79 1.636 . . . . 1.0 113.602 178.032 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 2.4 t70 -110.11 151.54 27.11 Favored 'General case' 0 N--CA 1.431 -1.407 0 O-C-N 120.966 -1.084 . . . . 1.0 109.356 174.277 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 50.8 mm -139.83 115.68 8.49 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.426 0 C-N-CA 126.811 2.044 . . . . 1.0 105.487 -161.245 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 41.8 m-20 -119.55 100.65 7.41 Favored 'General case' 0 N--CA 1.432 -1.373 0 CA-C-O 122.126 0.965 . . . . 1.0 109.27 167.51 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 24.7 t -73.95 137.73 43.75 Favored 'General case' 0 N--CA 1.43 -1.446 0 O-C-N 119.372 -2.08 . . . . 1.0 111.363 162.585 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -94.66 149.51 21.17 Favored 'General case' 0 N--CA 1.429 -1.507 0 C-N-CA 126.625 1.97 . . . . 1.0 108.679 179.81 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 3.3 mp -135.51 106.6 6.5 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.439 0 CA-C-O 123.787 1.756 . . . . 1.0 109.278 -171.345 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 4.7 m120 -113.09 172.34 7.0 Favored 'General case' 0 N--CA 1.431 -1.418 0 N-CA-C 106.829 -1.545 . . . . 1.0 106.829 167.109 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -69.75 85.09 0.28 Allowed Glycine 0 N--CA 1.43 -1.729 0 N-CA-C 117.019 1.568 . . . . 1.0 117.019 -168.745 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 94.87 12.47 55.42 Favored Glycine 0 N--CA 1.431 -1.698 0 C-N-CA 126.19 1.853 . . . . 1.0 112.882 -177.27 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 44.9 t -132.28 131.88 60.72 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.452 0 N-CA-C 107.083 -1.451 . . . . 1.0 107.083 -175.6 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 68.5 mt -121.77 137.94 54.56 Favored 'General case' 0 N--CA 1.43 -1.436 0 O-C-N 120.698 -1.251 . . . . 1.0 109.558 174.187 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -128.68 107.18 9.47 Favored 'General case' 0 N--CA 1.432 -1.372 0 N-CA-C 107.193 -1.41 . . . . 1.0 107.193 -174.654 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 42.6 mt -89.55 122.67 41.15 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.451 0 O-C-N 119.456 -2.027 . . . . 1.0 109.355 -167.397 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 27.2 p -123.9 135.01 53.43 Favored 'General case' 0 N--CA 1.43 -1.465 0 CA-C-O 122.114 0.959 . . . . 1.0 113.389 -179.741 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 43' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -121.41 171.74 8.55 Favored 'General case' 0 N--CA 1.43 -1.459 0 O-C-N 120.444 -1.41 . . . . 1.0 111.534 173.406 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 14.7 mm-40 -52.12 -32.69 36.51 Favored 'General case' 0 N--CA 1.43 -1.446 0 N-CA-C 118.495 2.776 . . . . 1.0 118.495 -169.694 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 31.5 t30 -66.05 -12.41 55.11 Favored 'General case' 0 N--CA 1.432 -1.367 0 N-CA-C 114.783 1.401 . . . . 1.0 114.783 175.712 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 90.04 17.27 54.18 Favored Glycine 0 N--CA 1.43 -1.718 0 O-C-N 120.14 -1.6 . . . . 1.0 111.528 -179.485 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 73.4 m -91.72 157.8 16.72 Favored 'General case' 0 N--CA 1.429 -1.486 0 C-N-CA 126.019 1.728 . . . . 1.0 110.907 -174.074 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 5.2 ptmm? -149.21 121.47 8.39 Favored 'General case' 0 N--CA 1.431 -1.381 0 N-CA-C 114.089 1.144 . . . . 1.0 114.089 -151.211 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 1.7 mm -116.1 134.91 57.98 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.491 0 N-CA-C 107.012 -1.477 . . . . 1.0 107.012 176.415 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 3.5 tp -125.13 119.67 56.3 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.504 0 CA-C-N 121.887 2.13 . . . . 1.0 110.543 -179.969 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 3.9 mt -130.57 125.83 59.61 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.394 0 CA-C-O 123.588 1.661 . . . . 1.0 113.098 -167.728 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 7.6 t-20 -161.8 175.73 11.62 Favored 'General case' 0 N--CA 1.43 -1.445 0 N-CA-C 105.661 -1.977 . . . . 1.0 105.661 -171.302 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 1.4 ptp85 -108.86 153.97 22.77 Favored 'General case' 0 N--CA 1.43 -1.471 0 O-C-N 120.04 -1.663 . . . . 1.0 111.966 -173.444 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 15.7 mm100 -103.92 86.05 2.52 Favored 'General case' 0 N--CA 1.43 -1.429 0 C-N-CA 125.0 1.32 . . . . 1.0 108.187 173.209 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . 0.281 28.6 tt0 -61.43 -39.34 61.38 Favored Pre-proline 0 N--CA 1.43 -1.46 0 N-CA-C 118.923 2.934 . . . . 1.0 118.923 -161.682 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 77.0 Cg_exo -64.62 -7.71 15.33 Favored 'Trans proline' 0 C--N 1.298 -2.086 0 CA-C-N 126.474 3.348 . . . . 1.0 117.198 -178.447 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 57' ' ' LEU . . . . . 0.485 HD11 HE22 ' A' ' 59' ' ' GLN . 61.4 mt -117.75 -113.08 0.34 Allowed 'General case' 0 N--CA 1.43 -1.437 0 CA-C-N 120.115 1.325 . . . . 1.0 110.395 173.972 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 58' ' ' HIS . . . . . 0.439 ' C ' ' CD2' ' A' ' 58' ' ' HIS . 7.8 t60 -146.53 -30.23 0.37 Allowed 'General case' 0 N--CA 1.431 -1.411 0 C-N-CA 124.784 1.234 . . . . 1.0 111.484 -168.221 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 59' ' ' GLN . . . . . 0.485 HE22 HD11 ' A' ' 57' ' ' LEU . 16.5 pm0 -80.88 152.58 28.06 Favored 'General case' 0 N--CA 1.431 -1.409 0 CA-C-O 124.977 2.323 . . . . 1.0 116.845 -169.967 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 59.5 t -91.29 147.29 5.35 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.469 0 CA-C-N 113.008 -1.905 . . . . 1.0 108.096 171.615 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 61' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -106.8 148.06 28.94 Favored 'General case' 0 N--CA 1.43 -1.462 0 O-C-N 120.139 -1.601 . . . . 1.0 107.972 175.681 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 2.4 pt? -146.49 115.93 7.11 Favored 'General case' 0 N--CA 1.428 -1.536 0 CA-C-O 123.248 1.499 . . . . 1.0 111.122 166.019 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -100.29 140.27 34.78 Favored 'General case' 0 N--CA 1.431 -1.39 0 CA-C-O 123.255 1.502 . . . . 1.0 113.779 172.644 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 64' ' ' THR . . . . . . . . . . . . . 9.0 t -151.86 -167.15 2.7 Favored 'General case' 0 N--CA 1.431 -1.421 0 C-N-CA 126.364 1.866 . . . . 1.0 107.318 -169.137 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 33.1 tptt -69.49 -29.96 67.73 Favored 'General case' 0 N--CA 1.43 -1.466 0 N-CA-C 116.286 1.958 . . . . 1.0 116.286 -165.847 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 11.1 tt0 -77.7 -13.3 59.94 Favored 'General case' 0 N--CA 1.429 -1.485 0 O-C-N 120.208 -1.557 . . . . 1.0 113.874 176.079 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 146.67 -56.42 0.51 Allowed Glycine 0 N--CA 1.43 -1.748 0 O-C-N 119.529 -1.982 . . . . 1.0 112.133 174.123 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 123.67 124.44 2.9 Favored Glycine 0 N--CA 1.43 -1.714 0 O-C-N 121.723 -0.869 . . . . 1.0 115.002 -176.704 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 19.6 m-30 -120.56 170.16 9.67 Favored 'General case' 0 N--CA 1.43 -1.442 0 C-N-CA 125.727 1.611 . . . . 1.0 107.392 -177.227 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 28.4 p80 -114.54 159.34 20.51 Favored 'General case' 0 N--CA 1.43 -1.434 0 O-C-N 119.796 -1.815 . . . . 1.0 111.905 170.221 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 71' ' ' PHE . . . . . . . . . . . . 0.259 20.0 t80 -118.48 113.27 21.08 Favored 'General case' 0 N--CA 1.432 -1.361 0 C-N-CA 127.291 2.236 . . . . 1.0 108.587 -160.607 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -128.58 166.45 18.83 Favored 'General case' 0 N--CA 1.429 -1.49 0 C-N-CA 124.713 1.205 . . . . 1.0 108.689 -170.371 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -112.35 121.31 44.5 Favored 'General case' 0 N--CA 1.43 -1.447 0 O-C-N 119.02 -2.3 . . . . 1.0 112.865 -163.633 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 12.1 mmtm -110.97 79.64 1.22 Allowed 'General case' 0 N--CA 1.431 -1.399 0 O-C-N 120.057 -1.652 . . . . 1.0 110.143 167.572 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . 72.36 -79.92 0.64 Allowed Glycine 0 N--CA 1.431 -1.675 0 C-N-CA 125.668 1.604 . . . . 1.0 115.93 173.452 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -116.75 -7.49 11.49 Favored 'General case' 0 N--CA 1.429 -1.504 0 C-N-CA 125.233 1.413 . . . . 1.0 110.862 -178.739 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 53.9 mt-10 -131.16 125.47 33.11 Favored 'General case' 0 N--CA 1.43 -1.469 0 N-CA-C 105.537 -2.023 . . . . 1.0 105.537 -171.687 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 78' ' ' TRP . . . . . 0.427 ' HB2' ' HB3' ' A' ' 87' ' ' PHE . 71.3 m95 -82.82 111.51 18.8 Favored 'General case' 0 N--CA 1.43 -1.428 0 N-CA-C 107.391 -1.337 . . . . 1.0 107.391 174.472 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 8.6 mt -90.21 124.85 43.04 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.433 0 CA-C-O 124.032 1.872 . . . . 1.0 107.437 178.373 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 80' ' ' CYS . . . . . 0.445 ' HG ' HD22 ' A' ' 90' ' ' LEU . 38.5 m -76.96 121.36 23.36 Favored 'General case' 0 N--CA 1.429 -1.496 0 CA-C-N 113.971 -1.468 . . . . 1.0 108.7 177.935 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 11.8 t70 -71.75 -41.62 68.23 Favored 'General case' 0 N--CA 1.429 -1.51 0 N-CA-C 114.634 1.346 . . . . 1.0 114.634 -154.223 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 24.1 mmt85 -70.94 129.63 39.52 Favored 'General case' 0 N--CA 1.43 -1.46 0 O-C-N 121.195 -0.941 . . . . 1.0 109.057 173.545 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 83' ' ' SER . . . . . . . . . . . . 0.257 29.6 t 69.8 -71.09 0.13 Allowed 'General case' 0 N--CA 1.43 -1.446 0 C-N-CA 125.91 1.684 . . . . 1.0 112.21 -159.482 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 120.85 68.09 0.27 Allowed Glycine 0 N--CA 1.431 -1.663 0 N-CA-C 108.066 -2.013 . . . . 1.0 108.066 -168.467 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 85' ' ' GLU . . . . . 0.4 ' HB2' ' HB2' ' A' ' 80' ' ' CYS . 60.1 mm-40 -113.83 -145.48 0.4 Allowed 'General case' 0 N--CA 1.429 -1.477 0 C-N-CA 124.737 1.215 . . . . 1.0 108.306 -171.252 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 93.2 m -150.57 133.99 16.38 Favored 'General case' 0 N--CA 1.43 -1.474 0 O-C-N 119.561 -1.962 . . . . 1.0 108.945 -160.685 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 87' ' ' PHE . . . . . 0.427 ' HB3' ' HB2' ' A' ' 78' ' ' TRP 0.278 0.0 OUTLIER -39.91 -85.95 0.0 OUTLIER 'General case' 0 N--CA 1.43 -1.447 0 N-CA-C 120.373 3.471 . . . . 1.0 120.373 179.923 . . . . . . . . 4 4 . 1 . 012 nuclear orig core ' A' A ' 88' ' ' TRP . . . . . . . . . . . . . 65.9 m95 -68.85 -29.62 67.97 Favored 'General case' 0 N--CA 1.43 -1.433 0 O-C-N 120.682 -1.261 . . . . 1.0 113.321 -172.956 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 24.0 m-20 -71.31 -38.81 71.73 Favored 'General case' 0 N--CA 1.429 -1.485 0 O-C-N 120.987 -1.071 . . . . 1.0 113.607 175.87 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 90' ' ' LEU . . . . . 0.445 HD22 ' HG ' ' A' ' 80' ' ' CYS . 45.3 tp -69.06 -44.07 73.35 Favored 'General case' 0 N--CA 1.43 -1.447 0 O-C-N 119.817 -1.802 . . . . 1.0 110.658 175.987 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 10.2 tt -49.14 -50.55 37.0 Favored 'General case' 0 N--CA 1.43 -1.429 0 C-N-CA 126.494 1.917 . . . . 1.0 113.371 172.272 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 37.4 tt0 -54.97 -57.93 9.68 Favored 'General case' 0 N--CA 1.431 -1.41 0 C-N-CA 126.706 2.002 . . . . 1.0 113.133 171.694 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 30.4 tt0 -50.58 -48.27 57.65 Favored 'General case' 0 CA--C 1.488 -1.414 0 C-N-CA 127.337 2.255 . . . . 1.0 114.595 178.364 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -65.85 -45.96 80.25 Favored 'General case' 0 N--CA 1.431 -1.421 0 C-N-CA 127.39 2.276 . . . . 1.0 114.377 174.919 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -63.19 -43.87 96.98 Favored 'General case' 0 N--CA 1.43 -1.46 0 O-C-N 120.03 -1.669 . . . . 1.0 112.97 177.453 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 15.5 m -55.46 -43.41 75.43 Favored 'General case' 0 N--CA 1.43 -1.472 0 C-N-CA 126.17 1.788 . . . . 1.0 114.087 170.017 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 2.2 pt20 -72.41 -28.55 63.05 Favored 'General case' 0 N--CA 1.43 -1.439 0 N-CA-C 114.893 1.442 . . . . 1.0 114.893 177.154 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 14.3 mm-40 -66.91 -57.37 7.09 Favored 'General case' 0 N--CA 1.43 -1.47 0 O-C-N 120.906 -1.122 . . . . 1.0 111.992 171.235 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -80.02 -46.21 17.01 Favored 'General case' 0 N--CA 1.43 -1.448 0 N-CA-C 115.723 1.749 . . . . 1.0 115.723 -172.323 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . 87.6 49.52 3.86 Favored Glycine 0 N--CA 1.43 -1.721 0 O-C-N 120.935 -1.103 . . . . 1.0 112.048 -168.37 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 19.3 tt0 -164.81 159.53 18.59 Favored 'General case' 0 N--CA 1.429 -1.513 0 N-CA-C 106.252 -1.759 . . . . 1.0 106.252 -176.268 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 45.9 m -72.16 99.09 2.26 Favored 'General case' 0 N--CA 1.431 -1.406 0 O-C-N 119.554 -1.966 . . . . 1.0 110.681 166.227 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 46.2 t -110.51 112.7 41.71 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.433 0 N-CA-C 105.643 -1.984 . . . . 1.0 105.643 178.066 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 7.5 t -141.42 176.44 8.86 Favored 'General case' 0 N--CA 1.431 -1.413 0 O-C-N 121.328 -0.857 . . . . 1.0 109.591 -171.043 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 5.7 m-85 -111.69 -14.99 13.53 Favored 'General case' 0 N--CA 1.43 -1.439 0 C-N-CA 125.147 1.379 . . . . 1.0 110.288 174.418 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 37.1 mmt180 . . . . . 0 C--O 1.26 1.649 0 O-C-N 120.619 -1.301 . . . . 1.0 111.554 -176.87 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 1.4 t-20 . . . . . 0 N--CA 1.43 -1.426 0 N-CA-C 113.251 0.834 . . . . 1.0 113.251 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 3' ' ' ASP . . . . . . . . . . . . 0.266 1.3 p-10 -61.54 -48.9 78.93 Favored 'General case' 0 N--CA 1.431 -1.395 0 N-CA-C 116.153 1.908 . . . . 1.0 116.153 -164.752 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 63.2 p -61.97 -37.53 85.11 Favored 'General case' 0 N--CA 1.43 -1.44 0 C-N-CA 124.855 1.262 . . . . 1.0 113.04 179.146 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 28.9 mt-10 -69.85 -49.61 50.72 Favored 'General case' 0 N--CA 1.43 -1.435 0 C-N-CA 126.501 1.92 . . . . 1.0 112.102 179.725 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 2.3 m-85 -60.14 -38.6 83.6 Favored 'General case' 0 N--CA 1.431 -1.392 0 C-N-CA 124.177 0.991 . . . . 1.0 112.93 172.815 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 25.2 t60 -65.76 -48.38 72.02 Favored 'General case' 0 N--CA 1.43 -1.459 0 C-N-CA 125.744 1.618 . . . . 1.0 111.792 177.684 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 41.8 ttp-105 -56.03 -57.04 13.81 Favored 'General case' 0 N--CA 1.431 -1.425 0 C-N-CA 124.808 1.243 . . . . 1.0 112.888 177.708 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 36.9 mt -57.74 -42.06 83.12 Favored 'General case' 0 N--CA 1.431 -1.412 0 C-N-CA 124.212 1.005 . . . . 1.0 113.235 178.147 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -57.23 -57.96 10.32 Favored 'General case' 0 N--CA 1.431 -1.376 0 C-N-CA 124.3 1.04 . . . . 1.0 113.123 173.006 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 14.6 t70 -54.43 -45.75 73.07 Favored 'General case' 0 CA--C 1.489 -1.396 0 C-N-CA 125.613 1.565 . . . . 1.0 113.877 -177.005 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 18.4 mt-30 -57.23 -55.2 37.88 Favored 'General case' 0 N--CA 1.431 -1.424 0 N-CA-C 115.194 1.553 . . . . 1.0 115.194 170.694 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 3.1 pp -70.9 -37.04 72.96 Favored 'General case' 0 N--CA 1.43 -1.463 0 O-C-N 119.738 -1.851 . . . . 1.0 115.789 -178.113 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 0.8 OUTLIER -43.91 -60.15 1.96 Allowed 'General case' 0 N--CA 1.429 -1.489 0 C-N-CA 128.155 2.582 . . . . 1.0 112.425 165.859 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 50.7 tp -62.01 -42.72 99.46 Favored 'General case' 0 N--CA 1.429 -1.478 0 C-N-CA 124.299 1.04 . . . . 1.0 113.611 178.396 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 87.4 m -55.44 -52.07 64.8 Favored 'General case' 0 N--CA 1.431 -1.41 0 C-N-CA 125.609 1.564 . . . . 1.0 112.986 176.61 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 78.0 mt -58.78 -52.26 62.26 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.462 0 C-N-CA 125.825 1.65 . . . . 1.0 112.27 175.71 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 2.1 tt0 -56.2 -49.93 72.66 Favored 'General case' 0 N--CA 1.43 -1.432 0 N-CA-C 114.194 1.183 . . . . 1.0 114.194 -177.729 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 34.1 tt0 -65.32 -48.54 72.72 Favored 'General case' 0 N--CA 1.43 -1.436 0 O-C-N 120.928 -1.108 . . . . 1.0 113.637 178.361 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 7.9 tpt180 -61.8 -49.83 74.76 Favored 'General case' 0 N--CA 1.43 -1.454 0 C-N-CA 124.045 0.938 . . . . 1.0 112.647 -176.843 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 11.2 mp -72.62 -30.2 64.13 Favored 'General case' 0 N--CA 1.43 -1.45 0 C-N-CA 124.494 1.118 . . . . 1.0 113.733 -177.756 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 7.9 t70 -66.48 -51.97 51.08 Favored 'General case' 0 N--CA 1.429 -1.509 0 O-C-N 120.371 -1.455 . . . . 1.0 113.506 171.356 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 2.0 t70 -69.82 -24.35 63.45 Favored 'General case' 0 N--CA 1.429 -1.494 0 O-C-N 120.15 -1.594 . . . . 1.0 113.597 -176.525 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 24' ' ' TRP . . . . . . . . . . . . . 59.3 t-105 -45.9 -54.01 8.9 Favored 'General case' 0 N--CA 1.429 -1.492 0 C-N-CA 128.201 2.6 . . . . 1.0 116.989 178.366 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 28.6 t0 66.27 173.6 0.24 Allowed 'General case' 0 N--CA 1.429 -1.492 0 C-N-CA 127.033 2.133 . . . . 1.0 112.884 -175.406 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -168.3 -151.83 7.31 Favored Glycine 0 N--CA 1.429 -1.801 0 O-C-N 119.053 -2.279 . . . . 1.0 112.574 -172.599 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 36.7 t70 -83.45 -47.23 11.61 Favored 'General case' 0 N--CA 1.43 -1.427 0 N-CA-C 107.697 -1.223 . . . . 1.0 107.697 161.736 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 83.2 p -87.62 167.61 13.75 Favored 'General case' 0 N--CA 1.429 -1.506 0 C-N-CA 124.807 1.243 . . . . 1.0 110.988 173.566 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . 0.436 ' H ' ' HG2' ' A' ' 44' ' ' GLU . 2.9 t70 -110.09 179.21 4.17 Favored 'General case' 0 N--CA 1.43 -1.453 0 O-C-N 120.763 -1.211 . . . . 1.0 109.583 -173.016 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -157.61 129.24 0.95 Allowed 'Isoleucine or valine' 0 N--CA 1.43 -1.46 0 CA-C-O 123.117 1.437 . . . . 1.0 108.933 -161.874 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 26.7 m-20 -132.72 105.31 7.1 Favored 'General case' 0 N--CA 1.429 -1.489 0 C-N-CA 126.707 2.003 . . . . 1.0 110.343 170.041 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 10.4 t -85.23 142.44 29.41 Favored 'General case' 0 N--CA 1.43 -1.469 0 O-C-N 118.92 -2.362 . . . . 1.0 110.809 170.811 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 2.2 tp10 -113.5 137.88 50.92 Favored 'General case' 0 N--CA 1.428 -1.546 0 C-N-CA 124.13 0.972 . . . . 1.0 109.9 178.708 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 5.1 tp -117.44 121.03 66.63 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.428 0 C-N-CA 126.516 1.926 . . . . 1.0 107.079 178.759 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 32.0 m120 -124.77 -176.33 3.51 Favored 'General case' 0 N--CA 1.43 -1.45 0 C-N-CA 126.1 1.76 . . . . 1.0 108.52 168.31 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -65.52 91.08 0.13 Allowed Glycine 0 N--CA 1.43 -1.703 0 O-C-N 120.105 -1.622 . . . . 1.0 116.047 -171.0 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 85.65 2.93 86.62 Favored Glycine 0 N--CA 1.429 -1.815 0 C-N-CA 125.115 1.341 . . . . 1.0 113.898 -176.258 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 33.4 t -124.53 125.38 70.07 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.449 0 C-N-CA 124.045 0.938 . . . . 1.0 109.983 -168.88 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 27.7 mt -115.73 130.63 56.92 Favored 'General case' 0 N--CA 1.43 -1.462 0 CA-C-O 122.623 1.202 . . . . 1.0 108.239 165.242 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 5.2 p -120.87 119.44 32.67 Favored 'General case' 0 N--CA 1.429 -1.482 0 N-CA-C 106.995 -1.483 . . . . 1.0 106.995 170.773 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 33.5 mt -92.82 113.09 27.19 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.455 0 N-CA-C 106.8 -1.556 . . . . 1.0 106.8 -177.203 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -99.35 128.04 45.43 Favored 'General case' 0 N--CA 1.43 -1.464 0 N-CA-C 108.434 -0.95 . . . . 1.0 108.434 -175.979 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 43' ' ' PHE . . . . . . . . . . . . . 5.4 p90 -116.14 151.06 36.38 Favored 'General case' 0 N--CA 1.43 -1.435 0 N-CA-C 107.394 -1.336 . . . . 1.0 107.394 171.386 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . 0.436 ' HG2' ' H ' ' A' ' 29' ' ' ASP . 0.2 OUTLIER -71.18 -13.42 61.92 Favored 'General case' 0 N--CA 1.43 -1.444 0 N-CA-C 116.334 1.976 . . . . 1.0 116.334 -153.986 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 19.7 t-20 -64.95 -19.56 66.02 Favored 'General case' 0 N--CA 1.43 -1.447 0 C-N-CA 127.457 2.303 . . . . 1.0 113.219 172.909 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 102.32 13.81 29.85 Favored Glycine 0 N--CA 1.429 -1.796 0 O-C-N 120.37 -1.456 . . . . 1.0 114.186 170.145 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 3.5 m -112.3 174.02 6.08 Favored 'General case' 0 N--CA 1.43 -1.458 0 C-N-CA 124.473 1.109 . . . . 1.0 109.036 172.083 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 20.9 pttm -156.9 148.92 22.85 Favored 'General case' 0 N--CA 1.431 -1.393 0 O-C-N 120.938 -1.101 . . . . 1.0 113.378 -160.863 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 7.5 mm -97.13 138.44 22.07 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.454 0 N-CA-C 106.355 -1.72 . . . . 1.0 106.355 171.171 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 50' ' ' ILE . . . . . 0.402 ' HB ' ' HB3' ' A' ' 63' ' ' ALA . 4.1 mm -122.77 115.89 47.21 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.473 0 CA-C-N 119.598 1.09 . . . . 1.0 110.233 -175.953 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 2.1 mt -129.4 126.22 63.19 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.501 0 O-C-N 120.536 -1.352 . . . . 1.0 110.61 176.868 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 52' ' ' ASN . . . . . 0.419 ' H ' ' HD1' ' A' ' 61' ' ' TRP . 15.1 p30 -151.2 165.47 33.82 Favored 'General case' 0 N--CA 1.429 -1.509 0 CA-C-O 122.971 1.367 . . . . 1.0 108.592 176.923 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 40.1 ptt85 -148.78 152.44 36.55 Favored 'General case' 0 N--CA 1.431 -1.41 0 CA-C-N 114.474 -1.239 . . . . 1.0 108.877 -172.67 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 68.8 mm-40 -116.4 107.99 15.48 Favored 'General case' 0 N--CA 1.429 -1.478 0 N-CA-C 107.026 -1.472 . . . . 1.0 107.026 171.46 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 15.5 tt0 -58.95 -41.61 89.45 Favored Pre-proline 0 N--CA 1.43 -1.435 0 N-CA-C 116.112 1.893 . . . . 1.0 116.112 -172.504 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 83.7 Cg_exo -69.25 -18.49 39.39 Favored 'Trans proline' 0 N--CA 1.433 -2.052 0 CA-C-N 126.173 3.24 . . . . 1.0 117.79 178.185 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . 0.381 3.9 pp -96.72 -14.41 22.05 Favored 'General case' 0 N--CA 1.431 -1.414 0 N-CA-C 116.744 2.127 . . . . 1.0 116.744 -170.766 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 5.9 m170 73.23 52.96 0.13 Allowed 'General case' 0 N--CA 1.43 -1.436 0 C-N-CA 125.003 1.321 . . . . 1.0 114.536 174.095 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 34.0 tt0 -162.05 158.26 24.66 Favored 'General case' 0 N--CA 1.43 -1.438 0 C-N-CA 124.515 1.126 . . . . 1.0 108.079 172.45 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 55.0 t -119.38 152.76 21.87 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.48 0 C-N-CA 126.106 1.762 . . . . 1.0 110.408 178.997 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 61' ' ' TRP . . . . . 0.419 ' HD1' ' H ' ' A' ' 52' ' ' ASN . 0.0 OUTLIER -104.84 152.59 22.42 Favored 'General case' 0 N--CA 1.43 -1.448 0 C-N-CA 125.463 1.505 . . . . 1.0 109.471 176.026 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -145.12 97.02 2.94 Favored 'General case' 0 N--CA 1.431 -1.401 0 O-C-N 120.804 -1.185 . . . . 1.0 110.548 -176.874 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . 0.402 ' HB3' ' HB ' ' A' ' 50' ' ' ILE . . . -122.6 149.18 44.33 Favored 'General case' 0 N--CA 1.431 -1.416 0 O-C-N 119.708 -1.87 . . . . 1.0 115.993 179.508 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 64' ' ' THR . . . . . . . . . . . . . 5.9 m -151.24 -94.69 0.06 Allowed 'General case' 0 N--CA 1.429 -1.482 0 C-N-CA 125.504 1.522 . . . . 1.0 111.269 175.041 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 10.7 tmtt? -99.59 -44.26 6.2 Favored 'General case' 0 N--CA 1.43 -1.448 0 C-N-CA 125.217 1.407 . . . . 1.0 110.387 -172.555 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 33.3 mm-40 -70.33 -23.57 62.85 Favored 'General case' 0 N--CA 1.43 -1.469 0 N-CA-C 113.831 1.048 . . . . 1.0 113.831 -174.403 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 136.75 -39.62 1.62 Allowed Glycine 0 N--CA 1.43 -1.757 0 O-C-N 121.398 -0.814 . . . . 1.0 111.9 166.774 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 140.95 123.86 1.99 Allowed Glycine 0 N--CA 1.43 -1.718 0 CA-C-O 122.279 0.933 . . . . 1.0 113.434 -179.842 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 21.5 m-30 -115.55 170.09 8.68 Favored 'General case' 0 N--CA 1.431 -1.424 0 C-N-CA 126.383 1.873 . . . . 1.0 107.189 176.744 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -115.29 161.02 19.07 Favored 'General case' 0 N--CA 1.43 -1.451 0 O-C-N 120.366 -1.459 . . . . 1.0 110.032 168.2 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 71' ' ' PHE . . . . . . . . . . . . 0.279 28.7 t80 -140.1 126.16 19.75 Favored 'General case' 0 N--CA 1.431 -1.413 0 C-N-CA 123.836 0.854 . . . . 1.0 109.889 -151.437 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 35.0 m-20 -136.73 156.51 48.42 Favored 'General case' 0 N--CA 1.43 -1.453 0 CA-C-O 121.994 0.902 . . . . 1.0 111.48 179.401 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 67.9 tp -84.69 136.72 33.61 Favored 'General case' 0 N--CA 1.43 -1.454 0 O-C-N 120.411 -1.431 . . . . 1.0 111.757 173.007 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 72.4 mmtt -89.19 -86.17 0.19 Allowed 'General case' 0 N--CA 1.43 -1.455 0 C-N-CA 124.868 1.267 . . . . 1.0 110.282 161.907 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -138.09 -55.31 0.05 OUTLIER Glycine 0 N--CA 1.428 -1.856 0 O-C-N 120.723 -1.235 . . . . 1.0 112.732 175.451 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 78.7 m-20 -97.2 -20.15 18.12 Favored 'General case' 0 N--CA 1.43 -1.467 0 C-N-CA 124.663 1.185 . . . . 1.0 110.755 173.742 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 26.6 tt0 -133.98 121.33 21.47 Favored 'General case' 0 N--CA 1.43 -1.441 0 N-CA-C 107.168 -1.419 . . . . 1.0 107.168 -151.673 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 78' ' ' TRP . . . . . . . . . . . . . 48.7 m95 -83.72 107.14 15.96 Favored 'General case' 0 N--CA 1.431 -1.403 0 N-CA-C 106.626 -1.62 . . . . 1.0 106.626 167.251 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER -93.2 154.28 3.25 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.467 0 CA-C-O 123.425 1.583 . . . . 1.0 107.142 178.885 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 59.2 m -84.08 125.59 32.26 Favored 'General case' 0 N--CA 1.431 -1.422 0 O-C-N 120.65 -1.281 . . . . 1.0 108.153 173.191 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 38.5 t70 -69.57 -53.77 17.29 Favored 'General case' 0 N--CA 1.43 -1.46 0 C-N-CA 126.38 1.872 . . . . 1.0 110.621 -173.551 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -76.46 137.23 39.56 Favored 'General case' 0 N--CA 1.428 -1.535 0 C-N-CA 125.961 1.704 . . . . 1.0 108.515 177.655 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 48.9 m 73.11 -59.63 0.56 Allowed 'General case' 0 N--CA 1.429 -1.52 0 C-N-CA 125.966 1.707 . . . . 1.0 113.161 -170.846 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 112.09 92.28 2.05 Favored Glycine 0 N--CA 1.429 -1.767 0 N-CA-C 109.008 -1.637 . . . . 1.0 109.008 -177.522 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -153.22 -154.04 0.51 Allowed 'General case' 0 N--CA 1.429 -1.485 0 CA-C-N 118.67 1.235 . . . . 1.0 109.513 -170.409 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 51.7 m -150.38 131.57 14.48 Favored 'General case' 0 N--CA 1.429 -1.489 0 O-C-N 120.671 -1.268 . . . . 1.0 109.501 -157.451 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . 0.26 0.0 OUTLIER -36.53 -91.63 0.0 OUTLIER 'General case' 0 N--CA 1.43 -1.462 0 N-CA-C 121.45 3.87 . . . . 1.0 121.45 178.827 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 88' ' ' TRP . . . . . . . . . . . . . 91.6 m95 -63.68 -27.87 69.52 Favored 'General case' 0 N--CA 1.429 -1.509 0 O-C-N 120.009 -1.682 . . . . 1.0 113.146 -173.198 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 3.2 t70 -68.9 -44.25 73.59 Favored 'General case' 0 N--CA 1.431 -1.41 0 C-N-CA 126.125 1.77 . . . . 1.0 112.601 175.857 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 45.1 tp -66.05 -45.15 82.42 Favored 'General case' 0 N--CA 1.43 -1.469 0 O-C-N 120.44 -1.413 . . . . 1.0 111.037 177.57 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 26.3 tp -55.92 -43.14 77.07 Favored 'General case' 0 N--CA 1.43 -1.475 0 C-N-CA 124.528 1.131 . . . . 1.0 113.472 175.868 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 34.6 tt0 -60.53 -47.49 85.93 Favored 'General case' 0 N--CA 1.431 -1.412 0 C-N-CA 126.254 1.821 . . . . 1.0 112.889 173.036 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 24.0 tt0 -59.18 -54.32 48.23 Favored 'General case' 0 N--CA 1.429 -1.48 0 C-N-CA 126.652 1.981 . . . . 1.0 113.45 177.538 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -54.05 -41.89 68.61 Favored 'General case' 0 N--CA 1.429 -1.48 0 C-N-CA 127.972 2.509 . . . . 1.0 114.264 175.328 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -73.94 -51.72 15.17 Favored 'General case' 0 N--CA 1.43 -1.436 0 N-CA-C 114.781 1.4 . . . . 1.0 114.781 178.546 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 1.6 t -61.16 -26.35 67.64 Favored 'General case' 0 N--CA 1.43 -1.464 0 O-C-N 119.236 -2.165 . . . . 1.0 114.1 175.809 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 7.5 tp-100 -62.65 -70.0 0.23 Allowed 'General case' 0 N--CA 1.43 -1.453 0 C-N-CA 126.31 1.844 . . . . 1.0 112.431 168.139 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 18.4 mt-30 -76.98 -48.31 18.37 Favored 'General case' 0 N--CA 1.43 -1.434 0 N-CA-C 116.411 2.004 . . . . 1.0 116.411 -175.369 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -73.5 -36.5 65.77 Favored 'General case' 0 N--CA 1.431 -1.414 0 O-C-N 120.059 -1.651 . . . . 1.0 112.067 -177.464 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . 93.1 28.3 12.08 Favored Glycine 0 N--CA 1.43 -1.719 0 C-N-CA 123.927 0.775 . . . . 1.0 113.956 171.981 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 27.7 mt-10 -145.91 168.92 19.67 Favored 'General case' 0 N--CA 1.431 -1.421 0 O-C-N 121.821 -0.811 . . . . 1.0 111.401 -172.749 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 6.8 m -78.91 78.92 5.33 Favored 'General case' 0 N--CA 1.431 -1.399 0 CA-C-O 122.792 1.282 . . . . 1.0 110.61 173.554 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 47.4 t -93.05 93.36 4.13 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.436 0 C-N-CA 126.687 1.995 . . . . 1.0 106.73 174.571 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 7.9 t -140.47 166.37 24.89 Favored 'General case' 0 N--CA 1.429 -1.48 0 CA-C-N 115.324 -0.853 . . . . 1.0 110.609 -175.367 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -120.3 -12.79 8.97 Favored 'General case' 0 N--CA 1.43 -1.444 0 C-N-CA 125.061 1.345 . . . . 1.0 109.714 175.935 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 75.6 mtm180 . . . . . 0 C--O 1.26 1.617 0 O-C-N 120.519 -1.363 . . . . 1.0 111.839 -174.174 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 7.3 m120 . . . . . 0 N--CA 1.429 -1.481 0 N-CA-C 114.117 1.154 . . . . 1.0 114.117 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 3.1 m-20 -59.33 -54.42 47.0 Favored 'General case' 0 N--CA 1.431 -1.391 0 C-N-CA 125.612 1.565 . . . . 1.0 111.656 176.581 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 23.1 t -57.7 -45.21 85.99 Favored 'General case' 0 N--CA 1.431 -1.411 0 C-N-CA 126.344 1.857 . . . . 1.0 113.558 177.01 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 88.0 tt0 -54.74 -60.51 3.26 Favored 'General case' 0 N--CA 1.431 -1.402 0 C-N-CA 126.08 1.752 . . . . 1.0 113.723 176.051 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 1.1 t80 -67.31 -25.21 65.91 Favored 'General case' 0 N--CA 1.43 -1.444 0 N-CA-C 115.4 1.63 . . . . 1.0 115.4 179.934 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 16.7 t60 -64.75 -46.01 84.03 Favored 'General case' 0 N--CA 1.43 -1.444 0 C-N-CA 125.935 1.694 . . . . 1.0 113.42 171.355 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 18.4 mmm180 -61.59 -48.89 78.88 Favored 'General case' 0 N--CA 1.431 -1.425 0 C-N-CA 124.958 1.303 . . . . 1.0 112.576 174.625 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 90.6 mt -57.07 -41.02 78.0 Favored 'General case' 0 N--CA 1.43 -1.431 0 C-N-CA 124.379 1.072 . . . . 1.0 113.133 174.449 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -58.88 -53.33 59.58 Favored 'General case' 0 N--CA 1.431 -1.413 0 C-N-CA 125.948 1.699 . . . . 1.0 113.349 176.304 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -56.04 -41.81 75.57 Favored 'General case' 0 N--CA 1.431 -1.399 0 N-CA-C 114.003 1.112 . . . . 1.0 114.003 176.432 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 97.1 mm-40 -63.0 -51.07 68.25 Favored 'General case' 0 N--CA 1.431 -1.415 0 N-CA-C 114.614 1.338 . . . . 1.0 114.614 174.961 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 3.6 pp -70.57 -39.72 73.74 Favored 'General case' 0 N--CA 1.429 -1.5 0 O-C-N 120.135 -1.603 . . . . 1.0 114.517 -179.925 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 0.2 OUTLIER -50.83 -49.89 57.78 Favored 'General case' 0 N--CA 1.43 -1.472 0 C-N-CA 125.789 1.636 . . . . 1.0 113.682 168.78 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 45.2 tp -62.51 -47.45 83.89 Favored 'General case' 0 N--CA 1.43 -1.461 0 O-C-N 121.402 -0.811 . . . . 1.0 112.673 177.167 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 20.2 m -64.75 -50.31 67.36 Favored 'General case' 0 N--CA 1.43 -1.43 0 C-N-CA 124.544 1.138 . . . . 1.0 114.069 -177.376 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 79.9 mt -54.62 -49.37 67.79 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.474 0 O-C-N 119.781 -1.825 . . . . 1.0 114.593 169.447 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 22.8 tt0 -59.35 -47.28 86.02 Favored 'General case' 0 N--CA 1.429 -1.495 0 O-C-N 120.555 -1.341 . . . . 1.0 112.175 177.006 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 3.5 tt0 -56.53 -40.63 75.4 Favored 'General case' 0 N--CA 1.43 -1.453 0 C-N-CA 125.053 1.341 . . . . 1.0 113.801 175.012 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 49.8 tpt85 -57.92 -51.05 71.23 Favored 'General case' 0 N--CA 1.429 -1.476 0 O-C-N 119.309 -2.119 . . . . 1.0 113.255 172.06 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 4.6 mm? -72.71 -47.15 49.5 Favored 'General case' 0 N--CA 1.431 -1.387 0 N-CA-C 114.329 1.233 . . . . 1.0 114.329 -176.924 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 19.0 t70 -74.4 -49.15 23.73 Favored 'General case' 0 N--CA 1.43 -1.448 0 C-N-CA 125.605 1.562 . . . . 1.0 114.092 -175.012 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 13.6 t70 -84.45 -39.75 18.56 Favored 'General case' 0 N--CA 1.43 -1.452 0 O-C-N 120.446 -1.408 . . . . 1.0 113.124 -170.944 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 24' ' ' TRP . . . . . . . . . . . . . 4.5 t90 -85.67 106.48 16.98 Favored 'General case' 0 N--CA 1.43 -1.44 0 O-C-N 119.803 -1.811 . . . . 1.0 108.982 172.38 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 1.4 t70 -80.95 -172.05 3.51 Favored 'General case' 0 N--CA 1.431 -1.418 0 CA-C-O 123.179 1.466 . . . . 1.0 113.645 -165.018 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -166.39 -171.05 32.09 Favored Glycine 0 N--CA 1.43 -1.745 0 O-C-N 119.815 -1.803 . . . . 1.0 111.637 -172.191 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 1.7 t70 -83.28 -39.12 21.24 Favored 'General case' 0 N--CA 1.43 -1.461 0 O-C-N 121.429 -1.042 . . . . 1.0 110.789 178.501 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 22.6 m -81.92 160.33 23.42 Favored 'General case' 0 N--CA 1.429 -1.482 0 CA-C-O 122.279 1.038 . . . . 1.0 111.709 174.36 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 1.8 t70 -76.59 175.85 8.89 Favored 'General case' 0 N--CA 1.43 -1.434 0 C-N-CA 125.205 1.402 . . . . 1.0 111.057 176.094 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 10.2 tp -159.74 115.22 0.16 Allowed 'Isoleucine or valine' 0 N--CA 1.43 -1.44 0 CA-C-O 123.54 1.638 . . . . 1.0 111.005 -167.254 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 36.9 m-20 -125.26 102.68 7.56 Favored 'General case' 0 N--CA 1.43 -1.459 0 O-C-N 120.648 -1.282 . . . . 1.0 109.696 169.129 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 36.7 m -94.14 125.14 38.59 Favored 'General case' 0 N--CA 1.429 -1.482 0 O-C-N 119.18 -2.2 . . . . 1.0 111.093 166.289 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -90.36 131.93 35.87 Favored 'General case' 0 N--CA 1.429 -1.493 0 C-N-CA 125.074 1.35 . . . . 1.0 110.906 -176.298 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 3.3 mm -105.56 105.77 19.29 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.489 0 C-N-CA 126.479 1.912 . . . . 1.0 106.238 -178.836 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -132.89 63.81 1.63 Allowed 'General case' 0 N--CA 1.429 -1.475 0 O-C-N 121.392 -0.818 . . . . 1.0 111.613 -176.129 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . 33.46 67.4 0.22 Allowed Glycine 0 N--CA 1.43 -1.748 0 C-N-CA 128.671 3.034 . . . . 1.0 119.559 169.467 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 114.89 -22.67 12.4 Favored Glycine 0 N--CA 1.431 -1.645 0 N-CA-C 111.031 -0.827 . . . . 1.0 111.031 -173.933 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 72.8 t -109.63 137.22 42.81 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.424 0 C-N-CA 124.676 1.19 . . . . 1.0 108.269 173.889 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 42.8 mt -119.57 129.75 54.8 Favored 'General case' 0 N--CA 1.43 -1.464 0 O-C-N 120.812 -1.18 . . . . 1.0 108.923 154.557 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -122.95 118.14 27.15 Favored 'General case' 0 N--CA 1.429 -1.48 0 CA-C-O 122.91 1.338 . . . . 1.0 108.237 177.103 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 81.7 mt -97.3 128.38 48.62 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.439 0 O-C-N 120.638 -1.289 . . . . 1.0 108.398 -172.763 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 69.5 p -129.62 122.19 28.58 Favored 'General case' 0 N--CA 1.429 -1.517 0 CA-C-O 122.018 0.913 . . . . 1.0 113.205 175.271 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 43' ' ' PHE . . . . . . . . . . . . . 5.2 p90 -120.49 167.73 12.07 Favored 'General case' 0 N--CA 1.431 -1.412 0 C-N-CA 125.003 1.321 . . . . 1.0 109.544 166.138 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 40.4 mt-10 -52.4 -36.1 53.37 Favored 'General case' 0 N--CA 1.431 -1.418 0 N-CA-C 118.63 2.826 . . . . 1.0 118.63 -171.308 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 74.1 m-20 -67.47 -4.22 10.75 Favored 'General case' 0 N--CA 1.429 -1.516 0 O-C-N 120.229 -1.545 . . . . 1.0 115.095 177.495 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 75.54 22.46 75.29 Favored Glycine 0 N--CA 1.432 -1.597 0 O-C-N 120.073 -1.642 . . . . 1.0 115.536 160.881 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 53.5 m -73.65 -47.06 42.77 Favored 'General case' 0 N--CA 1.43 -1.447 0 C-N-CA 124.622 1.169 . . . . 1.0 112.956 -175.175 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 86.0 mttt 75.54 107.55 0.08 Allowed 'General case' 0 N--CA 1.429 -1.479 0 C-N-CA 126.889 2.076 . . . . 1.0 114.768 170.697 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 2.7 mm -102.18 136.23 35.35 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.429 0 N-CA-C 107.367 -1.346 . . . . 1.0 107.367 -177.095 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 9.3 mm -126.18 105.25 14.18 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.437 0 C-N-CA 124.075 0.95 . . . . 1.0 109.359 -169.587 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 3.5 mt -126.88 128.25 70.63 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.416 0 O-C-N 120.249 -1.532 . . . . 1.0 109.936 -170.823 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 51.8 t-20 -161.87 170.84 18.74 Favored 'General case' 0 N--CA 1.43 -1.469 0 N-CA-C 105.197 -2.149 . . . . 1.0 105.197 -167.856 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -156.61 138.03 13.93 Favored 'General case' 0 N--CA 1.43 -1.465 0 O-C-N 121.185 -0.947 . . . . 1.0 113.194 -163.674 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 86.9 mm-40 -99.33 105.21 17.18 Favored 'General case' 0 N--CA 1.431 -1.416 0 C-N-CA 125.71 1.604 . . . . 1.0 109.096 166.574 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . 0.272 9.7 tt0 -65.64 -52.46 43.3 Favored Pre-proline 0 N--CA 1.431 -1.379 0 N-CA-C 116.891 2.182 . . . . 1.0 116.891 -164.419 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 51.7 Cg_exo -68.57 -21.0 40.33 Favored 'Trans proline' 0 C--N 1.299 -2.071 0 CA-C-N 126.3 3.286 . . . . 1.0 115.342 -177.591 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 32.3 mt -74.96 -25.52 58.92 Favored 'General case' 0 N--CA 1.429 -1.495 0 CA-C-N 119.507 1.048 . . . . 1.0 112.019 -174.955 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 25.5 m170 79.38 30.42 0.3 Allowed 'General case' 0 N--CA 1.431 -1.423 0 C-N-CA 128.056 2.543 . . . . 1.0 113.018 -178.767 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 65.1 mt-30 -120.02 132.63 55.53 Favored 'General case' 0 N--CA 1.43 -1.427 0 O-C-N 120.271 -1.518 . . . . 1.0 110.292 176.283 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 8.0 t -90.44 151.57 3.47 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.404 0 N-CA-C 106.515 -1.661 . . . . 1.0 106.515 163.178 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 61' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -111.38 145.65 38.52 Favored 'General case' 0 N--CA 1.43 -1.439 0 O-C-N 120.28 -1.512 . . . . 1.0 107.769 168.866 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 2.6 pt? -138.12 111.25 7.86 Favored 'General case' 0 N--CA 1.432 -1.361 0 O-C-N 120.966 -1.083 . . . . 1.0 108.299 173.471 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -101.6 144.08 30.78 Favored 'General case' 0 N--CA 1.429 -1.48 0 CA-C-O 123.626 1.679 . . . . 1.0 112.291 169.808 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 64' ' ' THR . . . . . . . . . . . . . 39.1 p -150.61 -165.82 2.37 Favored 'General case' 0 N--CA 1.43 -1.431 0 CA-C-N 113.034 -1.894 . . . . 1.0 107.991 -145.973 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 11.7 mmtt -65.13 -43.37 92.17 Favored 'General case' 0 N--CA 1.43 -1.47 0 N-CA-C 115.025 1.491 . . . . 1.0 115.025 168.583 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 29.6 mp0 -79.12 -25.56 42.94 Favored 'General case' 0 N--CA 1.43 -1.462 0 O-C-N 120.208 -1.558 . . . . 1.0 115.075 -170.208 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 159.69 -48.5 0.4 Allowed Glycine 0 N--CA 1.43 -1.735 0 O-C-N 120.37 -1.456 . . . . 1.0 114.557 176.001 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 120.39 121.36 2.87 Favored Glycine 0 N--CA 1.43 -1.725 0 CA-C-O 122.569 1.094 . . . . 1.0 114.901 -179.575 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 23.0 m-30 -122.37 171.09 9.31 Favored 'General case' 0 N--CA 1.429 -1.493 0 C-N-CA 125.499 1.52 . . . . 1.0 108.879 -177.253 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 70' ' ' HIS . . . . . 0.426 ' CE1' ' OD2' ' A' ' 81' ' ' ASP . 4.5 p80 -122.57 161.73 23.15 Favored 'General case' 0 N--CA 1.43 -1.434 0 O-C-N 120.293 -1.505 . . . . 1.0 109.384 169.102 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 71' ' ' PHE . . . . . . . . . . . . 0.286 37.3 t80 -139.43 122.29 16.59 Favored 'General case' 0 N--CA 1.431 -1.398 0 C-N-CA 124.116 0.967 . . . . 1.0 111.57 -145.953 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 11.9 m-20 -129.16 148.86 51.13 Favored 'General case' 0 N--CA 1.43 -1.426 0 C-N-CA 125.329 1.452 . . . . 1.0 113.044 -177.312 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 3.0 tm? -84.42 114.64 22.05 Favored 'General case' 0 N--CA 1.43 -1.457 0 C-N-CA 127.041 2.136 . . . . 1.0 111.699 -179.592 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 76.7 tttt -89.48 -52.6 4.94 Favored 'General case' 0 N--CA 1.43 -1.47 0 O-C-N 120.959 -1.088 . . . . 1.0 110.931 174.463 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -164.65 -78.79 0.04 OUTLIER Glycine 0 N--CA 1.43 -1.76 0 O-C-N 120.688 -1.258 . . . . 1.0 114.069 177.052 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 50.9 m-20 -96.03 -5.25 41.5 Favored 'General case' 0 N--CA 1.43 -1.45 0 O-C-N 120.366 -1.667 . . . . 1.0 111.357 -176.634 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 5.0 mt-10 -159.05 161.27 36.49 Favored 'General case' 0 CA--C 1.488 -1.404 0 N-CA-C 101.428 -3.545 . . . . 1.0 101.428 -176.286 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 78' ' ' TRP . . . . . . . . . . . . . 23.6 m95 -94.44 142.15 27.76 Favored 'General case' 0 N--CA 1.43 -1.439 0 N-CA-C 104.409 -2.441 . . . . 1.0 104.409 175.066 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 0.6 OUTLIER -93.71 149.93 4.14 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.399 0 N-CA-C 105.374 -2.084 . . . . 1.0 105.374 169.844 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 80' ' ' CYS . . . . . 0.41 ' HB2' ' HB2' ' A' ' 85' ' ' GLU . 90.0 m -88.61 114.39 25.18 Favored 'General case' 0 N--CA 1.43 -1.474 0 N-CA-C 106.383 -1.71 . . . . 1.0 106.383 169.972 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 81' ' ' ASP . . . . . 0.426 ' OD2' ' CE1' ' A' ' 70' ' ' HIS . 21.1 t70 -61.54 -55.2 33.58 Favored 'General case' 0 N--CA 1.431 -1.414 0 C-N-CA 127.6 2.36 . . . . 1.0 113.949 -162.536 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -51.07 -61.34 2.29 Favored 'General case' 0 N--CA 1.43 -1.451 0 C-N-CA 126.675 1.99 . . . . 1.0 115.603 -165.878 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 68.4 m -85.01 -31.96 23.19 Favored 'General case' 0 N--CA 1.431 -1.396 0 O-C-N 120.558 -1.339 . . . . 1.0 111.95 174.934 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 97.51 79.93 1.5 Allowed Glycine 0 N--CA 1.43 -1.7 0 N-CA-C 109.699 -1.36 . . . . 1.0 109.699 -169.215 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 85' ' ' GLU . . . . . 0.41 ' HB2' ' HB2' ' A' ' 80' ' ' CYS . 36.8 mm-40 -142.32 -161.14 1.19 Allowed 'General case' 0 N--CA 1.428 -1.554 0 N-CA-C 106.967 -1.494 . . . . 1.0 106.967 -174.439 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 89.5 m -137.96 142.8 40.51 Favored 'General case' 0 N--CA 1.429 -1.495 0 O-C-N 119.727 -1.858 . . . . 1.0 109.863 -161.233 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 1.1 t80 -38.63 -94.37 0.0 OUTLIER 'General case' 0 N--CA 1.43 -1.461 0 C-N-CA 128.005 2.522 . . . . 1.0 117.807 177.055 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 88' ' ' TRP . . . . . 0.454 ' HB2' ' HG2' ' A' ' 106' ' ' ARG . 19.1 m95 -76.12 -26.53 56.45 Favored 'General case' 0 N--CA 1.43 -1.462 0 O-C-N 120.308 -1.495 . . . . 1.0 111.331 -166.968 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -59.85 -50.66 72.91 Favored 'General case' 0 N--CA 1.43 -1.461 0 C-N-CA 125.857 1.663 . . . . 1.0 113.554 172.258 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 46.3 tp -68.5 -43.67 76.36 Favored 'General case' 0 N--CA 1.43 -1.462 0 O-C-N 119.652 -1.905 . . . . 1.0 111.077 179.0 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 10.3 tt -50.53 -49.85 54.74 Favored 'General case' 0 N--CA 1.43 -1.427 0 C-N-CA 125.636 1.574 . . . . 1.0 113.449 172.749 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 16.8 tt0 -55.57 -49.08 73.67 Favored 'General case' 0 N--CA 1.43 -1.465 0 C-N-CA 127.018 2.127 . . . . 1.0 113.281 173.943 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 51.0 mt-30 -60.36 -48.3 82.34 Favored 'General case' 0 N--CA 1.431 -1.393 0 O-C-N 120.766 -1.209 . . . . 1.0 113.743 175.944 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -58.78 -49.33 78.06 Favored 'General case' 0 N--CA 1.43 -1.438 0 C-N-CA 125.378 1.471 . . . . 1.0 113.171 174.277 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -59.94 -45.91 91.1 Favored 'General case' 0 N--CA 1.429 -1.509 0 C-N-CA 126.143 1.777 . . . . 1.0 114.115 177.576 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 96.4 m -60.93 -36.47 79.41 Favored 'General case' 0 N--CA 1.431 -1.399 0 C-N-CA 125.713 1.605 . . . . 1.0 112.526 178.25 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -69.05 -59.62 2.92 Favored 'General case' 0 N--CA 1.428 -1.528 0 C-N-CA 124.388 1.075 . . . . 1.0 113.317 170.243 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 5.4 pt20 -76.54 -19.64 57.71 Favored 'General case' 0 N--CA 1.431 -1.406 0 N-CA-C 116.016 1.858 . . . . 1.0 116.016 -166.134 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -97.92 -35.98 10.31 Favored 'General case' 0 N--CA 1.431 -1.408 0 C-N-CA 124.793 1.237 . . . . 1.0 112.224 169.579 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . 106.95 10.76 27.63 Favored Glycine 0 N--CA 1.429 -1.77 0 N-CA-C 116.222 1.249 . . . . 1.0 116.222 170.048 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 6.7 pt-20 -149.34 160.98 42.95 Favored 'General case' 0 N--CA 1.43 -1.425 0 N-CA-C 105.655 -1.979 . . . . 1.0 105.655 -177.416 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 18.4 m -65.8 111.43 3.25 Favored 'General case' 0 N--CA 1.429 -1.482 0 CA-C-N 120.804 1.638 . . . . 1.0 112.177 -178.595 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 60.7 t -94.86 107.68 19.78 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.415 0 CA-C-O 122.993 1.378 . . . . 1.0 109.394 -178.005 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 70.0 m -80.2 106.15 12.0 Favored 'General case' 0 N--CA 1.43 -1.456 0 C-N-CA 124.622 1.169 . . . . 1.0 111.336 -176.516 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -140.58 -12.02 1.02 Allowed 'General case' 0 N--CA 1.43 -1.458 0 C-N-CA 123.133 0.573 . . . . 1.0 109.875 168.625 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 106' ' ' ARG . . . . . 0.454 ' HG2' ' HB2' ' A' ' 88' ' ' TRP . 0.0 OUTLIER . . . . . 0 C--O 1.261 1.69 0 C-N-CA 126.592 1.957 . . . . 1.0 110.882 179.212 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 17.9 t-20 . . . . . 0 N--CA 1.43 -1.434 0 CA-C-O 122.297 1.046 . . . . 1.0 110.238 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -64.0 -30.79 71.84 Favored 'General case' 0 CA--C 1.489 -1.402 0 C-N-CA 126.095 1.758 . . . . 1.0 114.614 -176.136 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 48.0 p -65.45 -46.87 78.17 Favored 'General case' 0 N--CA 1.43 -1.441 0 O-C-N 120.483 -1.386 . . . . 1.0 113.882 174.971 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 40.2 tt0 -68.03 -44.69 75.9 Favored 'General case' 0 N--CA 1.431 -1.422 0 O-C-N 120.606 -1.308 . . . . 1.0 112.723 176.668 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 28.3 t80 -50.4 -49.38 54.76 Favored 'General case' 0 N--CA 1.43 -1.439 0 N-CA-C 114.123 1.157 . . . . 1.0 114.123 168.856 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 1.2 t60 -61.03 -38.6 86.69 Favored 'General case' 0 N--CA 1.429 -1.498 0 O-C-N 120.649 -1.282 . . . . 1.0 114.382 175.048 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 1.2 mpt_? -56.26 -56.94 14.81 Favored 'General case' 0 N--CA 1.43 -1.426 0 CA-C-N 120.629 1.558 . . . . 1.0 112.185 172.816 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 80.4 mt -63.96 -41.57 97.54 Favored 'General case' 0 N--CA 1.429 -1.492 0 N-CA-C 114.135 1.161 . . . . 1.0 114.135 -179.161 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -67.18 -41.31 86.11 Favored 'General case' 0 N--CA 1.43 -1.474 0 C-N-CA 125.446 1.498 . . . . 1.0 114.774 -179.472 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -66.41 -38.76 88.19 Favored 'General case' 0 N--CA 1.431 -1.409 0 O-C-N 120.305 -1.497 . . . . 1.0 112.025 172.346 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 3.6 mt-30 -56.38 -54.09 49.63 Favored 'General case' 0 N--CA 1.43 -1.442 0 N-CA-C 115.829 1.788 . . . . 1.0 115.829 170.142 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 4.3 pp -63.91 -39.31 93.88 Favored 'General case' 0 N--CA 1.429 -1.479 0 N-CA-C 114.469 1.285 . . . . 1.0 114.469 179.387 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 7.3 m0 -49.71 -49.5 47.55 Favored 'General case' 0 N--CA 1.429 -1.481 0 N-CA-C 114.552 1.315 . . . . 1.0 114.552 168.759 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 41.9 tp -61.54 -51.52 68.23 Favored 'General case' 0 N--CA 1.429 -1.507 0 C-N-CA 124.21 1.004 . . . . 1.0 113.618 176.251 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 17.0 m -57.07 -43.08 81.75 Favored 'General case' 0 N--CA 1.43 -1.464 0 C-N-CA 125.613 1.565 . . . . 1.0 113.978 177.384 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 87.9 mt -59.12 -49.9 81.67 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.504 0 O-C-N 120.573 -1.33 . . . . 1.0 113.162 173.144 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 72.5 tt0 -63.02 -48.58 78.14 Favored 'General case' 0 N--CA 1.43 -1.473 0 O-C-N 120.594 -1.316 . . . . 1.0 112.715 -179.86 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 27.0 mm-40 -48.44 -59.72 3.25 Favored 'General case' 0 N--CA 1.428 -1.537 0 C-N-CA 126.569 1.948 . . . . 1.0 114.316 172.527 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 3.1 tpm_? -62.79 -37.82 88.19 Favored 'General case' 0 N--CA 1.43 -1.451 0 N-CA-C 113.8 1.037 . . . . 1.0 113.8 -176.627 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 4.3 mm? -70.65 -44.63 66.71 Favored 'General case' 0 N--CA 1.43 -1.456 0 O-C-N 120.482 -1.386 . . . . 1.0 113.7 177.084 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 25.5 t70 -68.24 -39.3 82.32 Favored 'General case' 0 N--CA 1.429 -1.475 0 O-C-N 120.775 -1.203 . . . . 1.0 113.542 -178.54 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 35.8 t70 -64.84 -26.59 68.4 Favored 'General case' 0 N--CA 1.43 -1.475 0 C-N-CA 125.841 1.656 . . . . 1.0 113.624 178.681 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 24' ' ' TRP . . . . . . . . . . . . . 0.1 OUTLIER -99.46 -145.84 0.33 Allowed 'General case' 0 N--CA 1.429 -1.48 0 N-CA-C 115.074 1.509 . . . . 1.0 115.074 -167.939 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . 0.306 0.9 OUTLIER 55.35 -157.44 0.23 Allowed 'General case' 0 N--CA 1.43 -1.449 0 C-N-CA 128.819 2.848 . . . . 1.0 116.221 -175.282 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 155.67 -44.85 0.54 Allowed Glycine 0 N--CA 1.432 -1.613 0 O-C-N 120.464 -1.397 . . . . 1.0 112.247 -179.019 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -77.68 -30.87 52.2 Favored 'General case' 0 N--CA 1.432 -1.368 0 CA-C-O 122.165 0.983 . . . . 1.0 111.595 -178.51 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 63.4 m -112.64 166.26 11.51 Favored 'General case' 0 N--CA 1.43 -1.435 0 C-N-CA 124.652 1.181 . . . . 1.0 110.136 174.742 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 29.8 t70 -93.5 141.22 28.71 Favored 'General case' 0 N--CA 1.43 -1.446 0 N-CA-C 106.904 -1.517 . . . . 1.0 106.904 167.421 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 5.8 tp -141.99 124.06 13.56 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.463 0 C-N-CA 126.376 1.871 . . . . 1.0 106.01 -169.558 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 13.7 t70 -140.48 128.55 22.16 Favored 'General case' 0 N--CA 1.43 -1.467 0 O-C-N 120.611 -1.306 . . . . 1.0 110.058 169.044 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 43.3 t -95.1 131.81 40.69 Favored 'General case' 0 N--CA 1.43 -1.43 0 O-C-N 120.018 -1.676 . . . . 1.0 108.074 173.509 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 23.3 mt-10 -107.62 140.27 40.9 Favored 'General case' 0 N--CA 1.429 -1.506 0 O-C-N 120.99 -1.069 . . . . 1.0 108.762 -170.242 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 3.1 tp -114.58 109.38 28.27 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.44 0 N-CA-C 105.617 -1.994 . . . . 1.0 105.617 167.011 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 77.5 m-20 -125.73 126.1 44.06 Favored 'General case' 0 N--CA 1.43 -1.427 0 N-CA-C 106.889 -1.523 . . . . 1.0 106.889 168.522 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . 67.42 -103.68 0.99 Allowed Glycine 0 N--CA 1.43 -1.728 0 C-N-CA 125.039 1.304 . . . . 1.0 112.607 -174.963 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -139.73 25.44 2.7 Favored Glycine 0 N--CA 1.43 -1.738 0 C-N-CA 124.186 0.898 . . . . 1.0 111.408 171.839 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 46.9 t -112.23 130.53 65.75 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.516 0 N-CA-C 106.97 -1.493 . . . . 1.0 106.97 179.063 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 23.9 mt -99.73 120.34 39.57 Favored 'General case' 0 N--CA 1.429 -1.499 0 CA-C-O 123.208 1.48 . . . . 1.0 107.883 172.141 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 1.6 p -113.76 122.33 46.77 Favored 'General case' 0 N--CA 1.43 -1.454 0 N-CA-C 106.995 -1.483 . . . . 1.0 106.995 179.63 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 61.7 mt -93.89 112.62 27.09 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.431 0 N-CA-C 105.787 -1.931 . . . . 1.0 105.787 -177.794 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 27.2 p -121.77 126.41 48.8 Favored 'General case' 0 N--CA 1.43 -1.448 0 CA-C-O 122.441 1.115 . . . . 1.0 113.221 -167.919 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 43' ' ' PHE . . . . . . . . . . . . . 3.0 p90 -120.77 167.76 12.14 Favored 'General case' 0 N--CA 1.43 -1.443 0 CA-C-O 122.749 1.261 . . . . 1.0 111.59 178.675 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -56.61 -33.01 65.85 Favored 'General case' 0 N--CA 1.43 -1.435 0 C-N-CA 127.953 2.501 . . . . 1.0 117.037 -170.077 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 70.9 m-80 -67.09 -15.8 63.94 Favored 'General case' 0 N--CA 1.431 -1.425 0 N-CA-C 115.037 1.495 . . . . 1.0 115.037 175.427 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 88.2 13.13 64.43 Favored Glycine 0 N--CA 1.431 -1.64 0 O-C-N 119.676 -1.89 . . . . 1.0 115.475 167.447 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 56.8 m -98.65 149.89 22.33 Favored 'General case' 0 N--CA 1.429 -1.504 0 N-CA-C 107.336 -1.357 . . . . 1.0 107.336 167.693 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -128.49 150.88 49.97 Favored 'General case' 0 N--CA 1.429 -1.5 0 O-C-N 121.378 -0.826 . . . . 1.0 110.063 -168.236 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 3.1 mm -105.17 133.31 49.77 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.508 0 N-CA-C 105.527 -2.027 . . . . 1.0 105.527 166.546 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 50' ' ' ILE . . . . . 0.441 ' HB ' ' HB1' ' A' ' 63' ' ' ALA . 5.7 mm -116.64 117.74 56.47 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.484 0 CA-C-N 119.733 1.151 . . . . 1.0 109.617 -173.158 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 3.2 mt -126.93 116.27 44.13 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.432 0 CA-C-O 124.047 1.88 . . . . 1.0 112.179 -175.469 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 52' ' ' ASN . . . . . 0.535 ' H ' ' HD1' ' A' ' 61' ' ' TRP . 56.2 t30 -141.82 170.63 15.35 Favored 'General case' 0 N--CA 1.43 -1.449 0 C-N-CA 128.354 2.662 . . . . 1.0 106.27 -179.274 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -154.29 130.89 10.66 Favored 'General case' 0 N--CA 1.431 -1.408 0 CA-C-O 122.834 1.302 . . . . 1.0 109.289 -170.365 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 28.9 mm-40 -89.73 129.87 36.08 Favored 'General case' 0 N--CA 1.429 -1.477 0 N-CA-C 106.531 -1.655 . . . . 1.0 106.531 175.921 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 67.6 mt-10 -63.75 -47.99 80.56 Favored Pre-proline 0 N--CA 1.431 -1.42 0 N-CA-C 116.687 2.106 . . . . 1.0 116.687 -179.606 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 97.3 Cg_endo -74.52 153.39 44.26 Favored 'Trans proline' 0 C--N 1.299 -2.036 0 CA-C-N 126.531 3.368 . . . . 1.0 111.388 163.403 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . 0.388 5.4 mp 72.57 143.05 0.06 Allowed 'General case' 0 N--CA 1.43 -1.457 0 CA-C-O 124.754 2.216 . . . . 1.0 113.445 -168.203 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 21.2 m170 -88.93 44.32 1.2 Allowed 'General case' 0 N--CA 1.43 -1.446 0 C-N-CA 125.318 1.447 . . . . 1.0 112.904 -175.899 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 11.7 pt20 -140.0 145.44 37.81 Favored 'General case' 0 N--CA 1.43 -1.456 0 O-C-N 120.045 -1.66 . . . . 1.0 110.53 -172.077 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 86.7 t -111.88 156.08 13.05 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.457 0 N-CA-C 107.023 -1.473 . . . . 1.0 107.023 -178.679 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 61' ' ' TRP . . . . . 0.535 ' HD1' ' H ' ' A' ' 52' ' ' ASN . 0.0 OUTLIER -102.06 152.35 21.08 Favored 'General case' 0 N--CA 1.43 -1.455 0 O-C-N 120.054 -1.653 . . . . 1.0 113.011 174.784 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 75.6 mt -127.91 107.54 9.94 Favored 'General case' 0 CA--C 1.488 -1.409 0 N-CA-C 106.994 -1.484 . . . . 1.0 106.994 166.175 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . 0.441 ' HB1' ' HB ' ' A' ' 50' ' ' ILE . . . -95.19 145.14 25.25 Favored 'General case' 0 N--CA 1.429 -1.476 0 CA-C-O 122.801 1.286 . . . . 1.0 111.16 163.288 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 64' ' ' THR . . . . . . . . . . . . . 69.2 p -150.3 -168.1 3.01 Favored 'General case' 0 N--CA 1.43 -1.462 0 C-N-CA 126.182 1.793 . . . . 1.0 108.617 -150.583 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 7.1 tmtm? -62.12 -46.82 87.33 Favored 'General case' 0 N--CA 1.431 -1.411 0 C-N-CA 125.889 1.676 . . . . 1.0 112.435 174.693 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 48.9 tt0 -78.04 -24.51 47.75 Favored 'General case' 0 N--CA 1.429 -1.519 0 N-CA-C 114.516 1.302 . . . . 1.0 114.516 -170.718 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 151.06 -53.14 0.49 Allowed Glycine 0 N--CA 1.43 -1.725 0 O-C-N 120.893 -1.129 . . . . 1.0 110.89 176.963 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 134.83 162.06 9.67 Favored Glycine 0 N--CA 1.43 -1.736 0 CA-C-O 122.818 1.232 . . . . 1.0 115.839 174.448 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 4.7 m-85 -135.32 161.99 33.85 Favored 'General case' 0 N--CA 1.43 -1.442 0 C-N-CA 126.415 1.886 . . . . 1.0 107.148 -173.318 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 25.0 p80 -114.98 159.72 20.43 Favored 'General case' 0 N--CA 1.43 -1.433 0 O-C-N 119.797 -1.815 . . . . 1.0 108.586 156.025 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 37.3 p90 -136.96 141.47 42.61 Favored 'General case' 0 N--CA 1.43 -1.471 0 N-CA-C 114.694 1.368 . . . . 1.0 114.694 -168.755 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 8.9 m-20 -121.63 175.81 6.03 Favored 'General case' 0 N--CA 1.429 -1.491 0 C-N-CA 126.448 1.899 . . . . 1.0 110.391 -170.495 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 27.1 tp -113.82 110.25 19.84 Favored 'General case' 0 N--CA 1.429 -1.521 0 O-C-N 119.718 -1.864 . . . . 1.0 113.072 -174.616 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 12.2 mmmt -68.41 -42.46 78.96 Favored 'General case' 0 N--CA 1.431 -1.379 0 O-C-N 120.497 -1.377 . . . . 1.0 112.641 168.45 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . 165.08 -86.9 0.1 Allowed Glycine 0 N--CA 1.43 -1.764 0 N-CA-C 110.074 -1.211 . . . . 1.0 110.074 176.997 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 11.6 t0 -91.82 29.65 1.52 Allowed 'General case' 0 N--CA 1.43 -1.46 0 O-C-N 120.988 -1.301 . . . . 1.0 111.96 176.659 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 2.1 pt-20 -169.07 124.61 0.89 Allowed 'General case' 0 N--CA 1.429 -1.484 0 C-N-CA 126.33 1.852 . . . . 1.0 106.523 -173.772 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 78' ' ' TRP . . . . . . . . . . . . . 89.9 m95 -80.46 130.67 35.3 Favored 'General case' 0 N--CA 1.43 -1.462 0 N-CA-C 106.339 -1.726 . . . . 1.0 106.339 162.627 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -124.55 141.12 45.73 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.436 0 O-C-N 119.313 -2.117 . . . . 1.0 109.866 -173.777 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 21.2 m -81.64 121.17 26.01 Favored 'General case' 0 N--CA 1.429 -1.492 0 O-C-N 120.243 -1.535 . . . . 1.0 113.21 -172.572 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 30.0 t70 -83.11 58.33 4.38 Favored 'General case' 0 N--CA 1.43 -1.465 0 O-C-N 119.769 -1.832 . . . . 1.0 112.467 -173.172 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 15.6 tpt85 -170.45 101.29 0.26 Allowed 'General case' 0 N--CA 1.43 -1.437 0 O-C-N 120.433 -1.417 . . . . 1.0 110.053 178.039 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 4.3 t 79.48 -50.28 0.4 Allowed 'General case' 0 N--CA 1.43 -1.463 0 C-N-CA 126.695 1.998 . . . . 1.0 116.121 169.039 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -153.79 96.15 0.16 Allowed Glycine 0 N--CA 1.43 -1.732 0 O-C-N 120.214 -1.554 . . . . 1.0 110.015 -172.593 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 5.5 pt-20 -82.43 102.71 11.48 Favored 'General case' 0 N--CA 1.428 -1.539 0 N-CA-C 117.99 2.589 . . . . 1.0 117.99 -162.834 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 10.4 m -165.66 126.71 1.89 Allowed 'General case' 0 N--CA 1.43 -1.458 0 O-C-N 119.543 -1.973 . . . . 1.0 113.339 172.333 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 3.0 t80 -57.09 -84.34 0.01 OUTLIER 'General case' 0 N--CA 1.43 -1.438 0 N-CA-C 118.018 2.599 . . . . 1.0 118.018 177.192 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 88' ' ' TRP . . . . . . . . . . . . . 46.7 m95 -61.38 -27.81 68.79 Favored 'General case' 0 N--CA 1.431 -1.424 0 C-N-CA 125.876 1.67 . . . . 1.0 113.324 -167.295 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -77.27 -45.03 27.69 Favored 'General case' 0 N--CA 1.429 -1.492 0 C-N-CA 126.685 1.994 . . . . 1.0 112.896 179.558 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 25.6 tp -71.36 -38.89 71.56 Favored 'General case' 0 N--CA 1.429 -1.489 0 O-C-N 118.875 -2.391 . . . . 1.0 112.734 176.951 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 17.7 tp -51.58 -44.98 62.96 Favored 'General case' 0 N--CA 1.431 -1.391 0 C-N-CA 126.608 1.963 . . . . 1.0 114.483 168.027 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 38.5 tt0 -56.66 -47.18 80.37 Favored 'General case' 0 N--CA 1.431 -1.407 0 C-N-CA 126.318 1.847 . . . . 1.0 113.93 170.168 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 38.1 tt0 -57.05 -50.77 71.73 Favored 'General case' 0 N--CA 1.43 -1.448 0 C-N-CA 125.63 1.572 . . . . 1.0 114.427 176.938 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -56.56 -48.49 77.21 Favored 'General case' 0 N--CA 1.429 -1.478 0 C-N-CA 126.148 1.779 . . . . 1.0 114.121 173.969 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -65.69 -48.77 70.91 Favored 'General case' 0 N--CA 1.431 -1.415 0 O-C-N 120.339 -1.476 . . . . 1.0 113.682 179.45 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 94.0 m -47.13 -51.45 18.05 Favored 'General case' 0 N--CA 1.43 -1.465 0 C-N-CA 127.38 2.272 . . . . 1.0 113.97 173.986 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 8.4 pt20 -72.98 -37.02 67.19 Favored 'General case' 0 N--CA 1.431 -1.421 0 N-CA-C 114.692 1.368 . . . . 1.0 114.692 -179.173 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 41.7 mt-30 -71.22 -42.08 69.37 Favored 'General case' 0 N--CA 1.431 -1.411 0 N-CA-C 115.655 1.724 . . . . 1.0 115.655 178.741 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -82.82 -41.21 19.36 Favored 'General case' 0 N--CA 1.431 -1.421 0 N-CA-C 113.622 0.971 . . . . 1.0 113.622 -179.604 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . 89.59 42.69 5.39 Favored Glycine 0 N--CA 1.431 -1.669 0 O-C-N 120.667 -1.271 . . . . 1.0 112.984 -177.991 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 4.3 tp10 -158.92 164.85 35.27 Favored 'General case' 0 N--CA 1.43 -1.468 0 N-CA-C 103.252 -2.869 . . . . 1.0 103.252 -177.291 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 90.4 m -76.88 87.21 3.45 Favored 'General case' 0 N--CA 1.431 -1.383 0 CA-C-N 120.533 1.515 . . . . 1.0 109.339 169.666 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 18.0 t -95.45 84.01 1.53 Allowed 'Isoleucine or valine' 0 N--CA 1.43 -1.426 0 CA-C-O 124.297 1.999 . . . . 1.0 108.73 -179.265 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 71.5 p -96.72 168.07 10.73 Favored 'General case' 0 N--CA 1.431 -1.403 0 C-N-CA 126.783 2.033 . . . . 1.0 111.114 -177.6 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 20.2 m-85 -104.57 -27.05 12.1 Favored 'General case' 0 N--CA 1.429 -1.479 0 O-C-N 120.768 -1.207 . . . . 1.0 109.278 162.134 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 16.5 mmm-85 . . . . . 0 C--O 1.259 1.602 0 C-N-CA 124.354 1.061 . . . . 1.0 111.409 -170.957 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 29.2 m-80 . . . . . 0 N--CA 1.43 -1.468 0 CA-C-O 121.815 0.817 . . . . 1.0 109.782 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 28.3 p-10 -69.71 -56.23 7.77 Favored 'General case' 0 CA--C 1.488 -1.408 0 C-N-CA 125.586 1.554 . . . . 1.0 113.777 -176.357 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 33.4 m -59.46 -45.07 92.67 Favored 'General case' 0 N--CA 1.431 -1.403 0 C-N-CA 124.698 1.199 . . . . 1.0 112.417 174.146 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 8.4 mm-40 -52.5 -63.29 1.19 Allowed 'General case' 0 N--CA 1.429 -1.482 0 C-N-CA 126.491 1.916 . . . . 1.0 113.137 178.297 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 7.6 m-85 -62.12 -27.59 69.04 Favored 'General case' 0 N--CA 1.43 -1.462 0 N-CA-C 115.838 1.792 . . . . 1.0 115.838 177.089 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 1.9 t-80 -61.52 -52.6 63.8 Favored 'General case' 0 N--CA 1.429 -1.475 0 N-CA-C 114.441 1.274 . . . . 1.0 114.441 171.792 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 35.4 mtm180 -69.63 -39.14 77.33 Favored 'General case' 0 N--CA 1.431 -1.375 0 O-C-N 120.474 -1.391 . . . . 1.0 113.973 -179.793 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 66.7 mt -58.55 -41.7 86.19 Favored 'General case' 0 N--CA 1.431 -1.42 0 C-N-CA 125.05 1.34 . . . . 1.0 113.223 173.648 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -62.99 -45.91 90.17 Favored 'General case' 0 N--CA 1.429 -1.483 0 C-N-CA 125.312 1.445 . . . . 1.0 112.668 176.293 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 8.2 t70 -53.69 -57.53 10.48 Favored 'General case' 0 N--CA 1.43 -1.463 0 C-N-CA 124.42 1.088 . . . . 1.0 113.242 174.846 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 16.7 pt20 -64.1 -37.49 87.64 Favored 'General case' 0 N--CA 1.429 -1.478 0 N-CA-C 116.267 1.951 . . . . 1.0 116.267 -177.907 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 3.3 pp -65.06 -43.54 91.89 Favored 'General case' 0 N--CA 1.43 -1.44 0 O-C-N 120.174 -1.578 . . . . 1.0 113.376 174.928 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 23.1 m0 -52.62 -50.67 62.65 Favored 'General case' 0 N--CA 1.431 -1.413 0 N-CA-C 115.329 1.603 . . . . 1.0 115.329 173.222 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 25.3 mt -59.06 -48.4 81.75 Favored 'General case' 0 N--CA 1.429 -1.483 0 CA-C-O 121.944 0.878 . . . . 1.0 112.854 176.456 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 47.7 m -66.6 -45.82 77.94 Favored 'General case' 0 N--CA 1.43 -1.436 0 N-CA-C 114.456 1.28 . . . . 1.0 114.456 -175.748 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 96.7 mt -58.03 -45.9 88.07 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.462 0 O-C-N 119.988 -1.695 . . . . 1.0 112.143 172.677 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 8.0 tt0 -58.91 -48.3 81.94 Favored 'General case' 0 N--CA 1.43 -1.442 0 O-C-N 121.626 -0.671 . . . . 1.0 112.59 176.705 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 33.7 tt0 -58.47 -44.87 89.48 Favored 'General case' 0 N--CA 1.431 -1.41 0 C-N-CA 125.161 1.384 . . . . 1.0 114.107 177.92 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -53.52 -52.52 59.37 Favored 'General case' 0 N--CA 1.43 -1.453 0 C-N-CA 124.184 0.994 . . . . 1.0 112.344 174.656 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 35.4 mt -69.99 -51.04 35.71 Favored 'General case' 0 N--CA 1.431 -1.412 0 N-CA-C 113.658 0.985 . . . . 1.0 113.658 -176.429 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 23.0 t70 -62.9 -41.92 99.61 Favored 'General case' 0 N--CA 1.429 -1.495 0 N-CA-C 115.146 1.536 . . . . 1.0 115.146 -178.174 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 23.6 t70 -74.01 -26.1 60.26 Favored 'General case' 0 N--CA 1.43 -1.438 0 O-C-N 120.182 -1.574 . . . . 1.0 113.066 -179.04 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 24' ' ' TRP . . . . . . . . . . . . . 67.7 t-105 -72.26 136.64 46.37 Favored 'General case' 0 N--CA 1.43 -1.471 0 O-C-N 119.742 -1.849 . . . . 1.0 112.63 177.569 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 34.3 t70 -138.95 150.26 45.69 Favored 'General case' 0 N--CA 1.43 -1.445 0 N-CA-C 106.926 -1.509 . . . . 1.0 106.926 179.273 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -163.91 -121.88 0.58 Allowed Glycine 0 N--CA 1.43 -1.757 0 O-C-N 121.29 -0.881 . . . . 1.0 111.599 -174.822 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 4.2 t0 -92.0 -32.25 15.29 Favored 'General case' 0 N--CA 1.43 -1.471 0 C-N-CA 125.357 1.463 . . . . 1.0 108.614 172.293 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 18.3 p -95.14 166.94 11.67 Favored 'General case' 0 N--CA 1.429 -1.482 0 C-N-CA 126.499 1.92 . . . . 1.0 111.591 179.335 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 2.6 t70 -132.03 178.91 6.42 Favored 'General case' 0 N--CA 1.43 -1.453 0 C-N-CA 124.677 1.191 . . . . 1.0 109.272 177.018 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 9.3 tp -157.21 134.02 2.2 Favored 'Isoleucine or valine' 0 N--CA 1.428 -1.542 0 C-N-CA 125.43 1.492 . . . . 1.0 107.072 -154.632 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 2.1 t70 -143.81 106.67 4.48 Favored 'General case' 0 N--CA 1.429 -1.495 0 O-C-N 120.241 -1.537 . . . . 1.0 109.445 162.783 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 71.2 m -90.68 132.62 35.68 Favored 'General case' 0 N--CA 1.431 -1.42 0 O-C-N 120.513 -1.367 . . . . 1.0 111.171 175.571 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 35.2 tt0 -107.27 132.01 53.57 Favored 'General case' 0 N--CA 1.43 -1.474 0 C-N-CA 126.365 1.866 . . . . 1.0 109.769 -168.138 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 2.8 tp -117.2 109.03 26.37 Favored 'Isoleucine or valine' 0 N--CA 1.428 -1.535 0 CA-C-O 124.547 2.118 . . . . 1.0 108.236 -172.314 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 3.5 t-20 -108.29 79.35 1.25 Allowed 'General case' 0 N--CA 1.429 -1.483 0 C-N-CA 125.575 1.55 . . . . 1.0 108.288 173.98 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . 75.52 -80.17 1.04 Allowed Glycine 0 N--CA 1.429 -1.771 0 O-C-N 120.326 -1.484 . . . . 1.0 114.998 173.291 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -142.66 37.35 1.54 Allowed Glycine 0 N--CA 1.43 -1.766 0 N-CA-C 108.987 -1.645 . . . . 1.0 108.987 173.384 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 69.7 t -133.67 117.77 28.02 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.404 0 N-CA-C 104.519 -2.4 . . . . 1.0 104.519 176.383 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -110.08 137.32 48.0 Favored 'General case' 0 N--CA 1.431 -1.42 0 CA-C-O 123.728 1.728 . . . . 1.0 111.781 177.042 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -133.06 125.2 29.1 Favored 'General case' 0 N--CA 1.429 -1.479 0 N-CA-C 106.142 -1.799 . . . . 1.0 106.142 -170.174 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 86.1 mt -99.89 134.07 40.6 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.481 0 N-CA-C 107.534 -1.284 . . . . 1.0 107.534 -169.192 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -131.7 126.67 35.13 Favored 'General case' 0 N--CA 1.431 -1.414 0 N-CA-C 112.643 0.609 . . . . 1.0 112.643 174.944 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 43' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -108.15 167.51 9.95 Favored 'General case' 0 N--CA 1.431 -1.405 0 C-N-CA 125.482 1.513 . . . . 1.0 109.437 174.278 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 70.3 mt-10 -55.86 -26.19 45.79 Favored 'General case' 0 N--CA 1.429 -1.484 0 N-CA-C 117.059 2.244 . . . . 1.0 117.059 179.644 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 27.7 t-20 -63.87 -18.15 63.88 Favored 'General case' 0 N--CA 1.43 -1.442 0 C-N-CA 126.374 1.869 . . . . 1.0 112.828 176.363 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 96.32 -6.32 65.82 Favored Glycine 0 N--CA 1.431 -1.652 0 O-C-N 120.311 -1.493 . . . . 1.0 111.313 176.345 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -79.18 166.36 22.29 Favored 'General case' 0 N--CA 1.431 -1.424 0 C-N-CA 128.033 2.533 . . . . 1.0 111.265 -177.914 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 10.5 ptpt -157.17 148.14 21.67 Favored 'General case' 0 N--CA 1.431 -1.417 0 O-C-N 120.672 -1.267 . . . . 1.0 113.599 -162.434 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 9.2 mm -123.6 142.83 38.89 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.445 0 N-CA-C 105.703 -1.962 . . . . 1.0 105.703 175.672 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 50' ' ' ILE . . . . . 0.436 HG23 ' HB1' ' A' ' 63' ' ' ALA . 4.1 tp -126.5 129.06 71.77 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.509 0 CA-C-N 120.753 1.615 . . . . 1.0 110.076 175.606 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 3.3 mt -124.99 124.84 68.52 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.464 0 C-N-CA 127.689 2.396 . . . . 1.0 111.139 -177.263 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 52' ' ' ASN . . . . . 0.455 ' H ' ' HD1' ' A' ' 61' ' ' TRP . 40.9 t30 -160.04 173.14 16.29 Favored 'General case' 0 N--CA 1.43 -1.456 0 C-N-CA 128.802 2.841 . . . . 1.0 104.564 -173.901 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -153.35 147.99 26.23 Favored 'General case' 0 N--CA 1.429 -1.48 0 O-C-N 119.629 -1.92 . . . . 1.0 113.333 -154.455 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 34.1 mm-40 -121.13 97.63 5.61 Favored 'General case' 0 N--CA 1.43 -1.453 0 C-N-CA 125.361 1.465 . . . . 1.0 112.002 -172.51 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 18.9 tt0 -69.6 -39.89 12.83 Favored Pre-proline 0 N--CA 1.431 -1.416 0 N-CA-C 116.574 2.064 . . . . 1.0 116.574 -174.988 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 52.7 Cg_exo -71.16 -22.62 25.59 Favored 'Trans proline' 0 N--CA 1.433 -2.072 0 CA-C-N 126.228 3.26 . . . . 1.0 114.844 174.794 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 33.2 mt -94.04 -30.92 14.44 Favored 'General case' 0 N--CA 1.431 -1.412 0 C-N-CA 122.895 0.478 . . . . 1.0 111.312 -168.581 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 3.4 m170 85.67 56.5 0.01 OUTLIER 'General case' 0 N--CA 1.43 -1.425 0 C-N-CA 127.581 2.352 . . . . 1.0 110.102 176.826 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 6.5 pt20 -156.23 157.66 36.22 Favored 'General case' 0 N--CA 1.43 -1.449 0 O-C-N 120.409 -1.432 . . . . 1.0 109.71 -178.468 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 79.2 t -121.06 151.43 24.12 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.511 0 N-CA-C 105.63 -1.989 . . . . 1.0 105.63 173.045 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 61' ' ' TRP . . . . . 0.455 ' HD1' ' H ' ' A' ' 52' ' ' ASN . 0.0 OUTLIER -102.21 151.76 21.83 Favored 'General case' 0 N--CA 1.43 -1.467 0 CA-C-N 121.122 1.783 . . . . 1.0 114.275 177.291 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 61.5 mt -123.28 101.72 7.53 Favored 'General case' 0 N--CA 1.43 -1.428 0 N-CA-C 107.03 -1.47 . . . . 1.0 107.03 166.503 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . 0.436 ' HB1' HG23 ' A' ' 50' ' ' ILE . . . -102.05 112.91 25.73 Favored 'General case' 0 N--CA 1.43 -1.435 0 O-C-N 121.05 -1.032 . . . . 1.0 110.517 170.889 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 64' ' ' THR . . . . . . . . . . . . . 77.1 p -119.62 -122.44 0.29 Allowed 'General case' 0 N--CA 1.43 -1.472 0 C-N-CA 126.749 2.02 . . . . 1.0 113.652 -156.782 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 13.7 tmtt? -96.69 -66.33 0.91 Allowed 'General case' 0 N--CA 1.43 -1.426 0 C-N-CA 126.047 1.739 . . . . 1.0 110.726 -170.678 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 20.0 tt0 -77.62 -24.0 49.69 Favored 'General case' 0 N--CA 1.429 -1.487 0 O-C-N 121.26 -0.9 . . . . 1.0 112.694 -176.773 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 172.08 -60.39 0.16 Allowed Glycine 0 N--CA 1.431 -1.68 0 O-C-N 120.398 -1.439 . . . . 1.0 110.18 178.855 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 88.1 170.18 45.74 Favored Glycine 0 N--CA 1.431 -1.678 0 C-N-CA 123.766 0.698 . . . . 1.0 112.521 -177.893 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -166.23 171.79 11.85 Favored 'General case' 0 N--CA 1.429 -1.475 0 C-N-CA 125.986 1.715 . . . . 1.0 110.065 179.398 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 70' ' ' HIS . . . . . 0.437 ' HA ' ' HA ' ' A' ' 61' ' ' TRP . 10.7 p80 -75.68 159.33 31.26 Favored 'General case' 0 N--CA 1.431 -1.393 0 N-CA-C 115.736 1.754 . . . . 1.0 115.736 -178.161 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 47.2 p90 -121.01 137.02 54.85 Favored 'General case' 0 N--CA 1.429 -1.48 0 N-CA-C 114.427 1.269 . . . . 1.0 114.427 -179.912 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 3.3 m-20 -127.56 172.58 10.6 Favored 'General case' 0 N--CA 1.43 -1.462 0 C-N-CA 126.642 1.977 . . . . 1.0 108.364 -174.246 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 19.2 mt -101.01 116.24 32.37 Favored 'General case' 0 N--CA 1.43 -1.442 0 O-C-N 119.837 -1.789 . . . . 1.0 111.893 178.228 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 39.7 mmtm -67.74 -47.71 68.51 Favored 'General case' 0 N--CA 1.429 -1.495 0 O-C-N 120.743 -1.223 . . . . 1.0 111.491 151.889 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . 179.69 -81.81 0.06 OUTLIER Glycine 0 N--CA 1.431 -1.696 0 O-C-N 120.176 -1.578 . . . . 1.0 114.159 176.502 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -89.7 -8.3 52.66 Favored 'General case' 0 N--CA 1.43 -1.474 0 C-N-CA 125.386 1.474 . . . . 1.0 109.173 170.383 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 16.0 mt-10 -124.39 123.01 39.24 Favored 'General case' 0 N--CA 1.429 -1.485 0 N-CA-C 103.797 -2.668 . . . . 1.0 103.797 -172.227 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 78' ' ' TRP . . . . . . . . . . . . . 81.4 m95 -86.31 135.35 33.57 Favored 'General case' 0 N--CA 1.43 -1.464 0 N-CA-C 105.508 -2.034 . . . . 1.0 105.508 164.317 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -129.7 153.17 38.42 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.472 0 O-C-N 119.98 -1.7 . . . . 1.0 107.936 -171.551 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 80' ' ' CYS . . . . . 0.554 ' HG ' HD21 ' A' ' 90' ' ' LEU . 64.3 m -85.91 147.24 26.35 Favored 'General case' 0 N--CA 1.43 -1.43 0 O-C-N 120.46 -1.4 . . . . 1.0 112.591 -177.48 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 28.3 t70 -63.77 -39.94 95.49 Favored 'General case' 0 N--CA 1.431 -1.404 0 O-C-N 119.7 -1.875 . . . . 1.0 115.679 -174.242 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 12.3 ptm180 -130.5 177.22 7.52 Favored 'General case' 0 N--CA 1.43 -1.436 0 O-C-N 120.699 -1.251 . . . . 1.0 112.016 174.839 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 83' ' ' SER . . . . . . . . . . . . 0.408 9.5 p 72.3 -55.96 0.66 Allowed 'General case' 0 N--CA 1.43 -1.444 0 C-N-CA 128.554 2.742 . . . . 1.0 117.418 171.145 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -168.48 93.95 0.11 Allowed Glycine 0 N--CA 1.431 -1.684 0 N-CA-C 109.712 -1.355 . . . . 1.0 109.712 178.73 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 85' ' ' GLU . . . . . 0.423 ' C ' ' HG1' ' A' ' 86' ' ' THR . 10.5 pt-20 -72.33 96.69 1.9 Allowed 'General case' 0 N--CA 1.431 -1.407 0 N-CA-C 118.064 2.616 . . . . 1.0 118.064 -166.053 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 86' ' ' THR . . . . . 0.423 ' HG1' ' C ' ' A' ' 85' ' ' GLU . 57.4 m -167.33 125.92 1.32 Allowed 'General case' 0 N--CA 1.429 -1.49 0 O-C-N 119.347 -2.096 . . . . 1.0 110.836 171.6 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . 0.294 0.1 OUTLIER -51.03 -86.14 0.0 OUTLIER 'General case' 0 N--CA 1.429 -1.475 0 N-CA-C 117.195 2.294 . . . . 1.0 117.195 173.539 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 88' ' ' TRP . . . . . . . . . . . . . 22.3 m95 -58.96 -39.95 83.23 Favored 'General case' 0 N--CA 1.431 -1.422 0 CA-C-N 121.2 1.818 . . . . 1.0 113.584 -173.27 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 9.3 t70 -67.69 -39.96 84.41 Favored 'General case' 0 N--CA 1.43 -1.455 0 N-CA-C 114.388 1.255 . . . . 1.0 114.388 -176.82 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 90' ' ' LEU . . . . . 0.554 HD21 ' HG ' ' A' ' 80' ' ' CYS . 30.3 tp -76.03 -41.61 50.38 Favored 'General case' 0 N--CA 1.43 -1.438 0 O-C-N 119.098 -2.251 . . . . 1.0 112.483 177.363 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -48.01 -47.38 33.35 Favored 'General case' 0 CA--C 1.489 -1.394 0 C-N-CA 127.495 2.318 . . . . 1.0 113.376 166.835 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 1.3 tp10 -56.52 -51.9 66.77 Favored 'General case' 0 N--CA 1.43 -1.426 0 C-N-CA 127.105 2.162 . . . . 1.0 113.29 170.387 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 7.2 tt0 -52.47 -51.06 61.27 Favored 'General case' 0 N--CA 1.43 -1.464 0 O-C-N 120.668 -1.27 . . . . 1.0 112.866 174.539 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -53.19 -48.73 67.83 Favored 'General case' 0 N--CA 1.43 -1.432 0 N-CA-C 115.034 1.494 . . . . 1.0 115.034 172.706 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -64.45 -53.5 47.3 Favored 'General case' 0 N--CA 1.429 -1.495 0 O-C-N 120.135 -1.603 . . . . 1.0 113.255 178.989 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 96' ' ' THR . . . . . 0.454 HG22 ' H ' ' A' ' 103' ' ' VAL . 47.5 p -59.4 -38.04 79.56 Favored 'General case' 0 CA--C 1.488 -1.431 0 C-N-CA 126.543 1.937 . . . . 1.0 114.051 179.439 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 5.8 pt20 -78.65 -27.19 45.23 Favored 'General case' 0 N--CA 1.429 -1.476 0 N-CA-C 114.871 1.434 . . . . 1.0 114.871 177.944 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 12.4 mm100 -74.67 -38.74 62.35 Favored 'General case' 0 N--CA 1.431 -1.421 0 O-C-N 120.22 -1.55 . . . . 1.0 112.129 170.718 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -79.86 -46.31 17.08 Favored 'General case' 0 N--CA 1.43 -1.45 0 N-CA-C 114.928 1.455 . . . . 1.0 114.928 179.669 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . 122.5 0.1 10.25 Favored Glycine 0 N--CA 1.431 -1.659 0 N-CA-C 116.475 1.35 . . . . 1.0 116.475 174.433 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 11.2 pt-20 -153.56 174.33 14.58 Favored 'General case' 0 N--CA 1.429 -1.499 0 CA-C-N 119.355 1.577 . . . . 1.0 110.223 -178.813 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 16.9 m -74.2 121.62 21.52 Favored 'General case' 0 N--CA 1.43 -1.452 0 O-C-N 120.736 -1.228 . . . . 1.0 112.738 177.928 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 103' ' ' VAL . . . . . 0.454 ' H ' HG22 ' A' ' 96' ' ' THR . 40.5 t -120.87 134.92 62.71 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.458 0 N-CA-C 102.284 -3.228 . . . . 1.0 102.284 -175.195 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 43.7 p -106.73 129.02 54.68 Favored 'General case' 0 N--CA 1.43 -1.457 0 N-CA-C 115.218 1.562 . . . . 1.0 115.218 -166.336 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -139.69 -35.8 0.52 Allowed 'General case' 0 N--CA 1.43 -1.434 0 C-N-CA 127.155 2.182 . . . . 1.0 108.938 167.959 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 2.9 tmm_? . . . . . 0 C--O 1.26 1.609 0 C-N-CA 125.737 1.615 . . . . 1.0 112.859 -167.59 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 43.1 m-80 . . . . . 0 N--CA 1.43 -1.453 0 CA-C-O 121.69 0.757 . . . . 1.0 112.34 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -57.04 -48.97 77.25 Favored 'General case' 0 N--CA 1.43 -1.432 0 C-N-CA 126.806 2.042 . . . . 1.0 113.857 172.93 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 27.8 t -50.88 -52.9 37.23 Favored 'General case' 0 N--CA 1.431 -1.401 0 C-N-CA 125.722 1.609 . . . . 1.0 114.099 172.579 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 49.7 tt0 -62.86 -52.42 63.17 Favored 'General case' 0 N--CA 1.431 -1.395 0 C-N-CA 124.765 1.226 . . . . 1.0 113.976 -178.452 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -63.46 -35.31 80.03 Favored 'General case' 0 N--CA 1.43 -1.441 0 O-C-N 120.673 -1.267 . . . . 1.0 114.362 178.626 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 9.0 t-160 -66.49 -37.79 85.86 Favored 'General case' 0 N--CA 1.43 -1.432 0 O-C-N 120.198 -1.564 . . . . 1.0 113.791 172.755 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 1.5 mmm180 -68.56 -43.93 75.56 Favored 'General case' 0 N--CA 1.43 -1.432 0 O-C-N 120.055 -1.653 . . . . 1.0 113.687 175.73 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 67.1 mt -56.52 -46.26 80.67 Favored 'General case' 0 N--CA 1.43 -1.45 0 C-N-CA 124.666 1.186 . . . . 1.0 112.558 172.251 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -54.51 -55.69 26.47 Favored 'General case' 0 N--CA 1.43 -1.442 0 C-N-CA 124.477 1.111 . . . . 1.0 113.498 171.6 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 18.7 t70 -46.16 -48.15 17.51 Favored 'General case' 0 N--CA 1.43 -1.45 0 C-N-CA 126.491 1.917 . . . . 1.0 114.093 178.284 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 12.5 mm100 -55.72 -60.6 3.21 Favored 'General case' 0 N--CA 1.43 -1.456 0 N-CA-C 114.522 1.305 . . . . 1.0 114.522 172.944 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 2.5 pp -74.49 -37.68 63.09 Favored 'General case' 0 N--CA 1.43 -1.459 0 N-CA-C 116.585 2.068 . . . . 1.0 116.585 -175.497 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 11.9 m0 -55.6 -47.06 77.11 Favored 'General case' 0 N--CA 1.431 -1.411 0 C-N-CA 127.753 2.421 . . . . 1.0 112.109 171.663 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 47.8 tp -59.73 -45.25 92.75 Favored 'General case' 0 N--CA 1.43 -1.451 0 O-C-N 121.057 -1.027 . . . . 1.0 113.468 172.142 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 25.5 m -56.28 -46.34 79.78 Favored 'General case' 0 N--CA 1.431 -1.383 0 N-CA-C 114.853 1.427 . . . . 1.0 114.853 175.387 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 67.6 mt -64.75 -46.21 92.82 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.437 0 O-C-N 120.431 -1.418 . . . . 1.0 112.206 178.263 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 58.1 tt0 -53.41 -58.41 7.22 Favored 'General case' 0 N--CA 1.43 -1.443 0 C-N-CA 125.047 1.339 . . . . 1.0 111.939 174.765 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 23.7 mt-10 -55.68 -55.43 32.26 Favored 'General case' 0 N--CA 1.43 -1.446 0 C-N-CA 125.789 1.635 . . . . 1.0 115.138 176.748 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 7.2 tpm_? -52.31 -49.18 64.74 Favored 'General case' 0 N--CA 1.43 -1.445 0 C-N-CA 124.578 1.151 . . . . 1.0 113.056 -177.456 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 12.8 tp -81.51 -36.51 29.15 Favored 'General case' 0 N--CA 1.43 -1.432 0 N-CA-C 113.991 1.108 . . . . 1.0 113.991 -176.335 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 27.4 t70 -64.17 -34.36 77.9 Favored 'General case' 0 N--CA 1.431 -1.42 0 O-C-N 119.994 -1.691 . . . . 1.0 114.51 176.567 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 10.1 t70 -67.87 -26.81 66.21 Favored 'General case' 0 N--CA 1.43 -1.431 0 O-C-N 120.185 -1.572 . . . . 1.0 113.388 172.752 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 24' ' ' TRP . . . . . . . . . . . . . 0.2 OUTLIER -75.92 148.84 37.93 Favored 'General case' 0 N--CA 1.43 -1.426 0 O-C-N 120.154 -1.591 . . . . 1.0 114.003 -167.512 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 2.3 t70 -129.1 133.78 47.8 Favored 'General case' 0 N--CA 1.429 -1.491 0 O-C-N 120.528 -1.358 . . . . 1.0 108.972 -175.099 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -166.64 -149.16 5.85 Favored Glycine 0 N--CA 1.431 -1.652 0 O-C-N 120.536 -1.352 . . . . 1.0 112.521 -171.439 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 10.9 t70 -77.03 -41.65 41.72 Favored 'General case' 0 N--CA 1.431 -1.421 0 N-CA-C 107.88 -1.156 . . . . 1.0 107.88 168.439 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 47.1 m -65.2 141.62 58.6 Favored 'General case' 0 N--CA 1.43 -1.471 0 C-N-CA 125.275 1.43 . . . . 1.0 114.236 174.083 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 20.0 t70 -110.97 147.3 35.0 Favored 'General case' 0 N--CA 1.429 -1.517 0 N-CA-C 105.993 -1.854 . . . . 1.0 105.993 171.5 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 48.6 mm -135.02 115.7 19.07 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.457 0 C-N-CA 125.555 1.542 . . . . 1.0 108.528 -160.895 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -121.83 110.22 15.63 Favored 'General case' 0 N--CA 1.43 -1.472 0 C-N-CA 124.461 1.104 . . . . 1.0 109.188 158.718 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 10.3 t -77.13 143.73 38.94 Favored 'General case' 0 N--CA 1.429 -1.507 0 O-C-N 118.625 -2.547 . . . . 1.0 110.204 164.952 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 52.2 mt-10 -101.74 140.07 36.53 Favored 'General case' 0 N--CA 1.431 -1.415 0 C-N-CA 124.37 1.068 . . . . 1.0 109.302 172.211 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 2.5 tp -122.1 107.33 19.56 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.488 0 CA-C-O 124.327 2.013 . . . . 1.0 108.372 177.293 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 35.1 m120 -117.79 68.57 0.76 Allowed 'General case' 0 N--CA 1.43 -1.434 0 CA-C-N 114.425 -1.261 . . . . 1.0 109.651 176.499 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . 73.17 -86.55 0.58 Allowed Glycine 0 N--CA 1.43 -1.713 0 C-N-CA 125.363 1.459 . . . . 1.0 114.334 173.088 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -120.34 27.31 6.7 Favored Glycine 0 N--CA 1.429 -1.79 0 C-N-CA 125.332 1.444 . . . . 1.0 111.866 175.019 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 66.4 t -128.34 129.11 69.03 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.449 0 N-CA-C 107.661 -1.237 . . . . 1.0 107.661 169.628 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 46.3 mt -113.02 123.97 51.56 Favored 'General case' 0 N--CA 1.429 -1.481 0 CA-C-O 122.846 1.307 . . . . 1.0 108.655 166.754 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -121.84 116.33 24.24 Favored 'General case' 0 N--CA 1.43 -1.455 0 N-CA-C 106.348 -1.723 . . . . 1.0 106.348 179.385 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 49.3 mt -94.04 116.1 34.45 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.411 0 O-C-N 119.625 -1.922 . . . . 1.0 108.644 -172.985 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 47.0 p -109.76 120.06 41.29 Favored 'General case' 0 N--CA 1.43 -1.438 0 N-CA-C 113.237 0.828 . . . . 1.0 113.237 -173.656 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 43' ' ' PHE . . . . . . . . . . . . 0.25 1.2 p90 -118.23 166.34 12.72 Favored 'General case' 0 N--CA 1.429 -1.492 0 CA-C-O 123.322 1.534 . . . . 1.0 114.093 179.487 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 1.1 pp20? -63.13 -31.4 72.54 Favored 'General case' 0 N--CA 1.43 -1.45 0 N-CA-C 117.517 2.414 . . . . 1.0 117.517 -159.179 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 59.5 m-80 -74.81 -0.36 18.08 Favored 'General case' 0 N--CA 1.431 -1.411 0 N-CA-C 114.905 1.446 . . . . 1.0 114.905 176.67 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 99.41 -1.3 57.19 Favored Glycine 0 N--CA 1.432 -1.613 0 O-C-N 120.673 -1.267 . . . . 1.0 113.255 166.849 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 3.4 p -96.52 164.47 12.6 Favored 'General case' 0 N--CA 1.428 -1.548 0 C-N-CA 127.028 2.131 . . . . 1.0 110.255 178.439 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 54.3 pttt -162.35 158.93 24.74 Favored 'General case' 0 N--CA 1.429 -1.479 0 CA-C-O 122.468 1.128 . . . . 1.0 113.655 -171.108 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 17.9 mm -103.7 140.14 22.71 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.412 0 C-N-CA 125.258 1.423 . . . . 1.0 107.232 179.073 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 50' ' ' ILE . . . . . 0.416 ' HB ' ' HB3' ' A' ' 63' ' ' ALA . 1.2 mm -122.39 108.04 20.89 Favored 'Isoleucine or valine' 0 N--CA 1.428 -1.53 0 CA-C-N 119.649 1.113 . . . . 1.0 110.299 -175.34 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 2.7 mt -122.82 98.6 5.82 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.463 0 CA-C-O 123.357 1.551 . . . . 1.0 111.828 179.117 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 2.3 m120 -108.81 148.0 31.23 Favored 'General case' 0 N--CA 1.429 -1.51 0 C-N-CA 127.896 2.478 . . . . 1.0 108.727 174.796 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 39.1 ttp180 -154.29 134.29 13.1 Favored 'General case' 0 N--CA 1.429 -1.496 0 CA-C-N 113.729 -1.578 . . . . 1.0 108.305 -167.055 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -89.55 129.47 36.01 Favored 'General case' 0 N--CA 1.431 -1.391 0 N-CA-C 106.687 -1.598 . . . . 1.0 106.687 163.617 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 37.8 tt0 -63.7 -51.25 67.05 Favored Pre-proline 0 N--CA 1.431 -1.393 0 CA-C-O 116.573 -1.68 . . . . 1.0 113.431 172.581 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 52.6 Cg_exo -67.29 -175.69 0.71 Allowed 'Trans proline' 0 N--CA 1.433 -2.055 0 CA-C-N 125.307 2.931 . . . . 1.0 114.707 162.707 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 15.0 mt 82.38 -30.07 0.1 Allowed 'General case' 0 N--CA 1.43 -1.452 0 C-N-CA 127.657 2.383 . . . . 1.0 114.934 169.439 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER 76.87 47.38 0.07 Allowed 'General case' 0 N--CA 1.432 -1.364 0 C-N-CA 126.247 1.819 . . . . 1.0 114.204 170.433 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 38.2 tt0 -160.36 152.12 19.92 Favored 'General case' 0 N--CA 1.429 -1.48 0 O-C-N 120.693 -1.254 . . . . 1.0 108.27 179.031 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 15.6 t -120.73 156.91 23.91 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.486 0 C-N-CA 124.819 1.248 . . . . 1.0 109.83 179.634 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 61' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -99.35 153.49 18.93 Favored 'General case' 0 N--CA 1.43 -1.427 0 O-C-N 120.567 -1.333 . . . . 1.0 111.419 170.198 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -137.45 90.9 2.55 Favored 'General case' 0 N--CA 1.43 -1.457 0 O-C-N 120.103 -1.623 . . . . 1.0 109.862 179.116 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . 0.416 ' HB3' ' HB ' ' A' ' 50' ' ' ILE . . . -104.37 139.92 38.65 Favored 'General case' 0 N--CA 1.429 -1.492 0 O-C-N 119.943 -1.723 . . . . 1.0 111.858 175.647 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 64' ' ' THR . . . . . . . . . . . . . 80.8 p -150.44 -130.28 0.05 OUTLIER 'General case' 0 N--CA 1.43 -1.468 0 C-N-CA 126.633 1.973 . . . . 1.0 105.783 -163.082 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 4.7 tmtt? -84.82 -39.64 18.11 Favored 'General case' 0 N--CA 1.43 -1.434 0 O-C-N 120.254 -1.529 . . . . 1.0 110.913 166.076 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 1.7 tp-100 -78.62 -25.14 45.05 Favored 'General case' 0 N--CA 1.43 -1.453 0 N-CA-C 114.937 1.458 . . . . 1.0 114.937 -150.785 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 169.76 -52.04 0.2 Allowed Glycine 0 N--CA 1.43 -1.729 0 O-C-N 121.076 -1.015 . . . . 1.0 113.16 174.632 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 116.48 93.53 1.79 Allowed Glycine 0 N--CA 1.43 -1.7 0 C-N-CA 125.255 1.407 . . . . 1.0 110.843 -173.691 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 69' ' ' TYR . . . . . 0.486 ' CD1' ' HG2' ' A' ' 82' ' ' ARG . 13.5 m-85 -122.07 143.26 49.63 Favored 'General case' 0 N--CA 1.43 -1.464 0 N-CA-C 107.962 -1.125 . . . . 1.0 107.962 -166.406 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 70' ' ' HIS . . . . . . . . . . . . 0.275 1.3 p80 -89.47 160.92 16.52 Favored 'General case' 0 N--CA 1.429 -1.482 0 O-C-N 119.376 -2.078 . . . . 1.0 113.746 178.636 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 71' ' ' PHE . . . . . . . . . . . . 0.27 11.9 t80 -139.34 125.0 19.45 Favored 'General case' 0 N--CA 1.429 -1.48 0 CA-C-N 115.333 -0.849 . . . . 1.0 111.076 -149.589 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -126.25 161.4 27.83 Favored 'General case' 0 N--CA 1.431 -1.402 0 C-N-CA 123.746 0.818 . . . . 1.0 109.974 178.089 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 57.3 tp -96.11 121.83 38.29 Favored 'General case' 0 N--CA 1.43 -1.434 0 O-C-N 119.599 -1.938 . . . . 1.0 110.403 176.391 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 20.0 mmmt -84.89 -48.56 9.2 Favored 'General case' 0 N--CA 1.43 -1.461 0 O-C-N 120.989 -1.069 . . . . 1.0 112.815 175.74 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -171.85 -69.77 0.04 OUTLIER Glycine 0 N--CA 1.429 -1.77 0 N-CA-C 110.843 -0.903 . . . . 1.0 110.843 179.007 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 20.2 p-10 -90.06 -26.92 20.03 Favored 'General case' 0 N--CA 1.43 -1.469 0 O-C-N 121.07 -1.253 . . . . 1.0 111.09 179.089 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 5.8 mt-10 -152.58 155.75 37.97 Favored 'General case' 0 N--CA 1.429 -1.492 0 N-CA-C 104.161 -2.533 . . . . 1.0 104.161 -164.417 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 78' ' ' TRP . . . . . . . . . . . . . 31.0 m95 -86.69 123.59 32.03 Favored 'General case' 0 N--CA 1.43 -1.456 0 N-CA-C 107.084 -1.45 . . . . 1.0 107.084 -178.311 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 3.3 mt -101.47 137.12 30.26 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.484 0 CA-C-O 123.893 1.806 . . . . 1.0 106.332 176.804 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 74.8 m -77.17 145.95 37.37 Favored 'General case' 0 N--CA 1.428 -1.527 0 CA-C-N 114.411 -1.268 . . . . 1.0 109.977 -175.593 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 37.6 t0 -73.44 -43.51 60.2 Favored 'General case' 0 N--CA 1.431 -1.416 0 O-C-N 120.469 -1.394 . . . . 1.0 111.953 -174.007 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 82' ' ' ARG . . . . . 0.486 ' HG2' ' CD1' ' A' ' 69' ' ' TYR . 0.1 OUTLIER -79.11 134.55 36.72 Favored 'General case' 0 N--CA 1.43 -1.463 0 O-C-N 119.977 -1.702 . . . . 1.0 110.378 176.911 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 8.0 t 65.58 -66.24 0.15 Allowed 'General case' 0 N--CA 1.43 -1.437 0 N-CA-C 116.215 1.932 . . . . 1.0 116.215 -179.951 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 130.48 89.49 0.52 Allowed Glycine 0 N--CA 1.43 -1.711 0 N-CA-C 107.474 -2.25 . . . . 1.0 107.474 -167.417 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 52.3 mt-10 -137.97 -168.33 2.33 Favored 'General case' 0 N--CA 1.431 -1.413 0 N-CA-C 105.162 -2.162 . . . . 1.0 105.162 -178.755 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 32.0 m -154.99 130.71 9.96 Favored 'General case' 0 N--CA 1.43 -1.471 0 O-C-N 119.346 -2.096 . . . . 1.0 111.102 -150.661 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 1.1 t80 -25.79 -92.56 0.0 OUTLIER 'General case' 0 N--CA 1.429 -1.492 0 N-CA-C 119.674 3.213 . . . . 1.0 119.674 174.7 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 88' ' ' TRP . . . . . . . . . . . . . 78.8 m95 -72.12 -26.8 62.26 Favored 'General case' 0 N--CA 1.429 -1.483 0 O-C-N 120.392 -1.442 . . . . 1.0 110.379 -169.819 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -68.42 -49.97 56.14 Favored 'General case' 0 N--CA 1.43 -1.454 0 C-N-CA 125.409 1.483 . . . . 1.0 113.139 178.413 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -70.14 -42.74 72.16 Favored 'General case' 0 N--CA 1.429 -1.48 0 CA-C-O 122.969 1.366 . . . . 1.0 111.73 -177.565 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 24.6 tp -53.76 -49.86 67.29 Favored 'General case' 0 N--CA 1.43 -1.459 0 C-N-CA 126.371 1.868 . . . . 1.0 112.946 173.996 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 1.9 tm-20 -58.21 -55.76 30.81 Favored 'General case' 0 N--CA 1.43 -1.443 0 C-N-CA 126.742 2.017 . . . . 1.0 114.816 173.71 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 3.6 pt20 -63.96 -43.42 95.83 Favored 'General case' 0 N--CA 1.43 -1.437 0 O-C-N 120.577 -1.327 . . . . 1.0 114.068 -177.452 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -62.79 -47.97 81.15 Favored 'General case' 0 N--CA 1.43 -1.442 0 O-C-N 120.635 -1.29 . . . . 1.0 113.057 175.098 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -63.43 -35.99 82.24 Favored 'General case' 0 N--CA 1.428 -1.536 0 O-C-N 120.312 -1.493 . . . . 1.0 113.399 176.98 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 91.5 m -57.75 -51.96 67.41 Favored 'General case' 0 N--CA 1.43 -1.456 0 C-N-CA 125.526 1.53 . . . . 1.0 112.474 173.149 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 5.0 pt20 -70.18 -31.34 68.77 Favored 'General case' 0 N--CA 1.43 -1.45 0 N-CA-C 114.75 1.389 . . . . 1.0 114.75 -179.847 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 51.0 mt-30 -66.26 -46.71 76.12 Favored 'General case' 0 N--CA 1.43 -1.468 0 O-C-N 119.741 -1.849 . . . . 1.0 114.806 169.876 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -77.98 -46.88 19.85 Favored 'General case' 0 N--CA 1.428 -1.534 0 N-CA-C 113.912 1.078 . . . . 1.0 113.912 -176.335 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . 99.58 24.7 9.84 Favored Glycine 0 N--CA 1.431 -1.691 0 C-N-CA 124.502 1.048 . . . . 1.0 113.422 -175.499 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 13.7 pt-20 -161.63 160.69 29.08 Favored 'General case' 0 N--CA 1.429 -1.482 0 N-CA-C 106.495 -1.669 . . . . 1.0 106.495 174.672 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 70.2 m -66.63 112.18 4.03 Favored 'General case' 0 N--CA 1.429 -1.5 0 CA-C-N 120.087 1.312 . . . . 1.0 112.43 -178.522 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 39.9 t -100.49 108.43 23.03 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.453 0 N-CA-C 107.302 -1.37 . . . . 1.0 107.302 173.867 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 44.0 p -141.31 127.72 19.95 Favored 'General case' 0 N--CA 1.43 -1.442 0 N-CA-C 113.792 1.034 . . . . 1.0 113.792 -169.483 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 5.2 t80 -93.85 -24.31 17.79 Favored 'General case' 0 N--CA 1.43 -1.458 0 C-N-CA 124.059 0.944 . . . . 1.0 109.759 167.366 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 18.3 mmm-85 . . . . . 0 C--O 1.261 1.661 0 O-C-N 120.971 -1.081 . . . . 1.0 110.385 -175.56 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 23.6 t-20 . . . . . 0 N--CA 1.431 -1.397 0 CA-C-O 121.772 0.796 . . . . 1.0 112.892 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 16.2 m-20 -61.69 -54.16 46.33 Favored 'General case' 0 N--CA 1.43 -1.447 0 C-N-CA 125.96 1.704 . . . . 1.0 113.924 176.451 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 53.9 m -65.56 -33.57 76.22 Favored 'General case' 0 N--CA 1.429 -1.496 0 O-C-N 120.462 -1.399 . . . . 1.0 113.247 -177.705 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 37.0 tt0 -60.33 -55.09 37.92 Favored 'General case' 0 N--CA 1.43 -1.448 0 C-N-CA 124.306 1.042 . . . . 1.0 112.488 170.471 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 19.8 t80 -50.56 -48.11 57.58 Favored 'General case' 0 N--CA 1.431 -1.425 0 N-CA-C 114.651 1.352 . . . . 1.0 114.651 170.829 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 7.5 t-80 -55.62 -55.72 28.75 Favored 'General case' 0 N--CA 1.43 -1.435 0 C-N-CA 125.979 1.712 . . . . 1.0 114.939 177.344 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 42.6 mtm105 -61.12 -54.37 45.38 Favored 'General case' 0 CA--C 1.49 -1.357 0 C-N-CA 124.86 1.264 . . . . 1.0 113.017 179.92 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 95.9 mt -59.9 -46.45 89.31 Favored 'General case' 0 N--CA 1.431 -1.393 0 O-C-N 121.249 -0.907 . . . . 1.0 113.299 -179.221 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -57.53 -43.46 84.36 Favored 'General case' 0 N--CA 1.43 -1.448 0 N-CA-C 113.779 1.029 . . . . 1.0 113.779 177.355 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 15.9 t0 -63.27 -46.96 84.4 Favored 'General case' 0 N--CA 1.43 -1.45 0 N-CA-C 113.297 0.851 . . . . 1.0 113.297 177.307 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 59.7 mt-30 -61.04 -48.61 80.97 Favored 'General case' 0 N--CA 1.432 -1.35 0 N-CA-C 116.357 1.984 . . . . 1.0 116.357 174.92 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 3.9 pp -67.39 -39.11 85.59 Favored 'General case' 0 N--CA 1.43 -1.474 0 O-C-N 119.917 -1.739 . . . . 1.0 113.996 179.626 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 5.6 m0 -48.69 -57.52 6.15 Favored 'General case' 0 N--CA 1.43 -1.459 0 C-N-CA 126.039 1.736 . . . . 1.0 114.195 166.983 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 51.6 tp -58.7 -41.82 87.17 Favored 'General case' 0 N--CA 1.431 -1.41 0 N-CA-C 113.819 1.044 . . . . 1.0 113.819 177.741 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 90.3 m -57.74 -55.44 34.83 Favored 'General case' 0 N--CA 1.43 -1.444 0 C-N-CA 125.819 1.647 . . . . 1.0 113.496 175.915 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 86.1 mt -59.76 -48.9 85.85 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.419 0 C-N-CA 125.557 1.543 . . . . 1.0 112.397 176.768 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 69.6 tt0 -54.92 -53.3 57.29 Favored 'General case' 0 N--CA 1.428 -1.525 0 C-N-CA 125.226 1.41 . . . . 1.0 113.776 178.666 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 34.8 tt0 -63.88 -43.78 95.02 Favored 'General case' 0 N--CA 1.429 -1.523 0 N-CA-C 114.484 1.29 . . . . 1.0 114.484 179.287 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 6.8 tpt180 -67.19 -35.31 79.38 Favored 'General case' 0 N--CA 1.43 -1.438 0 N-CA-C 114.562 1.319 . . . . 1.0 114.562 -179.559 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 94.6 mt -78.23 -35.87 47.76 Favored 'General case' 0 N--CA 1.43 -1.466 0 O-C-N 120.627 -1.295 . . . . 1.0 113.409 174.314 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 37.2 t70 -57.87 -33.12 68.35 Favored 'General case' 0 N--CA 1.43 -1.465 0 C-N-CA 125.155 1.382 . . . . 1.0 113.026 171.036 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 33.6 t70 -69.79 -18.66 63.49 Favored 'General case' 0 N--CA 1.431 -1.41 0 N-CA-C 114.382 1.253 . . . . 1.0 114.382 174.359 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 24' ' ' TRP . . . . . . . . . . . . . 28.8 t-105 -75.99 152.44 36.98 Favored 'General case' 0 N--CA 1.429 -1.488 0 O-C-N 119.225 -2.172 . . . . 1.0 114.184 -171.557 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 1.8 t0 -154.33 175.79 13.11 Favored 'General case' 0 N--CA 1.431 -1.419 0 N-CA-C 108.635 -0.876 . . . . 1.0 108.635 -174.059 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 160.03 -131.43 2.68 Favored Glycine 0 N--CA 1.43 -1.733 0 N-CA-C 110.911 -0.875 . . . . 1.0 110.911 -178.655 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -86.52 -34.47 19.97 Favored 'General case' 0 N--CA 1.429 -1.489 0 C-N-CA 125.523 1.529 . . . . 1.0 108.697 170.566 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 39.3 m -85.5 172.29 11.1 Favored 'General case' 0 N--CA 1.43 -1.434 0 C-N-CA 124.795 1.238 . . . . 1.0 112.918 -176.589 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 43.1 t0 -121.41 151.43 40.19 Favored 'General case' 0 N--CA 1.431 -1.408 0 C-N-CA 125.874 1.67 . . . . 1.0 106.92 176.116 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -159.84 117.72 0.2 Allowed 'Isoleucine or valine' 0 N--CA 1.43 -1.46 0 CA-C-O 122.355 1.074 . . . . 1.0 108.265 -167.863 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 23.8 t0 -136.21 134.82 38.55 Favored 'General case' 0 N--CA 1.428 -1.546 0 O-C-N 120.83 -1.169 . . . . 1.0 109.066 175.451 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 73.4 m -100.66 138.82 37.21 Favored 'General case' 0 N--CA 1.43 -1.47 0 O-C-N 119.531 -1.981 . . . . 1.0 111.423 179.793 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 52.6 mt-10 -109.81 134.44 52.03 Favored 'General case' 0 N--CA 1.43 -1.459 0 O-C-N 121.102 -0.999 . . . . 1.0 109.929 -172.09 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 2.3 tp -105.29 106.41 20.46 Favored 'Isoleucine or valine' 0 CA--C 1.488 -1.413 0 N-CA-C 105.25 -2.13 . . . . 1.0 105.25 169.304 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 55.2 t30 -135.55 107.5 7.11 Favored 'General case' 0 N--CA 1.43 -1.457 0 CA-C-N 114.777 -1.101 . . . . 1.0 109.899 -173.242 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . 67.11 31.44 77.7 Favored Glycine 0 N--CA 1.43 -1.756 0 O-C-N 120.413 -1.43 . . . . 1.0 114.944 174.179 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 81.64 4.54 90.34 Favored Glycine 0 N--CA 1.429 -1.794 0 O-C-N 121.231 -1.158 . . . . 1.0 114.775 -174.581 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 24.2 t -103.51 127.36 57.57 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.471 0 N-CA-C 107.963 -1.125 . . . . 1.0 107.963 175.353 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 12.3 mt -88.64 127.14 35.56 Favored 'General case' 0 N--CA 1.431 -1.385 0 CA-C-O 123.626 1.679 . . . . 1.0 107.084 161.601 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -130.09 115.04 16.51 Favored 'General case' 0 N--CA 1.429 -1.492 0 N-CA-C 105.759 -1.941 . . . . 1.0 105.759 -169.605 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 82.9 mt -94.14 110.78 24.1 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.485 0 N-CA-C 107.867 -1.16 . . . . 1.0 107.867 -168.625 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 9.8 p -112.65 126.6 55.55 Favored 'General case' 0 N--CA 1.431 -1.423 0 CA-C-O 121.662 0.744 . . . . 1.0 112.508 -170.319 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 43' ' ' PHE . . . . . . . . . . . . . 1.6 p90 -119.97 159.83 23.94 Favored 'General case' 0 N--CA 1.429 -1.489 0 O-C-N 120.558 -1.339 . . . . 1.0 110.405 174.048 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -66.03 -15.08 62.73 Favored 'General case' 0 N--CA 1.43 -1.475 0 N-CA-C 117.762 2.505 . . . . 1.0 117.762 -163.454 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 45.1 m-80 -71.8 -7.74 50.1 Favored 'General case' 0 N--CA 1.43 -1.429 0 C-N-CA 125.935 1.694 . . . . 1.0 113.845 173.472 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 88.76 41.42 6.0 Favored Glycine 0 N--CA 1.429 -1.819 0 O-C-N 120.942 -1.098 . . . . 1.0 114.668 165.888 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 17.0 m -150.99 168.92 23.08 Favored 'General case' 0 N--CA 1.43 -1.45 0 N-CA-C 106.058 -1.831 . . . . 1.0 106.058 179.597 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -156.96 153.27 27.78 Favored 'General case' 0 N--CA 1.43 -1.442 0 N-CA-C 114.295 1.22 . . . . 1.0 114.295 -168.202 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 5.0 mm -97.61 140.62 17.43 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.478 0 C-N-CA 125.825 1.65 . . . . 1.0 106.963 177.598 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 4.7 mm -115.85 118.16 57.9 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.468 0 C-N-CA 124.616 1.166 . . . . 1.0 110.176 -171.935 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 3.4 mt -128.68 120.87 53.55 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.479 0 CA-C-O 122.806 1.288 . . . . 1.0 112.476 -176.876 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 52' ' ' ASN . . . . . 0.446 ' H ' ' HD1' ' A' ' 61' ' ' TRP . 47.2 t30 -156.46 169.17 25.24 Favored 'General case' 0 N--CA 1.429 -1.488 0 N-CA-C 105.374 -2.084 . . . . 1.0 105.374 -178.739 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 29.6 ptt180 -140.57 127.22 20.3 Favored 'General case' 0 N--CA 1.431 -1.409 0 C-N-CA 124.777 1.231 . . . . 1.0 113.004 -159.315 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -110.46 108.2 18.13 Favored 'General case' 0 N--CA 1.43 -1.469 0 C-N-CA 125.212 1.405 . . . . 1.0 110.935 -174.641 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 86.8 mt-10 -64.82 -52.76 48.2 Favored Pre-proline 0 N--CA 1.43 -1.462 0 N-CA-C 118.363 2.727 . . . . 1.0 118.363 -169.497 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 31.9 Cg_exo -73.52 -10.62 23.89 Favored 'Trans proline' 0 N--CA 1.433 -2.033 0 CA-C-N 128.01 3.896 . . . . 1.0 114.01 -168.971 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 35.0 mt -94.1 -22.37 18.53 Favored 'General case' 0 N--CA 1.431 -1.425 0 C-N-CA 126.282 1.833 . . . . 1.0 109.159 177.535 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 32.3 m80 65.91 47.92 1.92 Allowed 'General case' 0 N--CA 1.429 -1.494 0 C-N-CA 126.614 1.965 . . . . 1.0 111.193 175.145 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 13.9 pt20 -144.01 149.33 36.55 Favored 'General case' 0 N--CA 1.429 -1.49 0 C-N-CA 124.31 1.044 . . . . 1.0 110.733 -178.769 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 4.2 t -100.2 153.23 4.6 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.5 0 N-CA-C 108.372 -0.973 . . . . 1.0 108.372 172.043 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 61' ' ' TRP . . . . . 0.446 ' HD1' ' H ' ' A' ' 52' ' ' ASN . 0.0 OUTLIER -102.73 155.3 18.41 Favored 'General case' 0 N--CA 1.43 -1.443 0 O-C-N 119.856 -1.777 . . . . 1.0 113.784 173.337 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . 0.4 ' O ' ' HA2' ' A' ' 68' ' ' GLY . 18.2 mt -125.52 94.93 4.28 Favored 'General case' 0 N--CA 1.432 -1.36 0 N-CA-C 106.16 -1.793 . . . . 1.0 106.16 164.207 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -98.56 140.7 32.4 Favored 'General case' 0 N--CA 1.429 -1.49 0 CA-C-O 122.712 1.244 . . . . 1.0 110.113 171.812 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 64' ' ' THR . . . . . . . . . . . . . 6.3 t -153.47 -130.04 0.04 OUTLIER 'General case' 0 N--CA 1.431 -1.414 0 O-C-N 120.767 -1.208 . . . . 1.0 109.011 -169.883 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 3.4 tmtp? -72.01 -64.96 0.83 Allowed 'General case' 0 N--CA 1.429 -1.498 0 O-C-N 119.969 -1.707 . . . . 1.0 111.537 -179.871 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -128.24 -26.69 2.79 Favored 'General case' 0 N--CA 1.429 -1.507 0 O-C-N 121.41 -0.806 . . . . 1.0 112.011 179.139 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . -94.84 61.96 1.62 Allowed Glycine 0 N--CA 1.431 -1.668 0 O-C-N 121.062 -1.024 . . . . 1.0 113.486 -168.62 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 68' ' ' GLY . . . . . 0.4 ' HA2' ' O ' ' A' ' 62' ' ' LEU . . . -75.17 83.81 0.84 Allowed Glycine 0 N--CA 1.43 -1.705 0 CA-C-O 122.609 1.116 . . . . 1.0 115.663 174.412 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 20.0 m-30 -113.96 148.28 37.16 Favored 'General case' 0 N--CA 1.43 -1.432 0 N-CA-C 107.454 -1.313 . . . . 1.0 107.454 -169.634 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 18.1 p-80 -86.52 157.77 19.69 Favored 'General case' 0 N--CA 1.43 -1.428 0 O-C-N 120.288 -1.507 . . . . 1.0 111.272 174.593 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 71' ' ' PHE . . . . . . . . . . . . 0.294 86.9 t80 -121.41 113.18 19.51 Favored 'General case' 0 N--CA 1.43 -1.447 0 C-N-CA 125.671 1.588 . . . . 1.0 107.951 -157.147 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 12.1 m-20 -146.99 157.57 43.66 Favored 'General case' 0 N--CA 1.428 -1.56 0 CA-C-N 119.501 1.046 . . . . 1.0 111.323 -175.532 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 27.5 tp -84.78 137.09 33.4 Favored 'General case' 0 N--CA 1.432 -1.366 0 O-C-N 120.465 -1.397 . . . . 1.0 113.711 -172.302 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 38.9 mmtm -106.14 -96.63 0.35 Allowed 'General case' 0 N--CA 1.429 -1.475 0 C-N-CA 125.143 1.377 . . . . 1.0 108.926 166.971 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -100.7 -96.28 2.22 Favored Glycine 0 N--CA 1.429 -1.774 0 O-C-N 120.946 -1.096 . . . . 1.0 112.989 178.637 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 44.2 t0 -98.19 17.02 19.55 Favored 'General case' 0 N--CA 1.431 -1.394 0 C-N-CA 125.409 1.484 . . . . 1.0 108.182 173.587 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 5.3 mm-40 -135.78 124.58 23.97 Favored 'General case' 0 N--CA 1.43 -1.472 0 N-CA-C 106.162 -1.792 . . . . 1.0 106.162 -167.834 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 78' ' ' TRP . . . . . . . . . . . . . 46.8 m95 -80.56 102.22 9.63 Favored 'General case' 0 N--CA 1.43 -1.472 0 N-CA-C 104.639 -2.356 . . . . 1.0 104.639 161.536 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 1.7 pt -89.22 158.04 2.99 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.474 0 O-C-N 119.184 -2.197 . . . . 1.0 108.122 179.313 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 89.6 m -81.63 116.04 21.18 Favored 'General case' 0 N--CA 1.432 -1.359 0 N-CA-C 106.409 -1.7 . . . . 1.0 106.409 170.974 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 6.1 t70 -69.91 -41.58 74.47 Favored 'General case' 0 N--CA 1.431 -1.412 0 C-N-CA 126.147 1.779 . . . . 1.0 112.538 -161.744 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 27.3 ttt180 -73.24 125.23 27.29 Favored 'General case' 0 N--CA 1.431 -1.389 0 C-N-CA 125.8 1.64 . . . . 1.0 109.514 172.345 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 83' ' ' SER . . . . . . . . . . . . 0.341 56.8 m 73.17 -42.44 0.53 Allowed 'General case' 0 N--CA 1.43 -1.462 0 C-N-CA 126.511 1.924 . . . . 1.0 115.717 -174.947 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 107.18 70.16 0.72 Allowed Glycine 0 N--CA 1.43 -1.752 0 O-C-N 120.629 -1.294 . . . . 1.0 114.38 166.564 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 64.1 mm-40 -120.27 -126.62 0.27 Allowed 'General case' 0 N--CA 1.429 -1.481 0 CA-C-N 117.953 0.877 . . . . 1.0 112.519 -169.383 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 92.7 m -158.59 140.22 13.54 Favored 'General case' 0 N--CA 1.43 -1.467 0 O-C-N 119.806 -1.808 . . . . 1.0 108.851 -168.527 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 0.8 OUTLIER -42.94 -92.46 0.0 OUTLIER 'General case' 0 N--CA 1.43 -1.47 0 C-N-CA 127.699 2.399 . . . . 1.0 115.704 172.366 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 88' ' ' TRP . . . . . . . . . . . . . 1.1 t-105 -75.57 -26.61 58.08 Favored 'General case' 0 N--CA 1.428 -1.535 0 O-C-N 120.517 -1.365 . . . . 1.0 111.01 -164.739 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 60.2 m-20 -63.8 -42.53 97.69 Favored 'General case' 0 N--CA 1.43 -1.442 0 O-C-N 120.175 -1.578 . . . . 1.0 114.586 173.531 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 33.3 tp -74.66 -41.74 59.76 Favored 'General case' 0 N--CA 1.428 -1.526 0 O-C-N 119.457 -2.027 . . . . 1.0 111.733 178.589 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 37.0 tp -55.06 -35.4 64.47 Favored 'General case' 0 N--CA 1.431 -1.415 0 C-N-CA 126.617 1.967 . . . . 1.0 114.371 169.947 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 3.0 tm-20 -61.9 -53.51 54.81 Favored 'General case' 0 N--CA 1.43 -1.428 0 C-N-CA 126.189 1.796 . . . . 1.0 111.222 167.466 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 6.5 tt0 -56.01 -46.33 78.82 Favored 'General case' 0 N--CA 1.43 -1.435 0 CA-C-N 120.808 1.64 . . . . 1.0 115.151 176.514 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -51.67 -58.19 7.07 Favored 'General case' 0 N--CA 1.43 -1.438 0 C-N-CA 127.104 2.162 . . . . 1.0 114.584 171.859 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -64.63 -42.61 95.36 Favored 'General case' 0 N--CA 1.429 -1.487 0 O-C-N 120.5 -1.375 . . . . 1.0 113.604 178.366 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 44.5 m -57.87 -48.35 80.07 Favored 'General case' 0 N--CA 1.43 -1.431 0 C-N-CA 126.561 1.945 . . . . 1.0 112.56 175.403 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 2.0 pt20 -70.3 -28.36 65.13 Favored 'General case' 0 N--CA 1.429 -1.485 0 O-C-N 120.185 -1.572 . . . . 1.0 114.043 -179.953 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 3.6 mm-40 -81.84 -36.65 28.04 Favored 'General case' 0 N--CA 1.429 -1.477 0 O-C-N 120.033 -1.667 . . . . 1.0 114.263 175.656 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -86.14 -34.57 20.54 Favored 'General case' 0 N--CA 1.43 -1.435 0 O-C-N 120.518 -1.364 . . . . 1.0 114.186 -179.817 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . 92.67 22.06 29.69 Favored Glycine 0 N--CA 1.429 -1.794 0 O-C-N 120.514 -1.366 . . . . 1.0 114.073 178.156 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 12.0 pt-20 -158.17 158.46 34.64 Favored 'General case' 0 N--CA 1.43 -1.436 0 N-CA-C 104.707 -2.331 . . . . 1.0 104.707 -172.631 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 39.7 m -74.02 112.68 10.38 Favored 'General case' 0 N--CA 1.43 -1.444 0 CA-C-N 121.318 1.872 . . . . 1.0 111.848 178.205 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 44.7 t -107.24 101.59 12.72 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.444 0 CA-C-O 122.623 1.201 . . . . 1.0 108.315 177.071 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 66.1 p -139.76 149.91 44.14 Favored 'General case' 0 N--CA 1.429 -1.494 0 O-C-N 120.939 -1.101 . . . . 1.0 113.823 -168.057 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 105' ' ' PHE . . . . . . . . . . . . 0.262 0.0 OUTLIER -106.74 -21.94 12.88 Favored 'General case' 0 N--CA 1.429 -1.49 0 C-N-CA 124.679 1.192 . . . . 1.0 110.602 158.76 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 5.2 mmm180 . . . . . 0 C--O 1.26 1.628 0 CA-C-O 117.659 -1.162 . . . . 1.0 111.118 -178.855 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 1.8 p30 . . . . . 0 N--CA 1.43 -1.435 0 N-CA-C 112.278 0.473 . . . . 1.0 112.278 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 3.8 m-20 -55.71 -48.67 74.75 Favored 'General case' 0 N--CA 1.431 -1.424 0 C-N-CA 126.605 1.962 . . . . 1.0 114.784 -173.079 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 19.2 m -52.36 -53.93 38.3 Favored 'General case' 0 N--CA 1.43 -1.456 0 C-N-CA 125.186 1.394 . . . . 1.0 113.905 178.418 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 45.0 mt-10 -57.48 -58.59 7.62 Favored 'General case' 0 N--CA 1.431 -1.425 0 C-N-CA 125.49 1.516 . . . . 1.0 112.082 176.414 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 6' ' ' PHE . . . . . 0.474 ' HB2' ' CD2' ' A' ' 58' ' ' HIS . 2.7 t80 -56.56 -39.44 73.45 Favored 'General case' 0 N--CA 1.43 -1.459 0 N-CA-C 116.481 2.03 . . . . 1.0 116.481 178.967 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 29.7 m170 -67.82 -44.16 77.92 Favored 'General case' 0 CA--C 1.489 -1.372 0 O-C-N 121.061 -1.024 . . . . 1.0 113.454 179.418 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -70.89 -41.6 71.11 Favored 'General case' 0 N--CA 1.431 -1.392 0 O-C-N 121.091 -1.006 . . . . 1.0 112.295 178.53 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 89.9 mt -62.49 -39.07 92.28 Favored 'General case' 0 N--CA 1.431 -1.421 0 O-C-N 119.682 -1.886 . . . . 1.0 113.554 174.157 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -59.74 -53.2 60.75 Favored 'General case' 0 N--CA 1.43 -1.473 0 C-N-CA 125.047 1.339 . . . . 1.0 112.776 172.53 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 40.1 t0 -47.44 -54.97 9.94 Favored 'General case' 0 N--CA 1.43 -1.473 0 C-N-CA 127.609 2.364 . . . . 1.0 112.965 177.098 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 42.4 mt-30 -55.23 -50.73 68.69 Favored 'General case' 0 N--CA 1.43 -1.46 0 N-CA-C 116.375 1.991 . . . . 1.0 116.375 173.705 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 1.8 pp -71.27 -38.35 71.85 Favored 'General case' 0 N--CA 1.429 -1.497 0 O-C-N 119.942 -1.724 . . . . 1.0 115.386 178.888 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 0.5 OUTLIER -45.78 -57.19 4.49 Favored 'General case' 0 N--CA 1.429 -1.489 0 C-N-CA 128.231 2.612 . . . . 1.0 113.45 168.195 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 3.0 pp -70.55 -30.34 67.04 Favored 'General case' 0 N--CA 1.43 -1.431 0 O-C-N 120.764 -1.21 . . . . 1.0 112.926 -179.193 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 97.3 m -64.27 -50.19 68.91 Favored 'General case' 0 N--CA 1.43 -1.45 0 C-N-CA 124.419 1.088 . . . . 1.0 112.815 174.516 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 82.7 mt -60.49 -47.53 92.29 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.477 0 O-C-N 120.621 -1.3 . . . . 1.0 111.706 175.422 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 3.8 tt0 -52.45 -57.23 10.52 Favored 'General case' 0 N--CA 1.43 -1.432 0 N-CA-C 114.611 1.337 . . . . 1.0 114.611 175.115 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 21.9 tt0 -75.64 -33.36 60.47 Favored 'General case' 0 N--CA 1.429 -1.504 0 N-CA-C 114.719 1.377 . . . . 1.0 114.719 -174.488 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 2.0 tpm_? -64.81 -44.28 90.39 Favored 'General case' 0 N--CA 1.43 -1.426 0 O-C-N 119.668 -1.895 . . . . 1.0 112.433 174.133 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 4.6 mm? -74.13 -31.41 62.74 Favored 'General case' 0 N--CA 1.431 -1.424 0 N-CA-C 113.18 0.807 . . . . 1.0 113.18 178.435 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 20.1 t70 -54.55 -53.57 52.71 Favored 'General case' 0 N--CA 1.431 -1.423 0 O-C-N 120.432 -1.418 . . . . 1.0 113.171 167.909 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 6.0 t70 -96.52 29.64 2.86 Favored 'General case' 0 N--CA 1.43 -1.435 0 CA-C-O 122.175 0.988 . . . . 1.0 112.721 -174.27 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 24' ' ' TRP . . . . . . . . . . . . . 54.6 t-105 -80.27 -177.71 6.25 Favored 'General case' 0 N--CA 1.43 -1.449 0 O-C-N 120.037 -1.664 . . . . 1.0 111.379 177.083 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 40.1 t0 -81.16 65.82 6.44 Favored 'General case' 0 N--CA 1.429 -1.499 0 O-C-N 119.857 -1.777 . . . . 1.0 111.199 179.525 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -179.84 138.74 3.52 Favored Glycine 0 N--CA 1.429 -1.789 0 N-CA-C 107.056 -2.418 . . . . 1.0 107.056 -179.844 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 3.9 t70 -108.74 -43.68 4.2 Favored 'General case' 0 N--CA 1.43 -1.474 0 N-CA-C 108.446 -0.946 . . . . 1.0 108.446 -179.705 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 67.8 m -85.57 159.92 19.76 Favored 'General case' 0 N--CA 1.43 -1.472 0 C-N-CA 126.041 1.737 . . . . 1.0 109.953 171.876 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . 0.655 ' HA ' ' H ' ' A' ' 44' ' ' GLU 0.3 15.9 t70 61.26 20.53 11.12 Favored 'General case' 0 N--CA 1.429 -1.497 0 C-N-CA 128.156 2.582 . . . . 1.0 116.572 176.854 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 10.0 tp -147.21 111.36 0.8 Allowed 'Isoleucine or valine' 0 N--CA 1.43 -1.458 0 O-C-N 120.148 -1.595 . . . . 1.0 107.814 173.219 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 38.2 t0 -153.31 108.68 3.23 Favored 'General case' 0 N--CA 1.43 -1.462 0 O-C-N 120.544 -1.347 . . . . 1.0 108.421 -175.514 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 11.8 t -86.31 143.86 27.67 Favored 'General case' 0 N--CA 1.429 -1.477 0 O-C-N 118.055 -2.903 . . . . 1.0 113.099 -174.855 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 91.7 mt-10 -92.77 136.94 32.8 Favored 'General case' 0 N--CA 1.431 -1.417 0 C-N-CA 125.735 1.614 . . . . 1.0 108.481 167.164 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 4.3 mp -129.66 105.94 12.91 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.444 0 N-CA-C 106.421 -1.696 . . . . 1.0 106.421 177.451 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 35.1 m120 -128.48 77.63 1.79 Allowed 'General case' 0 N--CA 1.43 -1.475 0 CA-C-N 114.768 -1.105 . . . . 1.0 111.045 -178.647 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . 62.49 26.77 68.57 Favored Glycine 0 N--CA 1.429 -1.806 0 N-CA-C 118.587 2.195 . . . . 1.0 118.587 161.255 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 130.92 -32.8 2.94 Favored Glycine 0 N--CA 1.431 -1.685 0 N-CA-C 109.785 -1.326 . . . . 1.0 109.785 -173.82 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 44.9 t -88.41 128.17 40.86 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.434 0 O-C-N 121.639 -0.918 . . . . 1.0 109.212 175.562 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 80.2 mt -114.9 130.26 56.87 Favored 'General case' 0 N--CA 1.43 -1.445 0 N-CA-C 108.089 -1.078 . . . . 1.0 108.089 169.12 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -122.98 114.98 21.14 Favored 'General case' 0 N--CA 1.43 -1.426 0 N-CA-C 106.188 -1.782 . . . . 1.0 106.188 174.926 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 58.7 mt -88.05 112.13 23.21 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.482 0 N-CA-C 105.25 -2.13 . . . . 1.0 105.25 -178.788 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 33.3 m -108.7 143.04 38.32 Favored 'General case' 0 N--CA 1.43 -1.446 0 CA-C-O 122.237 1.017 . . . . 1.0 109.916 -166.024 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 43' ' ' PHE . . . . . . . . . . . . . 53.0 m-85 -115.31 155.96 26.34 Favored 'General case' 0 N--CA 1.43 -1.433 0 C-N-CA 124.874 1.27 . . . . 1.0 108.127 -172.806 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . 0.655 ' H ' ' HA ' ' A' ' 29' ' ' ASP . 5.3 mm-40 -66.12 -23.16 66.44 Favored 'General case' 0 N--CA 1.429 -1.501 0 O-C-N 119.291 -2.131 . . . . 1.0 115.299 164.268 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 49.4 m-80 -65.92 -7.26 15.66 Favored 'General case' 0 N--CA 1.429 -1.48 0 C-N-CA 124.989 1.316 . . . . 1.0 114.128 164.963 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 94.99 -8.49 70.25 Favored Glycine 0 N--CA 1.431 -1.694 0 O-C-N 119.962 -1.711 . . . . 1.0 113.925 169.219 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 1.5 m -80.71 -170.33 2.59 Favored 'General case' 0 N--CA 1.43 -1.45 0 C-N-CA 126.626 1.971 . . . . 1.0 113.001 -171.635 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 44.7 pttt -168.6 126.49 1.07 Allowed 'General case' 0 N--CA 1.43 -1.439 0 O-C-N 119.922 -1.736 . . . . 1.0 114.497 -162.819 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 5.9 mm -100.23 107.41 20.92 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.45 0 N-CA-C 106.737 -1.579 . . . . 1.0 106.737 166.298 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 4.5 tp -106.18 117.6 52.24 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.506 0 O-C-N 120.036 -1.665 . . . . 1.0 110.886 -173.942 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 3.7 mt -128.55 131.65 68.58 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.408 0 C-N-CA 125.864 1.666 . . . . 1.0 109.943 -171.444 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 16.8 t30 -161.26 175.03 12.74 Favored 'General case' 0 N--CA 1.432 -1.374 0 N-CA-C 104.628 -2.36 . . . . 1.0 104.628 -172.267 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 60.7 ttp85 -151.22 138.4 19.27 Favored 'General case' 0 N--CA 1.43 -1.46 0 O-C-N 120.033 -1.667 . . . . 1.0 108.238 -162.27 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 1.6 tt0 -149.03 -45.35 0.14 Allowed 'General case' 0 CA--C 1.489 -1.394 0 O-C-N 121.154 -0.966 . . . . 1.0 109.339 -168.647 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 55.5 mt-10 -76.05 147.77 80.64 Favored Pre-proline 0 N--CA 1.43 -1.468 0 N-CA-C 114.277 1.214 . . . . 1.0 114.277 -164.553 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 47.8 Cg_endo -77.6 -174.61 2.29 Favored 'Trans proline' 0 C--N 1.299 -2.06 0 C-N-CA 122.811 2.341 . . . . 1.0 111.478 166.221 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 57' ' ' LEU . . . . . 0.505 ' O ' ' CD2' ' A' ' 58' ' ' HIS . 22.8 mt 79.34 -48.66 0.4 Allowed 'General case' 0 N--CA 1.431 -1.402 0 C-N-CA 128.89 2.876 . . . . 1.0 112.122 178.305 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 58' ' ' HIS . . . . . 0.505 ' CD2' ' O ' ' A' ' 57' ' ' LEU . 20.8 m170 143.82 88.33 0.0 OUTLIER 'General case' 0 N--CA 1.43 -1.452 1 C-N-CA 132.382 4.273 . . . . 1.0 108.014 172.382 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 8.1 tt0 -154.25 145.27 22.7 Favored 'General case' 0 N--CA 1.43 -1.458 0 CA-C-N 123.06 2.664 . . . . 1.0 111.922 168.302 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 2.2 t -127.93 160.16 37.97 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.466 0 C-N-CA 127.478 2.311 . . . . 1.0 111.723 -175.395 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 61' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -109.48 152.44 25.41 Favored 'General case' 0 N--CA 1.431 -1.424 0 C-N-CA 124.564 1.146 . . . . 1.0 110.987 177.222 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 2.3 pt? -154.24 124.08 6.73 Favored 'General case' 0 N--CA 1.43 -1.45 0 CA-C-O 122.655 1.216 . . . . 1.0 109.935 168.781 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -124.24 130.48 52.59 Favored 'General case' 0 N--CA 1.429 -1.487 0 N-CA-C 115.042 1.497 . . . . 1.0 115.042 -178.813 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 64' ' ' THR . . . . . . . . . . . . . 8.6 m -123.97 -102.44 0.38 Allowed 'General case' 0 N--CA 1.432 -1.352 0 C-N-CA 124.467 1.107 . . . . 1.0 110.983 177.553 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 9.1 tmtm? -125.92 -40.63 2.01 Favored 'General case' 0 N--CA 1.429 -1.483 0 O-C-N 120.369 -1.457 . . . . 1.0 111.814 -163.648 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 5.2 tm0? -79.42 -23.96 42.84 Favored 'General case' 0 N--CA 1.428 -1.537 0 O-C-N 120.662 -1.274 . . . . 1.0 112.576 -172.872 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . -176.18 -62.58 0.06 OUTLIER Glycine 0 N--CA 1.43 -1.761 0 O-C-N 120.36 -1.462 . . . . 1.0 112.501 171.229 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 107.61 109.59 3.37 Favored Glycine 0 N--CA 1.43 -1.703 0 C-N-CA 124.894 1.235 . . . . 1.0 110.732 -171.322 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 23.1 m-85 -121.64 170.83 9.33 Favored 'General case' 0 N--CA 1.431 -1.404 0 C-N-CA 125.027 1.331 . . . . 1.0 108.665 -169.096 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 70' ' ' HIS . . . . . 0.402 ' HE1' ' OD2' ' A' ' 81' ' ' ASP . 5.6 p80 -115.85 161.08 19.29 Favored 'General case' 0 N--CA 1.43 -1.463 0 O-C-N 120.278 -1.514 . . . . 1.0 110.025 171.606 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 71' ' ' PHE . . . . . . . . . . . . 0.273 65.6 t80 -135.27 120.77 19.27 Favored 'General case' 0 N--CA 1.43 -1.431 0 C-N-CA 124.721 1.208 . . . . 1.0 109.829 -144.418 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 51.4 t0 -139.54 165.82 26.23 Favored 'General case' 0 N--CA 1.43 -1.436 0 CA-C-O 121.884 0.85 . . . . 1.0 110.424 -176.96 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 55.9 tp -103.03 121.59 42.88 Favored 'General case' 0 N--CA 1.43 -1.435 0 O-C-N 120.268 -1.52 . . . . 1.0 113.209 -167.48 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 29.6 mmtm -112.65 84.98 2.07 Favored 'General case' 0 N--CA 1.43 -1.439 0 O-C-N 120.9 -1.125 . . . . 1.0 109.305 170.926 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . 73.38 -95.52 0.77 Allowed Glycine 0 N--CA 1.43 -1.736 0 O-C-N 120.573 -1.33 . . . . 1.0 114.823 174.365 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 55.9 m-20 -104.31 -3.83 23.71 Favored 'General case' 0 N--CA 1.43 -1.425 0 C-N-CA 125.645 1.578 . . . . 1.0 112.975 -176.639 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 33.3 tt0 -150.24 132.39 15.37 Favored 'General case' 0 N--CA 1.429 -1.501 0 N-CA-C 106.317 -1.734 . . . . 1.0 106.317 -169.59 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 78' ' ' TRP . . . . . . . . . . . . . 33.7 m95 -79.93 127.29 32.08 Favored 'General case' 0 N--CA 1.43 -1.441 0 O-C-N 120.666 -1.271 . . . . 1.0 108.878 177.224 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 9.5 mt -103.14 135.86 38.56 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.513 0 C-N-CA 125.766 1.626 . . . . 1.0 107.016 177.565 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -81.39 134.63 35.58 Favored 'General case' 0 N--CA 1.43 -1.456 0 O-C-N 121.009 -1.057 . . . . 1.0 109.168 178.36 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 81' ' ' ASP . . . . . 0.402 ' OD2' ' HE1' ' A' ' 70' ' ' HIS . 25.7 t70 -77.6 -20.74 53.47 Favored 'General case' 0 N--CA 1.431 -1.411 0 N-CA-C 115.359 1.615 . . . . 1.0 115.359 -162.684 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 4.3 mmp_? -82.71 -90.03 0.08 Allowed 'General case' 0 N--CA 1.43 -1.432 0 O-C-N 120.349 -1.469 . . . . 1.0 113.462 -174.868 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 31.7 p -72.06 -29.64 64.35 Favored 'General case' 0 N--CA 1.431 -1.39 0 O-C-N 120.069 -1.644 . . . . 1.0 114.16 -176.854 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 106.24 83.37 1.62 Allowed Glycine 0 N--CA 1.43 -1.747 0 N-CA-C 109.716 -1.354 . . . . 1.0 109.716 -171.851 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 5.0 mm-40 -140.66 -172.27 3.41 Favored 'General case' 0 N--CA 1.431 -1.422 0 N-CA-C 105.693 -1.966 . . . . 1.0 105.693 -170.854 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 30.1 m -145.84 131.99 19.4 Favored 'General case' 0 N--CA 1.43 -1.444 0 O-C-N 120.578 -1.326 . . . . 1.0 111.435 -155.077 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 1.1 t80 -21.83 -97.08 0.0 OUTLIER 'General case' 0 N--CA 1.43 -1.433 0 N-CA-C 120.418 3.488 . . . . 1.0 120.418 175.523 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 88' ' ' TRP . . . . . . . . . . . . . 29.9 m95 -71.69 -26.83 62.67 Favored 'General case' 0 N--CA 1.431 -1.419 0 O-C-N 120.247 -1.533 . . . . 1.0 110.889 -167.445 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 16.2 m-20 -79.25 -42.21 26.41 Favored 'General case' 0 N--CA 1.43 -1.456 0 C-N-CA 126.432 1.893 . . . . 1.0 112.747 -176.879 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -70.3 -39.94 74.55 Favored 'General case' 0 N--CA 1.43 -1.452 0 O-C-N 119.716 -1.865 . . . . 1.0 111.54 176.007 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 41.0 tp -53.74 -47.28 70.78 Favored 'General case' 0 N--CA 1.429 -1.484 0 C-N-CA 126.252 1.821 . . . . 1.0 113.589 170.345 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 30.2 tt0 -56.73 -56.19 24.68 Favored 'General case' 0 N--CA 1.43 -1.448 0 C-N-CA 125.08 1.352 . . . . 1.0 113.917 169.832 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 38.6 mt-30 -55.34 -42.91 74.48 Favored 'General case' 0 N--CA 1.43 -1.442 0 C-N-CA 125.168 1.387 . . . . 1.0 113.678 179.248 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -59.21 -55.34 36.2 Favored 'General case' 0 N--CA 1.428 -1.526 0 C-N-CA 127.055 2.142 . . . . 1.0 114.395 173.538 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -65.68 -40.64 92.58 Favored 'General case' 0 N--CA 1.429 -1.498 0 O-C-N 120.222 -1.549 . . . . 1.0 113.314 -179.377 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 31.8 m -56.23 -45.81 79.81 Favored 'General case' 0 N--CA 1.43 -1.426 0 C-N-CA 125.215 1.406 . . . . 1.0 114.335 168.257 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 9.0 pt20 -71.8 -22.27 61.59 Favored 'General case' 0 N--CA 1.431 -1.397 0 O-C-N 120.589 -1.319 . . . . 1.0 114.129 -178.465 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 2.4 mm-40 -72.79 -57.64 3.94 Favored 'General case' 0 N--CA 1.431 -1.381 0 O-C-N 121.441 -0.787 . . . . 1.0 112.83 166.549 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -77.09 -41.95 40.13 Favored 'General case' 0 N--CA 1.43 -1.461 0 N-CA-C 117.089 2.255 . . . . 1.0 117.089 -170.563 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . 83.99 43.27 7.22 Favored Glycine 0 N--CA 1.43 -1.704 0 O-C-N 120.86 -1.15 . . . . 1.0 111.907 -165.868 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 4.9 tp10 -161.28 154.53 21.36 Favored 'General case' 0 N--CA 1.431 -1.419 0 N-CA-C 107.409 -1.33 . . . . 1.0 107.409 -169.69 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 93.2 m -78.47 93.68 4.8 Favored 'General case' 0 N--CA 1.43 -1.449 0 O-C-N 118.953 -2.342 . . . . 1.0 110.594 168.821 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 47.9 t -105.48 90.29 1.53 Allowed 'Isoleucine or valine' 0 N--CA 1.43 -1.437 0 C-N-CA 125.844 1.658 . . . . 1.0 106.931 -179.398 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 59.5 p -143.07 178.23 7.83 Favored 'General case' 0 N--CA 1.43 -1.444 0 O-C-N 120.709 -1.245 . . . . 1.0 113.754 -172.678 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -108.93 -40.41 5.03 Favored 'General case' 0 N--CA 1.43 -1.452 0 O-C-N 120.633 -1.292 . . . . 1.0 110.646 177.577 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 24.9 ttp180 . . . . . 0 C--O 1.259 1.581 0 O-C-N 120.766 -1.209 . . . . 1.0 111.824 -165.549 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 4.3 p30 . . . . . 0 N--CA 1.43 -1.435 0 CA-C-O 121.296 0.57 . . . . 1.0 110.145 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 1.1 p-10 -66.58 -30.49 70.8 Favored 'General case' 0 N--CA 1.43 -1.447 0 N-CA-C 114.978 1.473 . . . . 1.0 114.978 -176.67 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 8.5 t -63.52 -54.3 38.45 Favored 'General case' 0 N--CA 1.43 -1.47 0 O-C-N 120.492 -1.38 . . . . 1.0 113.368 174.019 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 53.9 mt-10 -63.38 -42.2 98.81 Favored 'General case' 0 N--CA 1.431 -1.385 0 O-C-N 120.615 -1.303 . . . . 1.0 113.624 176.625 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 6' ' ' PHE . . . . . 0.405 ' CD1' ' HA ' ' A' ' 58' ' ' HIS . 11.6 t80 -44.89 -55.37 5.5 Favored 'General case' 0 N--CA 1.429 -1.479 0 C-N-CA 125.666 1.586 . . . . 1.0 114.5 167.309 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 0.7 OUTLIER -70.08 -30.41 67.63 Favored 'General case' 0 N--CA 1.431 -1.402 0 N-CA-C 114.514 1.302 . . . . 1.0 114.514 -179.61 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 31.1 ttt85 -68.88 -48.78 62.55 Favored 'General case' 0 N--CA 1.43 -1.45 0 C-N-CA 125.816 1.646 . . . . 1.0 113.182 179.152 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 92.1 mt -64.7 -36.77 85.36 Favored 'General case' 0 N--CA 1.429 -1.516 0 C-N-CA 126.193 1.797 . . . . 1.0 112.366 173.589 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -57.78 -47.44 82.53 Favored 'General case' 0 N--CA 1.43 -1.464 0 C-N-CA 124.293 1.037 . . . . 1.0 113.107 171.914 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -56.57 -43.95 80.52 Favored 'General case' 0 N--CA 1.429 -1.522 0 C-N-CA 126.703 2.001 . . . . 1.0 113.4 175.131 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 19.1 mm-40 -54.99 -63.25 1.21 Allowed 'General case' 0 N--CA 1.431 -1.401 0 C-N-CA 124.879 1.272 . . . . 1.0 113.524 172.855 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 3.7 pp -69.86 -39.85 76.12 Favored 'General case' 0 N--CA 1.43 -1.435 0 O-C-N 120.23 -1.543 . . . . 1.0 114.969 -173.621 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 9.3 m0 -55.02 -48.66 73.07 Favored 'General case' 0 N--CA 1.43 -1.428 0 N-CA-C 114.179 1.178 . . . . 1.0 114.179 172.032 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 41.1 tp -63.71 -39.41 94.24 Favored 'General case' 0 N--CA 1.43 -1.442 0 N-CA-C 113.05 0.759 . . . . 1.0 113.05 175.876 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 25.6 m -52.36 -50.81 61.61 Favored 'General case' 0 N--CA 1.429 -1.497 0 C-N-CA 125.377 1.471 . . . . 1.0 114.709 172.921 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 20.6 mt -66.71 -48.61 79.57 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.483 0 O-C-N 120.174 -1.579 . . . . 1.0 112.206 178.078 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 41.1 tt0 -53.85 -54.56 36.82 Favored 'General case' 0 N--CA 1.43 -1.461 0 C-N-CA 124.638 1.175 . . . . 1.0 112.294 178.114 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 33.9 tt0 -58.32 -49.71 76.23 Favored 'General case' 0 N--CA 1.431 -1.403 0 C-N-CA 126.45 1.9 . . . . 1.0 114.241 178.414 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 8.7 tpm_? -60.49 -44.76 95.61 Favored 'General case' 0 N--CA 1.43 -1.469 0 CA-C-N 119.817 1.19 . . . . 1.0 112.913 -178.964 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 98.1 mt -72.29 -41.14 66.97 Favored 'General case' 0 N--CA 1.43 -1.443 0 N-CA-C 114.594 1.331 . . . . 1.0 114.594 175.769 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 38.0 t70 -59.48 -36.75 76.63 Favored 'General case' 0 N--CA 1.429 -1.483 0 O-C-N 119.365 -2.084 . . . . 1.0 113.566 174.967 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 24.6 t0 -105.17 33.83 3.49 Favored 'General case' 0 N--CA 1.43 -1.475 0 O-C-N 120.181 -1.575 . . . . 1.0 111.261 174.225 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 24' ' ' TRP . . . . . . . . . . . . . 22.6 t-105 -83.41 -61.76 1.76 Allowed 'General case' 0 N--CA 1.429 -1.494 0 O-C-N 119.872 -1.768 . . . . 1.0 109.896 168.515 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 28.1 t70 70.07 -111.66 0.08 Allowed 'General case' 0 N--CA 1.43 -1.438 0 C-N-CA 125.051 1.34 . . . . 1.0 111.501 174.344 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 76.35 -115.7 4.51 Favored Glycine 0 N--CA 1.43 -1.761 0 O-C-N 120.025 -1.672 . . . . 1.0 114.147 172.921 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -101.89 -19.45 15.27 Favored 'General case' 0 N--CA 1.431 -1.419 0 C-N-CA 124.962 1.305 . . . . 1.0 109.788 172.159 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 54.0 p -80.71 173.63 12.41 Favored 'General case' 0 N--CA 1.429 -1.476 0 N-CA-C 115.949 1.833 . . . . 1.0 115.949 -170.262 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 4.7 t70 -130.53 150.77 51.59 Favored 'General case' 0 N--CA 1.431 -1.416 0 N-CA-C 106.31 -1.737 . . . . 1.0 106.31 161.952 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER -155.16 114.27 0.32 Allowed 'Isoleucine or valine' 0 N--CA 1.431 -1.404 0 C-N-CA 125.047 1.339 . . . . 1.0 108.45 -159.923 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 21.1 m-20 -120.35 107.2 12.65 Favored 'General case' 0 N--CA 1.43 -1.441 0 C-N-CA 125.39 1.476 . . . . 1.0 110.645 174.12 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 27.6 t -86.34 136.22 33.22 Favored 'General case' 0 N--CA 1.431 -1.382 0 O-C-N 119.762 -1.836 . . . . 1.0 109.85 165.904 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 79.1 mt-10 -112.22 135.53 52.78 Favored 'General case' 0 N--CA 1.429 -1.478 0 O-C-N 120.904 -1.122 . . . . 1.0 109.342 179.292 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 3.2 tp -111.03 105.48 18.89 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.419 0 CA-C-O 125.1 2.381 . . . . 1.0 107.766 176.297 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 76.6 m-20 -115.63 74.68 0.9 Allowed 'General case' 0 N--CA 1.431 -1.408 0 CA-C-N 113.102 -1.863 . . . . 1.0 109.11 -179.382 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . 76.34 -92.16 0.96 Allowed Glycine 0 N--CA 1.43 -1.733 0 O-C-N 120.663 -1.273 . . . . 1.0 114.588 174.42 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -120.75 20.51 8.7 Favored Glycine 0 N--CA 1.431 -1.695 0 C-N-CA 124.308 0.956 . . . . 1.0 111.054 174.156 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 40.8 t -121.43 123.96 70.8 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.459 0 N-CA-C 107.543 -1.28 . . . . 1.0 107.543 178.257 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 12.6 mt -111.93 130.1 55.96 Favored 'General case' 0 N--CA 1.43 -1.448 0 CA-C-O 122.865 1.317 . . . . 1.0 107.973 167.308 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 17.9 p -126.33 125.8 42.86 Favored 'General case' 0 N--CA 1.431 -1.425 0 N-CA-C 107.387 -1.338 . . . . 1.0 107.387 177.868 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 22.8 mt -106.11 122.77 60.21 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.416 0 N-CA-C 108.846 -0.798 . . . . 1.0 108.846 -177.166 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 39.6 p -116.69 128.21 55.13 Favored 'General case' 0 N--CA 1.43 -1.449 0 CA-C-O 121.177 0.513 . . . . 1.0 112.055 -173.229 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 43' ' ' PHE . . . . . . . . . . . . . 26.1 p90 -119.66 171.85 8.09 Favored 'General case' 0 N--CA 1.431 -1.415 0 C-N-CA 124.447 1.099 . . . . 1.0 111.333 175.504 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 37.3 mm-40 -51.21 -30.88 18.57 Favored 'General case' 0 N--CA 1.43 -1.431 0 N-CA-C 118.88 2.918 . . . . 1.0 118.88 -173.154 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 6.6 m120 -66.95 -17.88 65.12 Favored 'General case' 0 N--CA 1.431 -1.424 0 O-C-N 119.761 -1.837 . . . . 1.0 114.0 179.007 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 86.95 -0.26 86.14 Favored Glycine 0 N--CA 1.429 -1.776 0 O-C-N 120.505 -1.372 . . . . 1.0 113.463 179.449 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 48.2 m -88.48 158.08 18.45 Favored 'General case' 0 N--CA 1.429 -1.502 0 C-N-CA 125.428 1.491 . . . . 1.0 107.66 167.702 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 6.8 ptpt -154.76 159.58 40.74 Favored 'General case' 0 N--CA 1.43 -1.431 0 O-C-N 120.933 -1.104 . . . . 1.0 112.878 -167.294 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 8.9 mm -100.37 137.64 27.23 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.477 0 N-CA-C 106.587 -1.635 . . . . 1.0 106.587 177.107 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 50' ' ' ILE . . . . . 0.434 ' HB ' ' HB1' ' A' ' 63' ' ' ALA . 4.7 mm -126.21 116.7 46.44 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.472 0 C-N-CA 124.518 1.127 . . . . 1.0 109.692 -178.516 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 3.3 mt -128.47 128.11 67.78 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.428 0 CA-C-O 122.424 1.107 . . . . 1.0 112.378 -179.629 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 52' ' ' ASN . . . . . 0.481 ' H ' ' HD1' ' A' ' 61' ' ' TRP . 20.4 t-20 -151.35 162.47 40.87 Favored 'General case' 0 N--CA 1.43 -1.471 0 C-N-CA 126.452 1.901 . . . . 1.0 105.995 174.379 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -129.09 145.87 51.18 Favored 'General case' 0 N--CA 1.43 -1.432 0 C-N-CA 125.829 1.651 . . . . 1.0 109.897 -174.498 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 2.2 tt0 -151.25 -38.9 0.12 Allowed 'General case' 0 N--CA 1.431 -1.419 0 O-C-N 120.878 -1.139 . . . . 1.0 111.323 -168.993 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 28.8 mm-40 -70.99 156.55 91.9 Favored Pre-proline 0 N--CA 1.43 -1.47 0 N-CA-C 114.417 1.265 . . . . 1.0 114.417 -168.83 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 39.1 Cg_endo -75.88 -25.86 10.13 Favored 'Trans proline' 0 C--N 1.3 -1.987 0 C-N-CA 121.916 1.744 . . . . 1.0 114.126 -165.626 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 49.4 mt -93.51 -112.87 0.1 Allowed 'General case' 0 N--CA 1.429 -1.496 0 CA-C-O 122.726 1.251 . . . . 1.0 111.018 -173.804 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 58' ' ' HIS . . . . . 0.405 ' HA ' ' CD1' ' A' ' 6' ' ' PHE . 39.3 m170 -125.85 70.1 1.2 Allowed 'General case' 0 N--CA 1.431 -1.394 0 C-N-CA 124.619 1.168 . . . . 1.0 109.171 174.827 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 9.6 mt-30 -141.06 125.44 17.59 Favored 'General case' 0 N--CA 1.431 -1.42 0 O-C-N 120.362 -1.461 . . . . 1.0 109.93 -175.683 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 88.6 t -124.32 156.41 32.0 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.509 0 O-C-N 120.942 -1.099 . . . . 1.0 108.825 -174.77 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 61' ' ' TRP . . . . . 0.481 ' HD1' ' H ' ' A' ' 52' ' ' ASN . 0.0 OUTLIER -92.6 152.22 19.7 Favored 'General case' 0 N--CA 1.43 -1.426 0 O-C-N 120.142 -1.599 . . . . 1.0 110.553 -178.201 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 2.2 tm? -137.27 98.26 3.68 Favored 'General case' 0 N--CA 1.429 -1.5 0 O-C-N 120.41 -1.432 . . . . 1.0 110.465 176.107 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . 0.434 ' HB1' ' HB ' ' A' ' 50' ' ' ILE . . . -103.95 139.61 38.86 Favored 'General case' 0 N--CA 1.431 -1.422 0 CA-C-O 123.314 1.531 . . . . 1.0 111.812 172.378 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 64' ' ' THR . . . . . 0.446 HG21 ' H ' ' A' ' 65' ' ' LYS . 0.0 OUTLIER -153.98 -80.16 0.09 Allowed 'General case' 0 N--CA 1.43 -1.436 0 C-N-CA 126.301 1.84 . . . . 1.0 107.066 -174.304 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 65' ' ' LYS . . . . . 0.446 ' H ' HG21 ' A' ' 64' ' ' THR . 3.6 tmtt? -116.65 -53.74 2.49 Favored 'General case' 0 N--CA 1.429 -1.494 0 C-N-CA 125.182 1.393 . . . . 1.0 113.376 176.831 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 50.7 mt-30 -72.43 -24.35 61.21 Favored 'General case' 0 N--CA 1.429 -1.499 0 N-CA-C 117.99 2.589 . . . . 1.0 117.99 -160.803 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 151.49 -9.93 0.7 Allowed Glycine 0 N--CA 1.43 -1.711 0 N-CA-C 116.714 1.446 . . . . 1.0 116.714 174.593 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 98.85 77.01 1.29 Allowed Glycine 0 N--CA 1.43 -1.731 0 CA-C-N 118.902 1.351 . . . . 1.0 110.77 -176.066 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 14.5 m-30 -102.22 122.14 43.61 Favored 'General case' 0 N--CA 1.43 -1.468 0 C-N-CA 124.345 1.058 . . . . 1.0 108.547 -175.589 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -86.5 157.25 19.82 Favored 'General case' 0 N--CA 1.431 -1.411 0 O-C-N 119.974 -1.704 . . . . 1.0 114.288 -179.271 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 49.6 p90 -129.37 138.45 51.53 Favored 'General case' 0 N--CA 1.429 -1.499 0 N-CA-C 113.296 0.85 . . . . 1.0 113.296 -165.558 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 23.5 t0 -126.99 159.54 33.77 Favored 'General case' 0 N--CA 1.43 -1.443 0 C-N-CA 126.34 1.856 . . . . 1.0 110.183 -176.779 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 7.0 tt -91.78 122.44 34.33 Favored 'General case' 0 N--CA 1.429 -1.495 0 O-C-N 120.471 -1.393 . . . . 1.0 112.664 -170.764 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 28.9 tptp -83.56 -56.59 3.65 Favored 'General case' 0 N--CA 1.43 -1.47 0 O-C-N 120.441 -1.412 . . . . 1.0 110.782 167.826 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -170.84 -79.65 0.05 OUTLIER Glycine 0 CA--C 1.487 -1.663 0 O-C-N 120.91 -1.119 . . . . 1.0 111.411 -179.805 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 7.6 m-20 -93.79 5.59 51.15 Favored 'General case' 0 N--CA 1.43 -1.451 0 C-N-CA 124.936 1.294 . . . . 1.0 111.139 178.93 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 7.7 pt-20 -165.59 145.33 6.57 Favored 'General case' 0 N--CA 1.431 -1.414 0 N-CA-C 104.383 -2.451 . . . . 1.0 104.383 -153.716 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 78' ' ' TRP . . . . . . . . . . . . . 27.4 m95 -111.79 139.1 47.54 Favored 'General case' 0 N--CA 1.431 -1.39 0 N-CA-C 107.633 -1.247 . . . . 1.0 107.633 178.254 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 40.4 mt -96.32 135.73 29.48 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.483 0 C-N-CA 127.247 2.219 . . . . 1.0 107.977 -179.379 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 75.8 m -82.5 122.19 27.73 Favored 'General case' 0 N--CA 1.431 -1.41 0 N-CA-C 108.154 -1.054 . . . . 1.0 108.154 171.684 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 16.3 t70 -66.68 -47.87 71.1 Favored 'General case' 0 N--CA 1.429 -1.485 0 N-CA-C 114.224 1.194 . . . . 1.0 114.224 -167.227 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 17.1 mmt180 -72.25 129.24 37.97 Favored 'General case' 0 N--CA 1.43 -1.455 0 O-C-N 120.899 -1.126 . . . . 1.0 109.55 177.804 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 83' ' ' SER . . . . . . . . . . . . 0.27 5.6 t 76.45 -47.64 0.55 Allowed 'General case' 0 N--CA 1.428 -1.532 0 C-N-CA 126.869 2.068 . . . . 1.0 114.124 -168.473 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 99.33 70.91 0.97 Allowed Glycine 0 N--CA 1.429 -1.773 0 O-C-N 120.69 -1.256 . . . . 1.0 111.024 176.68 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 5.5 mm-40 -128.97 -131.89 0.22 Allowed 'General case' 0 N--CA 1.431 -1.418 0 C-N-CA 124.156 0.983 . . . . 1.0 110.752 -166.35 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 93.9 m -153.76 133.61 13.1 Favored 'General case' 0 N--CA 1.431 -1.383 0 O-C-N 120.551 -1.343 . . . . 1.0 109.46 -157.34 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . 0.309 0.0 OUTLIER -49.3 -83.11 0.01 OUTLIER 'General case' 0 N--CA 1.43 -1.446 0 N-CA-C 119.939 3.311 . . . . 1.0 119.939 -175.911 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 88' ' ' TRP . . . . . . . . . . . . . 7.9 m95 -65.83 -34.37 78.01 Favored 'General case' 0 N--CA 1.43 -1.443 0 O-C-N 119.84 -1.788 . . . . 1.0 113.367 -175.106 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -61.64 -41.97 98.25 Favored 'General case' 0 N--CA 1.431 -1.408 0 N-CA-C 114.409 1.263 . . . . 1.0 114.409 176.148 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 17.9 tp -67.82 -48.93 64.86 Favored 'General case' 0 N--CA 1.43 -1.454 0 O-C-N 120.647 -1.283 . . . . 1.0 111.054 175.808 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 58.0 tp -51.96 -46.33 64.76 Favored 'General case' 0 N--CA 1.429 -1.492 0 C-N-CA 126.268 1.827 . . . . 1.0 113.752 174.017 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 18.6 tt0 -53.32 -54.39 37.17 Favored 'General case' 0 N--CA 1.429 -1.501 0 C-N-CA 125.983 1.713 . . . . 1.0 111.873 171.639 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -59.23 -53.25 60.4 Favored 'General case' 0 N--CA 1.43 -1.429 0 N-CA-C 113.418 0.896 . . . . 1.0 113.418 -178.188 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -59.7 -43.92 93.88 Favored 'General case' 0 N--CA 1.43 -1.436 0 C-N-CA 125.841 1.656 . . . . 1.0 115.381 178.455 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -71.31 -40.31 70.87 Favored 'General case' 0 N--CA 1.429 -1.517 0 O-C-N 120.497 -1.377 . . . . 1.0 112.988 178.53 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 95.1 m -63.65 -37.02 85.76 Favored 'General case' 0 N--CA 1.43 -1.44 0 C-N-CA 126.415 1.886 . . . . 1.0 112.06 174.304 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -57.35 -54.54 45.67 Favored 'General case' 0 CA--C 1.489 -1.395 0 C-N-CA 127.108 2.163 . . . . 1.0 112.205 173.382 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 2.3 pt20 -73.57 -33.73 64.79 Favored 'General case' 0 N--CA 1.43 -1.454 0 N-CA-C 115.217 1.562 . . . . 1.0 115.217 179.165 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -75.36 -41.24 56.94 Favored 'General case' 0 N--CA 1.43 -1.47 0 O-C-N 120.111 -1.618 . . . . 1.0 115.206 177.863 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . 85.87 24.41 41.84 Favored Glycine 0 N--CA 1.429 -1.791 0 C-N-CA 124.692 1.139 . . . . 1.0 112.763 -175.198 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 9.3 pt-20 -175.44 159.19 2.39 Favored 'General case' 0 N--CA 1.43 -1.462 0 C-N-CA 126.495 1.918 . . . . 1.0 106.117 -176.24 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 44.0 m -69.79 130.77 43.22 Favored 'General case' 0 N--CA 1.43 -1.456 0 O-C-N 120.792 -1.193 . . . . 1.0 113.271 -169.041 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 69.3 t -102.1 120.96 52.52 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.416 0 N-CA-C 107.771 -1.196 . . . . 1.0 107.771 173.768 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 19.7 m -107.03 141.94 37.46 Favored 'General case' 0 N--CA 1.429 -1.493 0 N-CA-C 115.103 1.52 . . . . 1.0 115.103 -160.285 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 2.6 p90 -127.28 -43.36 1.63 Allowed 'General case' 0 N--CA 1.43 -1.467 0 C-N-CA 125.509 1.524 . . . . 1.0 110.783 179.191 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 30.2 mtt-85 . . . . . 0 C--O 1.261 1.671 0 C-N-CA 124.465 1.106 . . . . 1.0 111.05 -179.907 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 26.5 mmt . . . . . 0 CA--C 1.49 -1.361 0 CA-C-O 121.369 0.604 . . . . 1.0 110.964 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 7.1 p30 -93.27 -51.21 5.11 Favored 'General case' 0 N--CA 1.43 -1.458 0 O-C-N 120.185 -1.572 . . . . 1.0 113.842 -170.172 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 35.3 t70 -55.92 -40.08 72.59 Favored 'General case' 0 N--CA 1.429 -1.479 0 C-N-CA 127.125 2.17 . . . . 1.0 113.46 -178.543 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 5.2 p -68.49 -37.94 80.55 Favored 'General case' 0 N--CA 1.43 -1.467 0 C-N-CA 126.274 1.83 . . . . 1.0 114.359 174.972 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 14.2 tp10 -67.74 -53.06 30.44 Favored 'General case' 0 N--CA 1.43 -1.435 0 C-N-CA 125.226 1.41 . . . . 1.0 110.115 177.925 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 16.3 t80 -47.25 -50.94 20.17 Favored 'General case' 0 N--CA 1.431 -1.425 0 C-N-CA 127.425 2.29 . . . . 1.0 114.821 169.657 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 35.2 m-70 -63.97 -41.43 97.56 Favored 'General case' 0 N--CA 1.43 -1.452 0 N-CA-C 114.907 1.447 . . . . 1.0 114.907 177.989 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -70.76 -37.19 73.38 Favored 'General case' 0 N--CA 1.43 -1.435 0 O-C-N 120.366 -1.459 . . . . 1.0 114.074 178.887 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 79.7 mt -59.58 -51.55 69.37 Favored 'General case' 0 N--CA 1.43 -1.444 0 C-N-CA 124.99 1.316 . . . . 1.0 111.747 168.239 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -54.06 -50.34 66.95 Favored 'General case' 0 N--CA 1.431 -1.416 0 C-N-CA 125.011 1.324 . . . . 1.0 113.458 176.991 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -51.58 -49.71 61.57 Favored 'General case' 0 N--CA 1.43 -1.425 0 N-CA-C 114.783 1.401 . . . . 1.0 114.783 173.136 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 12.2 pt20 -68.9 -33.27 73.49 Favored 'General case' 0 N--CA 1.43 -1.433 0 N-CA-C 115.583 1.697 . . . . 1.0 115.583 179.764 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 84.8 mt -66.74 -59.07 3.89 Favored 'General case' 0 N--CA 1.431 -1.419 0 O-C-N 120.087 -1.633 . . . . 1.0 111.02 174.753 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 1.2 m-90 -50.3 -50.11 51.58 Favored 'General case' 0 N--CA 1.429 -1.487 0 C-N-CA 125.65 1.58 . . . . 1.0 113.27 -179.565 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 41.0 tp -61.85 -59.05 5.71 Favored 'General case' 0 N--CA 1.43 -1.447 0 N-CA-C 113.626 0.973 . . . . 1.0 113.626 175.775 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 59.6 m -64.88 -37.42 87.58 Favored 'General case' 0 N--CA 1.431 -1.4 0 N-CA-C 114.252 1.204 . . . . 1.0 114.252 -173.621 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 93.5 mt -64.63 -54.24 32.7 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.458 0 C-N-CA 124.923 1.289 . . . . 1.0 111.686 174.83 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 1.7 tt0 -55.48 -49.66 71.94 Favored 'General case' 0 N--CA 1.43 -1.473 0 C-N-CA 123.984 0.914 . . . . 1.0 113.386 178.565 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 44.4 tt0 -54.65 -49.1 71.38 Favored 'General case' 0 N--CA 1.429 -1.493 0 C-N-CA 125.966 1.706 . . . . 1.0 114.025 174.173 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 7.4 tpm_? -58.95 -45.92 89.29 Favored 'General case' 0 N--CA 1.431 -1.406 0 O-C-N 120.726 -1.234 . . . . 1.0 114.291 179.818 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 3.8 pp -83.51 -26.97 29.71 Favored 'General case' 0 N--CA 1.431 -1.384 0 N-CA-C 115.097 1.517 . . . . 1.0 115.097 -177.387 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 8.7 t70 -62.71 -34.09 76.44 Favored 'General case' 0 CA--C 1.488 -1.405 0 O-C-N 120.336 -1.478 . . . . 1.0 113.342 163.591 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 19.2 t70 -70.59 -55.08 9.65 Favored 'General case' 0 N--CA 1.43 -1.472 0 C-N-CA 126.201 1.8 . . . . 1.0 114.559 178.405 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' TRP . . . . . . . . . . . . . 32.4 t-105 -73.03 138.68 46.11 Favored 'General case' 0 N--CA 1.43 -1.456 0 O-C-N 120.703 -1.248 . . . . 1.0 113.104 -172.643 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 63.3 m-20 -84.16 -141.33 0.07 Allowed 'General case' 0 N--CA 1.431 -1.408 0 O-C-N 120.327 -1.483 . . . . 1.0 112.054 177.519 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 164.3 -164.8 36.9 Favored Glycine 0 N--CA 1.431 -1.664 0 O-C-N 118.592 -2.568 . . . . 1.0 114.181 -175.221 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 37.4 t70 -86.84 -53.43 4.92 Favored 'General case' 0 N--CA 1.43 -1.463 0 C-N-CA 125.238 1.415 . . . . 1.0 107.911 169.242 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 4.5 t -82.7 -176.48 6.3 Favored 'General case' 0 N--CA 1.431 -1.414 0 C-N-CA 125.728 1.611 . . . . 1.0 109.691 178.94 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 32.9 t0 -99.85 178.63 4.76 Favored 'General case' 0 N--CA 1.43 -1.449 0 O-C-N 120.26 -1.525 . . . . 1.0 108.142 175.218 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 9.3 tp -152.26 126.58 1.41 Allowed 'Isoleucine or valine' 0 N--CA 1.43 -1.431 0 N-CA-C 106.936 -1.505 . . . . 1.0 106.936 -173.974 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 28.4 t70 -131.73 119.07 20.82 Favored 'General case' 0 N--CA 1.43 -1.439 0 CA-C-O 122.956 1.36 . . . . 1.0 109.13 163.299 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 17.3 p -86.21 131.17 34.3 Favored 'General case' 0 N--CA 1.43 -1.445 0 O-C-N 120.088 -1.632 . . . . 1.0 111.228 174.349 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 41.0 mm-40 -100.06 137.5 38.42 Favored 'General case' 0 N--CA 1.429 -1.488 0 C-N-CA 124.708 1.203 . . . . 1.0 108.916 174.651 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 3.5 tp -127.42 114.1 34.79 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.407 0 CA-C-O 124.046 1.879 . . . . 1.0 106.245 178.81 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 35' ' ' ASN . . . . . 0.419 ' HB3' ' HB ' ' A' ' 38' ' ' VAL . 1.6 t-20 -125.81 179.98 4.93 Favored 'General case' 0 N--CA 1.43 -1.427 0 C-N-CA 124.805 1.242 . . . . 1.0 107.828 176.663 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -71.36 87.36 0.41 Allowed Glycine 0 N--CA 1.431 -1.653 0 O-C-N 120.566 -1.334 . . . . 1.0 115.898 -168.657 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 82.2 23.57 56.67 Favored Glycine 0 N--CA 1.429 -1.792 0 C-N-CA 125.379 1.466 . . . . 1.0 112.526 -171.889 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . 0.419 ' HB ' ' HB3' ' A' ' 35' ' ' ASN . 61.8 t -138.84 135.05 42.92 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.475 0 CA-C-N 118.307 1.053 . . . . 1.0 109.109 -173.253 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 31.1 mt -118.07 142.01 47.86 Favored 'General case' 0 N--CA 1.43 -1.427 0 CA-C-O 122.919 1.343 . . . . 1.0 108.799 166.273 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -138.49 111.3 7.71 Favored 'General case' 0 N--CA 1.43 -1.426 0 O-C-N 120.422 -1.424 . . . . 1.0 108.436 178.032 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 70.3 mt -96.83 105.41 17.07 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.467 0 N-CA-C 107.362 -1.347 . . . . 1.0 107.362 -165.859 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 14.0 m -118.44 131.2 56.28 Favored 'General case' 0 N--CA 1.43 -1.457 0 CA-C-N 118.896 0.771 . . . . 1.0 112.994 -163.053 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 43' ' ' PHE . . . . . . . . . . . . . 1.4 m-85 -99.56 173.68 6.61 Favored 'General case' 0 N--CA 1.43 -1.431 0 O-C-N 120.608 -1.308 . . . . 1.0 111.193 -179.381 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -71.77 -19.03 62.08 Favored 'General case' 0 N--CA 1.429 -1.481 0 O-C-N 119.219 -2.175 . . . . 1.0 113.476 -179.466 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 29.0 t-20 -67.21 -17.97 65.05 Favored 'General case' 0 N--CA 1.429 -1.502 0 C-N-CA 126.811 2.044 . . . . 1.0 113.512 170.731 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 92.34 -14.9 63.5 Favored Glycine 0 N--CA 1.43 -1.74 0 O-C-N 119.962 -1.712 . . . . 1.0 113.683 179.666 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 13.8 m -77.8 167.86 20.86 Favored 'General case' 0 N--CA 1.431 -1.425 0 O-C-N 121.082 -1.246 . . . . 1.0 111.077 172.943 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 12.9 ptpt -169.93 157.68 6.82 Favored 'General case' 0 N--CA 1.43 -1.439 0 O-C-N 121.156 -0.965 . . . . 1.0 113.07 -162.668 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 5.3 mm -101.54 137.11 30.39 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.438 0 C-N-CA 125.791 1.636 . . . . 1.0 107.389 171.823 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 16.1 mm -111.17 116.85 53.61 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.437 0 C-N-CA 125.032 1.333 . . . . 1.0 109.382 -178.013 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 3.0 mt -125.43 124.76 67.68 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.506 0 O-C-N 120.717 -1.239 . . . . 1.0 110.695 179.297 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 52' ' ' ASN . . . . . 0.413 ' H ' ' HD1' ' A' ' 61' ' ' TRP . 26.6 t30 -162.52 172.93 14.7 Favored 'General case' 0 N--CA 1.43 -1.471 0 N-CA-C 103.142 -2.91 . . . . 1.0 103.142 -172.815 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 1.9 ptm180 -139.76 150.57 44.93 Favored 'General case' 0 N--CA 1.429 -1.524 0 CA-C-O 122.546 1.165 . . . . 1.0 112.337 -158.913 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 15.8 mm-40 -107.16 -108.42 0.31 Allowed 'General case' 0 N--CA 1.43 -1.448 0 C-N-CA 124.653 1.181 . . . . 1.0 109.562 -167.173 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 33.2 mm-40 -79.23 135.75 57.6 Favored Pre-proline 0 N--CA 1.43 -1.446 0 CA-C-O 117.718 -1.134 . . . . 1.0 112.799 -172.041 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 98.5 Cg_endo -73.45 62.69 4.46 Favored 'Trans proline' 0 N--CA 1.434 -1.999 0 C-N-CA 123.277 2.651 . . . . 1.0 112.319 162.997 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . 0.404 ' O ' ' HD2' ' A' ' 58' ' ' HIS . 73.1 mt -120.32 -103.0 0.41 Allowed 'General case' 0 N--CA 1.429 -1.493 0 N-CA-C 102.841 -3.022 . . . . 1.0 102.841 164.483 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 58' ' ' HIS . . . . . 0.404 ' HD2' ' O ' ' A' ' 57' ' ' LEU . 42.0 m170 -132.47 92.02 3.01 Favored 'General case' 0 N--CA 1.429 -1.489 0 N-CA-C 106.622 -1.622 . . . . 1.0 106.622 159.412 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 22.1 tt0 -158.68 122.05 3.84 Favored 'General case' 0 N--CA 1.429 -1.516 0 CA-C-N 121.687 2.04 . . . . 1.0 114.161 173.005 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 86.4 t -133.36 157.57 42.63 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.451 0 C-N-CA 127.031 2.132 . . . . 1.0 109.437 -179.013 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 61' ' ' TRP . . . . . 0.413 ' HD1' ' H ' ' A' ' 52' ' ' ASN . 0.0 OUTLIER -111.36 156.06 22.16 Favored 'General case' 0 N--CA 1.429 -1.505 0 C-N-CA 127.867 2.467 . . . . 1.0 109.755 -174.169 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . 0.277 2.3 pt? -150.91 134.01 16.03 Favored 'General case' 0 N--CA 1.432 -1.364 0 CA-C-N 120.686 1.584 . . . . 1.0 113.916 150.939 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -120.08 147.29 45.03 Favored 'General case' 0 N--CA 1.429 -1.514 0 C-N-CA 125.367 1.467 . . . . 1.0 114.429 -179.557 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 64' ' ' THR . . . . . . . . . . . . . 12.5 t -153.96 -149.52 0.29 Allowed 'General case' 0 N--CA 1.429 -1.509 0 C-N-CA 126.745 2.018 . . . . 1.0 112.388 -172.694 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 5.6 tmtm? -63.56 -53.57 49.64 Favored 'General case' 0 N--CA 1.43 -1.456 0 C-N-CA 130.116 3.366 . . . . 1.0 114.362 -174.404 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 31.3 tt0 -82.24 2.19 33.02 Favored 'General case' 0 N--CA 1.429 -1.492 0 CA-C-O 122.581 1.181 . . . . 1.0 111.602 -177.008 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 117.5 -72.92 0.29 Allowed Glycine 0 N--CA 1.43 -1.732 0 N-CA-C 107.343 -2.303 . . . . 1.0 107.343 -177.4 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 106.06 -173.43 19.85 Favored Glycine 0 N--CA 1.43 -1.733 0 C-N-CA 124.229 0.918 . . . . 1.0 112.486 -176.382 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -162.05 169.83 20.29 Favored 'General case' 0 N--CA 1.431 -1.423 0 N-CA-C 107.284 -1.376 . . . . 1.0 107.284 -173.008 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 19.8 p80 -79.87 159.9 26.25 Favored 'General case' 0 N--CA 1.431 -1.422 0 O-C-N 119.775 -1.828 . . . . 1.0 114.653 174.504 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 71' ' ' PHE . . . . . . . . . . . . 0.3 72.3 t80 -112.21 113.77 26.2 Favored 'General case' 0 N--CA 1.431 -1.402 0 C-N-CA 127.744 2.418 . . . . 1.0 107.019 -158.565 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 5.7 m-20 -134.12 155.1 50.66 Favored 'General case' 0 N--CA 1.43 -1.459 0 CA-C-O 121.851 0.834 . . . . 1.0 110.546 -173.99 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 8.0 tt -97.37 133.53 41.84 Favored 'General case' 0 N--CA 1.431 -1.42 0 O-C-N 119.68 -1.888 . . . . 1.0 111.869 -166.677 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 53.5 tttm -101.81 -56.39 2.29 Favored 'General case' 0 N--CA 1.43 -1.471 0 O-C-N 120.823 -1.173 . . . . 1.0 109.556 174.539 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -157.03 -96.91 0.12 Allowed Glycine 0 N--CA 1.431 -1.677 0 O-C-N 121.035 -1.041 . . . . 1.0 111.346 175.863 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 27.9 m-20 -89.72 16.31 8.17 Favored 'General case' 0 N--CA 1.429 -1.479 0 O-C-N 121.047 -1.266 . . . . 1.0 111.405 179.94 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 32.9 tt0 -166.02 132.83 2.66 Favored 'General case' 0 N--CA 1.43 -1.427 0 N-CA-C 102.046 -3.316 . . . . 1.0 102.046 -161.484 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 78' ' ' TRP . . . . . . . . . . . . . 50.2 m95 -87.75 144.88 26.39 Favored 'General case' 0 N--CA 1.432 -1.37 0 N-CA-C 106.322 -1.732 . . . . 1.0 106.322 175.186 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 9.4 pt -102.35 167.54 2.33 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.485 0 N-CA-C 106.618 -1.623 . . . . 1.0 106.618 174.083 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 1.4 m -89.79 135.65 33.5 Favored 'General case' 0 N--CA 1.429 -1.484 0 O-C-N 120.195 -1.565 . . . . 1.0 107.193 155.29 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 36.8 t70 -59.94 -38.87 83.66 Favored 'General case' 0 N--CA 1.43 -1.447 0 CA-C-N 120.689 1.586 . . . . 1.0 115.069 -174.238 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -9.85 -84.34 0.0 OUTLIER 'General case' 0 N--CA 1.43 -1.467 0 C-N-CA 131.628 3.971 . . . . 1.0 118.457 176.634 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 58.8 m -111.19 -12.79 14.09 Favored 'General case' 0 CA--C 1.489 -1.371 0 O-C-N 120.485 -1.384 . . . . 1.0 109.588 158.126 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 115.85 76.41 0.63 Allowed Glycine 0 N--CA 1.43 -1.763 0 N-CA-C 108.041 -2.023 . . . . 1.0 108.041 -173.509 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 5.2 mm-40 -100.74 -136.4 0.31 Allowed 'General case' 0 N--CA 1.431 -1.419 0 N-CA-C 109.141 -0.688 . . . . 1.0 109.141 -175.583 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 95.5 m -154.2 133.95 12.94 Favored 'General case' 0 N--CA 1.43 -1.445 0 O-C-N 120.156 -1.59 . . . . 1.0 110.402 -171.317 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 1.1 t80 -38.02 -92.13 0.0 OUTLIER 'General case' 0 CA--C 1.489 -1.375 0 C-N-CA 128.432 2.693 . . . . 1.0 115.842 168.895 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 88' ' ' TRP . . . . . . . . . . . . . 50.7 m95 -63.16 -32.69 74.14 Favored 'General case' 0 N--CA 1.431 -1.419 0 C-N-CA 125.649 1.58 . . . . 1.0 113.454 -167.195 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 35.7 t70 -77.96 -42.94 31.24 Favored 'General case' 0 N--CA 1.43 -1.456 0 C-N-CA 125.088 1.355 . . . . 1.0 113.027 -175.898 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 35.0 tp -75.3 -38.9 60.08 Favored 'General case' 0 N--CA 1.43 -1.46 0 O-C-N 119.427 -2.045 . . . . 1.0 111.332 179.335 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 41.9 tp -54.78 -38.64 67.51 Favored 'General case' 0 N--CA 1.43 -1.427 0 C-N-CA 126.33 1.852 . . . . 1.0 113.626 168.106 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 3.4 tm-20 -56.85 -59.9 4.35 Favored 'General case' 0 N--CA 1.429 -1.506 0 C-N-CA 124.611 1.164 . . . . 1.0 112.043 165.875 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 35.9 mt-30 -51.92 -41.81 62.29 Favored 'General case' 0 N--CA 1.43 -1.425 0 N-CA-C 116.28 1.956 . . . . 1.0 116.28 177.394 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -59.19 -58.39 8.84 Favored 'General case' 0 N--CA 1.43 -1.473 0 C-N-CA 126.523 1.929 . . . . 1.0 113.906 172.424 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -62.77 -49.11 76.3 Favored 'General case' 0 N--CA 1.429 -1.507 0 O-C-N 120.41 -1.431 . . . . 1.0 113.446 179.783 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 66.1 m -48.18 -47.55 35.11 Favored 'General case' 0 N--CA 1.43 -1.437 0 C-N-CA 127.859 2.464 . . . . 1.0 114.913 170.501 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 6.6 pt20 -73.4 -30.93 63.59 Favored 'General case' 0 N--CA 1.43 -1.441 0 O-C-N 120.306 -1.496 . . . . 1.0 114.428 -179.222 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 49.7 mt-30 -81.03 -37.93 28.3 Favored 'General case' 0 N--CA 1.431 -1.379 0 O-C-N 120.323 -1.486 . . . . 1.0 113.868 174.715 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -79.42 -42.76 24.73 Favored 'General case' 0 N--CA 1.43 -1.456 0 O-C-N 120.32 -1.488 . . . . 1.0 114.98 -179.686 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . 106.98 17.75 11.35 Favored Glycine 0 N--CA 1.431 -1.695 0 O-C-N 120.683 -1.261 . . . . 1.0 115.762 175.408 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 4.9 tt0 -162.41 152.78 16.81 Favored 'General case' 0 N--CA 1.43 -1.455 0 N-CA-C 104.946 -2.242 . . . . 1.0 104.946 179.527 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 35.1 m -53.48 108.31 0.33 Allowed 'General case' 0 N--CA 1.43 -1.463 0 C-N-CA 125.238 1.415 . . . . 1.0 114.571 175.317 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 49.0 t -89.43 110.49 21.69 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.414 0 CA-C-O 123.258 1.504 . . . . 1.0 108.244 176.892 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 61.5 m -94.19 98.98 11.33 Favored 'General case' 0 N--CA 1.43 -1.46 0 N-CA-C 113.615 0.968 . . . . 1.0 113.615 -162.525 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 88.5 m-85 -89.17 -32.91 17.24 Favored 'General case' 0 N--CA 1.429 -1.485 0 O-C-N 120.961 -1.087 . . . . 1.0 112.884 176.738 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 30.7 mmt180 . . . . . 0 C--O 1.26 1.647 0 N-CA-C 107.3 -1.37 . . . . 1.0 107.3 172.78 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 26.5 mmt . . . . . 0 CA--C 1.491 -1.289 0 N-CA-C 114.482 1.289 . . . . 1.0 114.482 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 76.8 m-20 -110.83 -72.02 0.74 Allowed 'General case' 0 N--CA 1.431 -1.405 0 O-C-N 120.548 -1.345 . . . . 1.0 110.542 -173.643 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -56.86 -45.95 82.12 Favored 'General case' 0 N--CA 1.43 -1.446 0 C-N-CA 126.723 2.009 . . . . 1.0 110.611 170.95 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 49.5 m -60.06 -40.79 90.69 Favored 'General case' 0 N--CA 1.431 -1.416 0 C-N-CA 125.285 1.434 . . . . 1.0 114.776 176.57 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 26.1 tt0 -62.8 -57.34 11.25 Favored 'General case' 0 N--CA 1.429 -1.494 0 C-N-CA 124.236 1.014 . . . . 1.0 111.933 175.265 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 2.4 m-85 -67.31 -24.79 65.79 Favored 'General case' 0 N--CA 1.429 -1.499 0 N-CA-C 115.506 1.669 . . . . 1.0 115.506 178.555 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 10.0 t60 -62.56 -43.28 99.19 Favored 'General case' 0 N--CA 1.43 -1.429 0 O-C-N 119.709 -1.869 . . . . 1.0 112.982 167.857 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -73.84 -45.47 51.02 Favored 'General case' 0 N--CA 1.43 -1.458 0 O-C-N 120.355 -1.465 . . . . 1.0 113.683 177.965 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 84.2 mt -59.76 -44.82 93.69 Favored 'General case' 0 N--CA 1.429 -1.495 0 C-N-CA 124.539 1.135 . . . . 1.0 112.782 173.441 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -58.47 -40.57 83.06 Favored 'General case' 0 N--CA 1.43 -1.47 0 O-C-N 120.538 -1.351 . . . . 1.0 113.427 173.01 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -58.51 -38.48 77.78 Favored 'General case' 0 N--CA 1.431 -1.417 0 CA-C-N 120.276 1.398 . . . . 1.0 114.138 172.358 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 57.9 mm-40 -63.06 -47.94 80.79 Favored 'General case' 0 N--CA 1.43 -1.453 0 O-C-N 119.999 -1.688 . . . . 1.0 114.98 171.719 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 77.6 mt -60.71 -50.06 75.0 Favored 'General case' 0 N--CA 1.431 -1.422 0 O-C-N 120.283 -1.51 . . . . 1.0 112.508 173.863 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 0.4 OUTLIER -46.5 -61.75 1.67 Allowed 'General case' 0 N--CA 1.43 -1.451 0 C-N-CA 127.594 2.358 . . . . 1.0 111.799 177.416 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 53.0 tp -53.62 -58.21 7.99 Favored 'General case' 0 N--CA 1.431 -1.415 0 C-N-CA 125.041 1.336 . . . . 1.0 113.304 174.519 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 28.7 m -60.93 -44.13 97.64 Favored 'General case' 0 N--CA 1.429 -1.485 0 N-CA-C 115.038 1.496 . . . . 1.0 115.038 -170.234 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 7.4 mt -83.41 -27.85 7.69 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.408 0 O-C-N 120.237 -1.539 . . . . 1.0 111.4 -178.196 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 5.4 tt0 -59.33 -50.23 74.78 Favored 'General case' 0 N--CA 1.431 -1.394 0 O-C-N 119.852 -1.78 . . . . 1.0 110.944 167.714 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 53.3 mt-10 -51.84 -52.86 46.41 Favored 'General case' 0 N--CA 1.429 -1.48 0 C-N-CA 126.234 1.814 . . . . 1.0 114.397 172.315 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -63.94 -45.28 89.9 Favored 'General case' 0 N--CA 1.43 -1.472 0 O-C-N 120.277 -1.515 . . . . 1.0 114.843 -177.933 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 96.0 mt -63.93 -49.17 73.67 Favored 'General case' 0 N--CA 1.43 -1.447 0 N-CA-C 115.486 1.661 . . . . 1.0 115.486 174.207 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 25.2 t0 -58.28 -37.58 75.3 Favored 'General case' 0 N--CA 1.429 -1.492 0 O-C-N 119.517 -1.99 . . . . 1.0 114.501 174.349 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 18.2 t70 -91.21 28.32 1.67 Allowed 'General case' 0 N--CA 1.43 -1.46 0 C-N-CA 125.643 1.577 . . . . 1.0 113.9 177.201 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 24' ' ' TRP . . . . . . . . . . . . . 14.1 t90 -65.41 -66.81 0.5 Allowed 'General case' 0 N--CA 1.43 -1.47 0 O-C-N 119.51 -1.994 . . . . 1.0 113.356 176.844 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 29.0 t0 83.2 167.71 0.11 Allowed 'General case' 0 N--CA 1.43 -1.452 0 C-N-CA 127.368 2.267 . . . . 1.0 113.841 172.912 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 116.51 -134.59 11.45 Favored Glycine 0 N--CA 1.431 -1.686 0 C-N-CA 124.803 1.192 . . . . 1.0 111.785 177.223 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -80.57 -28.54 37.16 Favored 'General case' 0 N--CA 1.429 -1.519 0 C-N-CA 126.524 1.93 . . . . 1.0 111.054 -174.921 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 81.9 p -77.42 171.51 14.77 Favored 'General case' 0 N--CA 1.432 -1.366 0 C-N-CA 127.176 2.191 . . . . 1.0 115.68 -172.387 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 17.2 t0 -132.32 157.66 43.88 Favored 'General case' 0 N--CA 1.429 -1.478 0 N-CA-C 107.051 -1.462 . . . . 1.0 107.051 166.18 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 16.6 tt -159.62 123.33 0.41 Allowed 'Isoleucine or valine' 0 N--CA 1.43 -1.461 0 CA-C-O 123.088 1.423 . . . . 1.0 107.754 -169.274 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 31.9 t0 -115.7 101.59 8.97 Favored 'General case' 0 N--CA 1.43 -1.472 0 C-N-CA 127.554 2.342 . . . . 1.0 108.212 -179.377 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 21.7 p -89.26 134.48 34.03 Favored 'General case' 0 N--CA 1.43 -1.447 0 O-C-N 120.283 -1.511 . . . . 1.0 110.345 174.841 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 19.5 mt-10 -129.03 130.11 46.19 Favored 'General case' 0 N--CA 1.431 -1.379 0 O-C-N 120.488 -1.383 . . . . 1.0 111.475 -175.996 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 3.3 tp -106.51 110.77 32.71 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.456 0 C-N-CA 127.34 2.256 . . . . 1.0 105.893 178.335 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 62.7 m-80 -115.17 -178.5 3.39 Favored 'General case' 0 N--CA 1.429 -1.503 0 C-N-CA 126.255 1.822 . . . . 1.0 107.786 175.524 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -71.98 92.79 0.56 Allowed Glycine 0 N--CA 1.431 -1.669 0 O-C-N 119.816 -1.803 . . . . 1.0 115.695 -167.031 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 85.76 11.42 74.05 Favored Glycine 0 N--CA 1.429 -1.782 0 C-N-CA 125.898 1.713 . . . . 1.0 113.264 -174.194 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 48.5 t -136.97 125.89 35.8 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.426 0 O-C-N 121.615 -0.932 . . . . 1.0 111.048 -165.429 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 13.5 mt -105.47 126.0 51.63 Favored 'General case' 0 N--CA 1.43 -1.437 0 CA-C-O 124.511 2.101 . . . . 1.0 108.933 161.587 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -126.66 120.73 30.21 Favored 'General case' 0 N--CA 1.43 -1.449 0 N-CA-C 104.412 -2.44 . . . . 1.0 104.412 -178.621 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 4.5 mp -119.09 126.29 75.23 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.484 0 N-CA-C 108.011 -1.107 . . . . 1.0 108.011 -173.676 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 44.0 p -129.88 130.45 45.22 Favored 'General case' 0 N--CA 1.428 -1.547 0 CA-C-O 121.421 0.629 . . . . 1.0 110.932 -171.83 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 43' ' ' PHE . . . . . . . . . . . . . 1.9 p90 -120.02 172.31 7.83 Favored 'General case' 0 N--CA 1.429 -1.494 0 O-C-N 120.552 -1.343 . . . . 1.0 111.343 -176.395 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -64.02 -24.43 67.71 Favored 'General case' 0 N--CA 1.43 -1.466 0 N-CA-C 116.774 2.138 . . . . 1.0 116.774 -160.062 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 31.1 m120 -66.22 -18.17 65.18 Favored 'General case' 0 N--CA 1.429 -1.489 0 N-CA-C 115.369 1.618 . . . . 1.0 115.369 173.848 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 83.57 43.69 7.23 Favored Glycine 0 N--CA 1.429 -1.774 0 N-CA-C 109.898 -1.281 . . . . 1.0 109.898 -169.929 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 57.8 m -123.94 158.71 31.38 Favored 'General case' 0 N--CA 1.43 -1.468 0 C-N-CA 126.336 1.855 . . . . 1.0 107.213 -177.382 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 22.1 ptmt -151.35 142.3 23.0 Favored 'General case' 0 N--CA 1.43 -1.442 0 N-CA-C 115.21 1.559 . . . . 1.0 115.21 -160.985 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 4.7 mm -109.18 132.71 56.53 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.433 0 N-CA-C 106.136 -1.801 . . . . 1.0 106.136 166.651 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 2.7 tp -125.0 119.75 56.69 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.505 0 CA-C-O 123.116 1.436 . . . . 1.0 109.19 174.243 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 3.0 mt -124.69 96.02 3.58 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.386 0 C-N-CA 126.229 1.812 . . . . 1.0 110.769 -179.035 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 27.2 m120 -94.68 150.77 19.88 Favored 'General case' 0 N--CA 1.43 -1.473 0 CA-C-O 123.864 1.792 . . . . 1.0 108.469 166.97 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 5.8 tmm_? -153.51 141.6 20.38 Favored 'General case' 0 N--CA 1.429 -1.495 0 CA-C-O 123.237 1.494 . . . . 1.0 110.933 -163.977 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -111.57 132.02 54.84 Favored 'General case' 0 N--CA 1.428 -1.541 0 C-N-CA 127.484 2.314 . . . . 1.0 107.352 178.047 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 56.0 mt-10 -67.33 -48.88 45.5 Favored Pre-proline 0 N--CA 1.43 -1.44 0 CA-C-O 115.687 -2.101 . . . . 1.0 115.295 165.573 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 92.4 Cg_endo -77.29 -172.31 1.41 Allowed 'Trans proline' 0 N--CA 1.434 -2.004 0 CA-C-N 126.449 3.339 . . . . 1.0 112.586 172.401 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 22.3 mt 77.7 -44.54 0.42 Allowed 'General case' 0 N--CA 1.43 -1.45 0 C-N-CA 127.419 2.288 . . . . 1.0 114.609 173.989 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 3.8 m170 91.15 47.0 0.01 OUTLIER 'General case' 0 N--CA 1.43 -1.458 0 C-N-CA 128.865 2.866 . . . . 1.0 112.673 169.035 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -150.49 161.86 41.72 Favored 'General case' 0 N--CA 1.43 -1.454 0 O-C-N 120.403 -1.435 . . . . 1.0 107.169 174.984 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 91.3 t -123.14 154.5 28.77 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.403 0 N-CA-C 108.126 -1.064 . . . . 1.0 108.126 173.166 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 61' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -90.1 153.67 20.36 Favored 'General case' 0 N--CA 1.43 -1.451 0 CA-C-N 120.91 1.687 . . . . 1.0 110.376 176.665 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 2.1 tm? -147.61 103.93 3.57 Favored 'General case' 0 N--CA 1.429 -1.477 0 O-C-N 119.144 -2.222 . . . . 1.0 111.035 178.761 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -123.97 136.07 54.06 Favored 'General case' 0 N--CA 1.43 -1.433 0 O-C-N 120.818 -1.176 . . . . 1.0 113.742 172.915 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 64' ' ' THR . . . . . . . . . . . . 0.258 0.1 OUTLIER -134.66 -80.84 0.44 Allowed 'General case' 0 N--CA 1.429 -1.475 0 N-CA-C 107.415 -1.328 . . . . 1.0 107.415 171.456 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 6.1 tmtm? -82.31 -83.69 0.12 Allowed 'General case' 0 N--CA 1.43 -1.442 0 O-C-N 120.242 -1.536 . . . . 1.0 113.161 -175.84 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 20.9 tt0 -128.51 -26.38 2.77 Favored 'General case' 0 N--CA 1.43 -1.464 0 O-C-N 120.218 -1.551 . . . . 1.0 111.733 -175.357 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . -92.19 71.25 1.67 Allowed Glycine 0 N--CA 1.431 -1.689 0 O-C-N 120.692 -1.255 . . . . 1.0 110.839 -179.466 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . -77.97 94.78 1.23 Allowed Glycine 0 N--CA 1.43 -1.759 0 C-N-CA 123.382 0.515 . . . . 1.0 112.522 168.831 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 15.5 m-85 -126.45 151.53 47.62 Favored 'General case' 0 N--CA 1.43 -1.447 0 N-CA-C 107.699 -1.223 . . . . 1.0 107.699 -171.625 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 12.8 p80 -92.71 158.17 16.06 Favored 'General case' 0 N--CA 1.431 -1.392 0 O-C-N 120.187 -1.571 . . . . 1.0 111.063 169.411 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 47.1 p90 -130.01 143.32 50.73 Favored 'General case' 0 N--CA 1.431 -1.423 0 N-CA-C 114.379 1.252 . . . . 1.0 114.379 -162.503 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 30.8 m-20 -125.02 154.35 41.41 Favored 'General case' 0 N--CA 1.43 -1.464 0 C-N-CA 125.74 1.616 . . . . 1.0 110.496 -177.729 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 64.2 tp -87.07 137.48 32.31 Favored 'General case' 0 N--CA 1.43 -1.433 0 C-N-CA 125.625 1.57 . . . . 1.0 111.555 -178.397 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 2.5 mmmp? -101.46 -76.15 0.57 Allowed 'General case' 0 N--CA 1.43 -1.471 0 O-C-N 120.694 -1.254 . . . . 1.0 109.279 165.076 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -146.12 -76.35 0.02 OUTLIER Glycine 0 N--CA 1.43 -1.741 0 O-C-N 121.133 -0.98 . . . . 1.0 112.062 -178.674 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 37.8 m-20 -113.99 39.7 2.65 Favored 'General case' 0 N--CA 1.429 -1.502 0 C-N-CA 124.695 1.198 . . . . 1.0 109.382 170.637 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 15.0 tp10 -168.63 138.0 2.3 Favored 'General case' 0 N--CA 1.43 -1.453 0 N-CA-C 103.624 -2.732 . . . . 1.0 103.624 -178.81 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 78' ' ' TRP . . . . . . . . . . . . . 45.1 m95 -101.65 141.55 34.34 Favored 'General case' 0 N--CA 1.429 -1.477 0 N-CA-C 104.984 -2.228 . . . . 1.0 104.984 165.51 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 9.9 pt -105.11 160.6 5.21 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.432 0 O-C-N 120.527 -1.358 . . . . 1.0 107.93 176.744 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 39.0 m -82.74 133.54 35.15 Favored 'General case' 0 N--CA 1.43 -1.431 0 O-C-N 121.041 -1.037 . . . . 1.0 108.674 167.765 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 29.0 t70 -65.25 -43.29 91.84 Favored 'General case' 0 N--CA 1.43 -1.469 0 CA-C-N 120.577 1.535 . . . . 1.0 112.774 -178.092 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 29.2 tpt85 -66.63 101.79 0.83 Allowed 'General case' 0 N--CA 1.43 -1.428 0 C-N-CA 126.822 2.049 . . . . 1.0 111.38 -179.054 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 83' ' ' SER . . . . . . . . . . . . 0.279 15.4 m 80.52 -43.49 0.23 Allowed 'General case' 0 N--CA 1.43 -1.433 0 C-N-CA 128.619 2.767 . . . . 1.0 114.931 -171.87 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 110.86 81.78 1.23 Allowed Glycine 0 N--CA 1.43 -1.751 0 N-CA-C 109.71 -1.356 . . . . 1.0 109.71 -176.181 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . 0.264 16.0 mt-10 -124.72 -140.5 0.29 Allowed 'General case' 0 N--CA 1.43 -1.455 0 CA-C-N 118.19 0.995 . . . . 1.0 109.535 -172.0 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 62.9 m -146.04 129.2 16.63 Favored 'General case' 0 N--CA 1.43 -1.461 0 O-C-N 119.592 -1.942 . . . . 1.0 110.004 -169.388 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 15.0 t80 -58.86 -81.87 0.02 OUTLIER 'General case' 0 N--CA 1.429 -1.481 0 N-CA-C 117.11 2.263 . . . . 1.0 117.11 -171.277 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 88' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -66.94 -34.38 77.65 Favored 'General case' 0 N--CA 1.429 -1.487 0 O-C-N 120.608 -1.307 . . . . 1.0 112.958 -170.697 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 35.5 t70 -59.93 -47.51 85.47 Favored 'General case' 0 N--CA 1.43 -1.458 0 C-N-CA 126.233 1.813 . . . . 1.0 114.62 173.074 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 49.3 tp -69.81 -41.42 75.05 Favored 'General case' 0 N--CA 1.429 -1.524 0 O-C-N 119.541 -1.974 . . . . 1.0 111.981 178.521 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 45.3 tp -50.58 -44.27 56.78 Favored 'General case' 0 N--CA 1.429 -1.519 0 C-N-CA 126.584 1.954 . . . . 1.0 113.763 167.698 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 2.7 tm-20 -59.55 -50.36 74.21 Favored 'General case' 0 N--CA 1.429 -1.504 0 C-N-CA 125.329 1.452 . . . . 1.0 113.122 172.324 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 37.5 mt-30 -53.33 -45.55 69.1 Favored 'General case' 0 N--CA 1.43 -1.446 0 CA-C-N 120.188 1.358 . . . . 1.0 114.373 173.693 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -62.71 -44.47 96.14 Favored 'General case' 0 N--CA 1.43 -1.461 0 O-C-N 120.219 -1.551 . . . . 1.0 115.133 175.024 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -71.21 -45.23 63.77 Favored 'General case' 0 N--CA 1.43 -1.426 0 O-C-N 119.692 -1.88 . . . . 1.0 113.808 178.233 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 63.0 m -57.46 -30.83 65.36 Favored 'General case' 0 N--CA 1.431 -1.409 0 C-N-CA 127.764 2.425 . . . . 1.0 112.521 174.631 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -63.54 -72.36 0.14 Allowed 'General case' 0 N--CA 1.429 -1.507 0 C-N-CA 125.004 1.321 . . . . 1.0 112.098 168.711 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 3.2 pt20 -70.5 -12.17 61.4 Favored 'General case' 0 N--CA 1.43 -1.425 0 N-CA-C 116.756 2.132 . . . . 1.0 116.756 -169.76 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -90.51 -48.2 7.24 Favored 'General case' 0 N--CA 1.43 -1.446 0 C-N-CA 124.854 1.261 . . . . 1.0 112.139 164.643 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . 110.62 4.33 28.38 Favored Glycine 0 N--CA 1.43 -1.702 0 O-C-N 121.037 -1.039 . . . . 1.0 114.379 -178.614 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 11.2 pt-20 -162.91 165.87 24.61 Favored 'General case' 0 N--CA 1.429 -1.511 0 N-CA-C 106.754 -1.573 . . . . 1.0 106.754 -177.087 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 96.4 m -70.83 121.66 18.45 Favored 'General case' 0 N--CA 1.431 -1.424 0 CA-C-N 120.313 1.415 . . . . 1.0 113.424 -173.342 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 76.6 t -98.62 121.36 49.1 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.493 0 C-N-CA 127.272 2.229 . . . . 1.0 109.421 -179.625 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 29.6 m -67.27 124.07 22.09 Favored 'General case' 0 N--CA 1.43 -1.457 0 C-N-CA 128.845 2.858 . . . . 1.0 115.557 -172.721 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 1.6 p90 -140.85 -56.12 0.5 Allowed 'General case' 0 N--CA 1.429 -1.482 0 O-C-N 120.196 -1.565 . . . . 1.0 112.174 -156.032 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 17.6 ttt180 . . . . . 0 C--O 1.262 1.723 0 C-N-CA 125.346 1.459 . . . . 1.0 111.13 -171.938 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 77.4 mtm . . . . . 0 CA--C 1.491 -1.308 0 N-CA-C 113.099 0.777 . . . . 1.0 113.099 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 2.2 m120 -35.88 -70.29 0.09 Allowed 'General case' 0 N--CA 1.431 -1.406 0 N-CA-C 118.876 2.917 . . . . 1.0 118.876 -160.679 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 11.0 p-10 -71.51 -25.34 62.21 Favored 'General case' 0 N--CA 1.43 -1.436 0 O-C-N 120.181 -1.574 . . . . 1.0 114.129 -175.989 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 28.2 m -71.3 -53.65 13.54 Favored 'General case' 0 N--CA 1.43 -1.451 0 C-N-CA 124.877 1.271 . . . . 1.0 110.338 175.943 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 44.6 mm-40 -57.55 -51.17 70.59 Favored 'General case' 0 N--CA 1.429 -1.483 0 C-N-CA 126.622 1.969 . . . . 1.0 113.509 175.778 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 5.1 t80 -56.42 -39.73 73.54 Favored 'General case' 0 CA--C 1.489 -1.4 0 N-CA-C 114.833 1.42 . . . . 1.0 114.833 172.768 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . 0.31 0.2 OUTLIER -67.61 -40.42 84.69 Favored 'General case' 0 N--CA 1.43 -1.429 0 O-C-N 119.543 -1.973 . . . . 1.0 115.009 173.015 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 81.5 mtt180 -56.4 -53.96 51.26 Favored 'General case' 0 N--CA 1.429 -1.476 0 C-N-CA 125.28 1.432 . . . . 1.0 113.832 177.957 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 3.4 pp -62.0 -42.28 98.98 Favored 'General case' 0 N--CA 1.429 -1.504 0 C-N-CA 124.042 0.937 . . . . 1.0 112.865 176.936 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -56.92 -47.06 81.48 Favored 'General case' 0 N--CA 1.431 -1.419 0 C-N-CA 124.927 1.291 . . . . 1.0 113.996 172.598 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 58.7 m-20 -58.85 -41.7 87.6 Favored 'General case' 0 N--CA 1.43 -1.447 0 C-N-CA 125.484 1.514 . . . . 1.0 113.07 176.265 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . 0.26 15.6 pt20 -70.83 -39.24 73.12 Favored 'General case' 0 N--CA 1.431 -1.42 0 O-C-N 119.696 -1.877 . . . . 1.0 115.859 175.405 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 4.2 pp -73.01 -34.58 66.46 Favored 'General case' 0 N--CA 1.431 -1.376 0 O-C-N 119.183 -2.198 . . . . 1.0 114.028 175.128 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -51.73 -52.05 51.48 Favored 'General case' 0 N--CA 1.43 -1.47 0 C-N-CA 126.257 1.823 . . . . 1.0 112.438 166.434 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 50.8 tp -58.69 -45.83 88.6 Favored 'General case' 0 N--CA 1.429 -1.5 0 C-N-CA 124.643 1.177 . . . . 1.0 113.65 175.088 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 75.3 m -57.0 -59.81 4.51 Favored 'General case' 0 N--CA 1.43 -1.435 0 C-N-CA 125.699 1.6 . . . . 1.0 113.063 175.858 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 84.4 mt -50.15 -45.43 23.7 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.449 0 C-N-CA 126.515 1.926 . . . . 1.0 114.765 172.218 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 10.7 mt-10 -55.57 -63.83 1.04 Allowed 'General case' 0 N--CA 1.43 -1.459 0 O-C-N 119.901 -1.749 . . . . 1.0 113.15 173.65 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 95.2 mt-10 -62.53 -46.55 87.9 Favored 'General case' 0 N--CA 1.43 -1.449 0 C-N-CA 124.998 1.319 . . . . 1.0 113.736 -175.448 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 3.3 tpt180 -73.9 -24.03 59.65 Favored 'General case' 0 N--CA 1.43 -1.447 0 N-CA-C 114.372 1.249 . . . . 1.0 114.372 -174.553 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -88.01 -48.25 7.9 Favored 'General case' 0 N--CA 1.43 -1.43 0 O-C-N 120.742 -1.224 . . . . 1.0 112.088 172.895 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 26.2 t70 -60.33 -50.31 74.14 Favored 'General case' 0 N--CA 1.431 -1.408 0 O-C-N 120.25 -1.531 . . . . 1.0 114.531 -179.244 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 15.5 t70 -93.68 106.99 18.92 Favored 'General case' 0 N--CA 1.429 -1.499 0 O-C-N 119.88 -1.762 . . . . 1.0 109.441 171.047 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 24' ' ' TRP . . . . . . . . . . . . . 14.4 t90 -146.47 175.48 10.53 Favored 'General case' 0 N--CA 1.43 -1.471 0 C-N-CA 126.019 1.728 . . . . 1.0 108.335 -179.165 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 61.0 m-20 -100.48 112.15 24.49 Favored 'General case' 0 N--CA 1.432 -1.351 0 O-C-N 120.356 -1.465 . . . . 1.0 108.502 173.335 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -173.71 167.81 40.49 Favored Glycine 0 N--CA 1.429 -1.797 0 C-N-CA 119.136 -1.506 . . . . 1.0 112.892 176.85 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 31.2 m-20 -88.92 -34.21 17.01 Favored 'General case' 0 N--CA 1.43 -1.475 0 C-N-CA 126.837 2.055 . . . . 1.0 110.607 177.593 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 58.5 p -75.79 147.43 39.22 Favored 'General case' 0 CA--C 1.488 -1.42 0 C-N-CA 124.776 1.23 . . . . 1.0 113.302 -178.717 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 3.3 t0 -90.5 170.58 10.08 Favored 'General case' 0 N--CA 1.431 -1.416 0 O-C-N 120.453 -1.404 . . . . 1.0 111.127 -175.555 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 6.9 mm -152.5 122.59 0.87 Allowed 'Isoleucine or valine' 0 N--CA 1.429 -1.485 0 C-N-CA 128.473 2.709 . . . . 1.0 105.623 -171.288 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 60.6 m-20 -111.39 101.72 10.16 Favored 'General case' 0 N--CA 1.429 -1.513 0 C-N-CA 124.146 0.978 . . . . 1.0 108.803 158.419 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 14.3 p -85.08 124.83 32.22 Favored 'General case' 0 N--CA 1.43 -1.463 0 O-C-N 120.57 -1.331 . . . . 1.0 111.666 173.213 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 36.0 mm-40 -99.4 139.4 35.11 Favored 'General case' 0 N--CA 1.43 -1.429 0 O-C-N 119.781 -1.824 . . . . 1.0 109.534 -174.688 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 4.0 mp -127.2 112.53 28.85 Favored 'Isoleucine or valine' 0 N--CA 1.432 -1.366 0 N-CA-C 105.7 -1.963 . . . . 1.0 105.7 174.437 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 48.5 m-80 -123.8 175.26 6.99 Favored 'General case' 0 N--CA 1.43 -1.455 0 C-N-CA 126.918 2.087 . . . . 1.0 108.244 173.104 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -68.07 86.87 0.18 Allowed Glycine 0 N--CA 1.429 -1.781 0 N-CA-C 116.455 1.342 . . . . 1.0 116.455 -170.615 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 85.86 16.6 63.1 Favored Glycine 0 N--CA 1.43 -1.758 0 C-N-CA 125.29 1.424 . . . . 1.0 112.584 -174.152 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 94.7 t -136.54 122.98 30.13 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.395 0 C-N-CA 124.549 1.139 . . . . 1.0 109.162 -169.828 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 98.9 mt -112.91 140.72 47.47 Favored 'General case' 0 N--CA 1.431 -1.386 0 O-C-N 120.411 -1.431 . . . . 1.0 109.064 168.822 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -134.45 121.06 20.54 Favored 'General case' 0 N--CA 1.43 -1.442 0 O-C-N 120.361 -1.462 . . . . 1.0 108.204 179.229 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 96.4 mt -97.02 115.26 36.14 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.483 0 N-CA-C 106.784 -1.561 . . . . 1.0 106.784 -177.882 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 2.9 m -124.77 122.71 38.2 Favored 'General case' 0 N--CA 1.43 -1.472 0 N-CA-C 108.698 -0.853 . . . . 1.0 108.698 -177.354 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 43' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -115.07 173.28 6.57 Favored 'General case' 0 N--CA 1.429 -1.522 0 C-N-CA 124.339 1.055 . . . . 1.0 110.611 179.882 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -68.89 -23.27 64.18 Favored 'General case' 0 N--CA 1.43 -1.471 0 N-CA-C 116.474 2.027 . . . . 1.0 116.474 -161.017 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 8.4 t-20 -66.85 -18.56 65.44 Favored 'General case' 0 N--CA 1.429 -1.484 0 C-N-CA 124.81 1.244 . . . . 1.0 112.925 169.07 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 99.71 5.06 55.59 Favored Glycine 0 N--CA 1.429 -1.768 0 O-C-N 120.603 -1.311 . . . . 1.0 113.49 172.776 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 1.3 t -89.9 171.83 9.31 Favored 'General case' 0 N--CA 1.431 -1.379 0 CA-C-N 118.277 1.038 . . . . 1.0 112.795 -177.293 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 73.7 tttt -138.17 129.38 27.41 Favored 'General case' 0 N--CA 1.43 -1.468 0 N-CA-C 113.816 1.043 . . . . 1.0 113.816 -157.301 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 1.4 mm -112.32 127.14 69.7 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.39 0 N-CA-C 105.242 -2.133 . . . . 1.0 105.242 161.528 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 3.0 tp -123.07 117.89 53.08 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.464 0 CA-C-O 123.67 1.7 . . . . 1.0 109.311 -178.803 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 6.6 mt -121.13 131.64 72.52 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.472 0 C-N-CA 125.703 1.601 . . . . 1.0 109.976 -170.127 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 52' ' ' ASN . . . . . 0.474 ' H ' ' HD1' ' A' ' 61' ' ' TRP . 6.8 t-20 -162.91 163.8 26.17 Favored 'General case' 0 N--CA 1.43 -1.439 0 CA-C-O 124.049 1.881 . . . . 1.0 107.108 -170.993 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 2.6 ttp180 -156.81 117.37 3.62 Favored 'General case' 0 N--CA 1.43 -1.456 0 CA-C-N 114.204 -1.362 . . . . 1.0 109.337 -156.098 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 32.2 mm-40 -104.55 122.29 45.27 Favored 'General case' 0 N--CA 1.43 -1.473 0 C-N-CA 126.562 1.945 . . . . 1.0 106.876 -179.342 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 23.5 mt-10 -55.72 -39.77 79.79 Favored Pre-proline 0 N--CA 1.43 -1.473 0 N-CA-C 119.332 3.086 . . . . 1.0 119.332 -175.505 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 50.1 Cg_exo -67.44 114.01 3.11 Favored 'Trans proline' 0 N--CA 1.434 -1.997 0 CA-C-N 126.107 3.217 . . . . 1.0 113.051 172.752 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . 0.389 5.3 mp 76.89 132.84 0.05 Allowed 'General case' 0 N--CA 1.429 -1.499 0 C-N-CA 126.83 2.052 . . . . 1.0 114.376 -166.872 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 35.4 m170 -73.78 43.65 0.16 Allowed 'General case' 0 N--CA 1.43 -1.451 0 C-N-CA 127.191 2.196 . . . . 1.0 114.48 -175.29 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 85.5 mt-30 -116.98 134.57 54.58 Favored 'General case' 0 N--CA 1.43 -1.474 0 O-C-N 119.877 -1.765 . . . . 1.0 110.321 -172.618 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 59.3 t -105.83 156.26 6.67 Favored 'Isoleucine or valine' 0 N--CA 1.427 -1.591 0 N-CA-C 106.173 -1.788 . . . . 1.0 106.173 177.91 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 61' ' ' TRP . . . . . 0.474 ' HD1' ' H ' ' A' ' 52' ' ' ASN . 0.0 OUTLIER -104.29 144.55 31.47 Favored 'General case' 0 N--CA 1.431 -1.394 0 O-C-N 119.788 -1.82 . . . . 1.0 111.447 170.82 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 13.1 mt -112.86 95.34 5.36 Favored 'General case' 0 N--CA 1.431 -1.392 0 N-CA-C 104.578 -2.379 . . . . 1.0 104.578 163.873 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -90.79 125.91 35.86 Favored 'General case' 0 N--CA 1.43 -1.444 0 CA-C-O 123.174 1.464 . . . . 1.0 109.224 169.655 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 64' ' ' THR . . . . . . . . . . . . . 9.4 t -152.55 -169.44 3.34 Favored 'General case' 0 N--CA 1.43 -1.453 0 N-CA-C 107.414 -1.328 . . . . 1.0 107.414 -154.9 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 2.3 tptm -56.25 -44.44 79.67 Favored 'General case' 0 N--CA 1.43 -1.466 0 N-CA-C 115.778 1.77 . . . . 1.0 115.778 -178.326 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 82.1 mt-30 -71.66 -24.14 61.79 Favored 'General case' 0 N--CA 1.431 -1.418 0 N-CA-C 115.229 1.566 . . . . 1.0 115.229 -177.313 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 147.25 -46.78 0.71 Allowed Glycine 0 N--CA 1.43 -1.708 0 O-C-N 120.595 -1.315 . . . . 1.0 113.299 175.213 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 125.88 116.77 2.11 Favored Glycine 0 N--CA 1.431 -1.686 0 N-CA-C 117.816 1.886 . . . . 1.0 117.816 178.755 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 20.1 m-30 -123.59 131.99 53.76 Favored 'General case' 0 N--CA 1.431 -1.398 0 C-N-CA 124.791 1.237 . . . . 1.0 109.219 -178.912 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 70' ' ' HIS . . . . . 0.441 ' HE1' ' OD2' ' A' ' 81' ' ' ASP . 17.6 p80 -88.7 158.18 18.29 Favored 'General case' 0 N--CA 1.429 -1.487 0 O-C-N 120.372 -1.455 . . . . 1.0 114.024 173.502 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 48.0 p90 -148.19 148.8 30.94 Favored 'General case' 0 N--CA 1.431 -1.406 0 N-CA-C 115.469 1.655 . . . . 1.0 115.469 -161.369 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 6.2 m-20 -116.46 175.23 5.66 Favored 'General case' 0 N--CA 1.431 -1.414 0 C-N-CA 127.349 2.26 . . . . 1.0 111.808 -172.648 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 50.2 tp -111.3 116.74 31.51 Favored 'General case' 0 N--CA 1.431 -1.416 0 C-N-CA 125.723 1.609 . . . . 1.0 112.039 -178.998 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -72.91 -42.35 63.62 Favored 'General case' 0 N--CA 1.429 -1.495 0 O-C-N 121.14 -0.975 . . . . 1.0 112.476 163.375 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . 166.63 -66.64 0.2 Allowed Glycine 0 N--CA 1.431 -1.694 0 O-C-N 121.035 -1.04 . . . . 1.0 111.815 178.003 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 18.0 p-10 -110.45 6.07 21.86 Favored 'General case' 0 N--CA 1.43 -1.458 0 C-N-CA 124.888 1.275 . . . . 1.0 111.716 -179.108 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 20.2 tt0 -151.72 132.58 14.15 Favored 'General case' 0 N--CA 1.43 -1.44 0 N-CA-C 103.921 -2.622 . . . . 1.0 103.921 -177.574 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 78' ' ' TRP . . . . . . . . . . . . . 71.3 m95 -89.12 135.54 33.51 Favored 'General case' 0 N--CA 1.43 -1.441 0 N-CA-C 105.667 -1.975 . . . . 1.0 105.667 173.495 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -133.96 136.92 53.13 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.452 0 N-CA-C 104.992 -2.225 . . . . 1.0 104.992 -161.737 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 60.5 m -78.69 137.42 37.79 Favored 'General case' 0 N--CA 1.431 -1.384 0 O-C-N 120.089 -1.632 . . . . 1.0 111.957 -173.194 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 81' ' ' ASP . . . . . 0.441 ' OD2' ' HE1' ' A' ' 70' ' ' HIS . 23.8 t0 -72.78 -56.82 4.68 Favored 'General case' 0 N--CA 1.43 -1.428 0 CA-C-O 123.12 1.438 . . . . 1.0 109.548 177.311 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 1.9 tpt85 -72.73 128.59 36.0 Favored 'General case' 0 N--CA 1.43 -1.449 0 C-N-CA 125.535 1.534 . . . . 1.0 110.076 178.59 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 11.0 t 77.86 -63.2 0.34 Allowed 'General case' 0 N--CA 1.43 -1.471 0 C-N-CA 127.33 2.252 . . . . 1.0 112.916 -170.773 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 110.67 71.68 0.66 Allowed Glycine 0 N--CA 1.429 -1.779 0 C-N-CA 124.62 1.105 . . . . 1.0 110.813 -176.774 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 59.6 mt-10 -136.05 -146.36 0.24 Allowed 'General case' 0 N--CA 1.43 -1.441 0 C-N-CA 125.023 1.329 . . . . 1.0 109.444 -170.246 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 88.7 m -143.32 134.8 26.22 Favored 'General case' 0 N--CA 1.43 -1.464 0 O-C-N 120.427 -1.42 . . . . 1.0 109.998 -156.789 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 31.1 t80 -61.03 -76.85 0.05 OUTLIER 'General case' 0 N--CA 1.43 -1.444 0 N-CA-C 117.353 2.353 . . . . 1.0 117.353 -177.535 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 88' ' ' TRP . . . . . . . . . . . . . 55.0 m95 -60.77 -31.88 71.21 Favored 'General case' 0 N--CA 1.431 -1.425 0 O-C-N 120.032 -1.668 . . . . 1.0 114.727 -169.674 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 6.1 t70 -78.14 -36.2 48.04 Favored 'General case' 0 N--CA 1.43 -1.441 0 C-N-CA 125.83 1.652 . . . . 1.0 113.16 177.721 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 50.5 tp -70.63 -41.39 72.26 Favored 'General case' 0 N--CA 1.431 -1.409 0 O-C-N 118.679 -2.513 . . . . 1.0 110.989 175.591 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 31.6 tp -55.46 -37.8 68.23 Favored 'General case' 0 N--CA 1.431 -1.383 0 C-N-CA 126.554 1.942 . . . . 1.0 114.074 169.614 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 35.0 tt0 -60.66 -54.23 47.84 Favored 'General case' 0 N--CA 1.43 -1.434 0 C-N-CA 125.454 1.502 . . . . 1.0 113.028 169.804 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 10.9 tm0? -51.71 -53.81 35.22 Favored 'General case' 0 N--CA 1.43 -1.438 0 C-N-CA 125.995 1.718 . . . . 1.0 114.268 175.133 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -52.21 -55.56 20.36 Favored 'General case' 0 N--CA 1.431 -1.408 0 C-N-CA 127.721 2.408 . . . . 1.0 113.954 176.053 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -61.58 -44.9 96.16 Favored 'General case' 0 N--CA 1.429 -1.49 0 N-CA-C 114.528 1.307 . . . . 1.0 114.528 177.066 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 93.4 m -64.71 -21.21 66.69 Favored 'General case' 0 N--CA 1.429 -1.478 0 O-C-N 119.634 -1.916 . . . . 1.0 113.779 175.324 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 7.5 tp60 -74.45 -65.13 0.89 Allowed 'General case' 0 N--CA 1.429 -1.496 0 O-C-N 120.345 -1.472 . . . . 1.0 110.927 171.749 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 13.3 pt20 -77.38 -28.37 52.81 Favored 'General case' 0 N--CA 1.429 -1.486 0 N-CA-C 115.478 1.658 . . . . 1.0 115.478 -170.963 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -85.6 -46.2 11.02 Favored 'General case' 0 N--CA 1.43 -1.447 0 O-C-N 120.667 -1.271 . . . . 1.0 112.866 171.602 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . 95.61 32.46 6.91 Favored Glycine 0 N--CA 1.43 -1.742 0 O-C-N 120.878 -1.139 . . . . 1.0 114.655 -178.848 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 14.1 pt-20 -158.37 163.1 37.6 Favored 'General case' 0 N--CA 1.43 -1.433 0 O-C-N 120.955 -1.321 . . . . 1.0 108.987 179.57 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 92.6 m -77.9 85.38 4.16 Favored 'General case' 0 N--CA 1.429 -1.502 0 O-C-N 119.862 -1.774 . . . . 1.0 112.58 -178.937 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 47.8 t -85.12 100.38 8.27 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.42 0 C-N-CA 126.914 2.085 . . . . 1.0 106.617 168.378 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 34.9 t -143.09 154.72 44.23 Favored 'General case' 0 N--CA 1.431 -1.415 0 C-N-CA 125.261 1.424 . . . . 1.0 107.93 -174.78 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -110.98 -16.77 13.44 Favored 'General case' 0 N--CA 1.43 -1.456 0 O-C-N 120.437 -1.415 . . . . 1.0 112.217 176.262 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 16.1 mtp180 . . . . . 0 C--O 1.259 1.574 0 N-CA-C 115.519 1.674 . . . . 1.0 115.519 -167.16 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 91.7 mtp . . . . . 0 CA--C 1.49 -1.35 0 CA-C-O 121.391 0.615 . . . . 1.0 110.725 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 18.8 m120 66.53 -84.62 0.03 OUTLIER 'General case' 0 N--CA 1.43 -1.46 0 C-N-CA 126.7 2.0 . . . . 1.0 114.02 -178.278 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -57.3 -47.61 81.04 Favored 'General case' 0 CA--C 1.49 -1.361 0 C-N-CA 127.493 2.317 . . . . 1.0 113.197 -173.235 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 10.5 m -60.07 -42.5 94.67 Favored 'General case' 0 N--CA 1.43 -1.43 0 C-N-CA 125.743 1.617 . . . . 1.0 113.567 177.106 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 9.0 tp10 -70.6 -46.47 63.35 Favored 'General case' 0 N--CA 1.43 -1.426 0 C-N-CA 125.083 1.353 . . . . 1.0 111.729 -178.732 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 4.4 t80 -50.36 -54.69 19.83 Favored 'General case' 0 N--CA 1.429 -1.5 0 C-N-CA 125.802 1.641 . . . . 1.0 114.63 166.572 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 30.4 m170 -59.47 -45.16 92.42 Favored 'General case' 0 N--CA 1.43 -1.454 0 N-CA-C 115.475 1.657 . . . . 1.0 115.475 178.434 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 73.4 mtp85 -56.52 -56.27 23.34 Favored 'General case' 0 N--CA 1.43 -1.433 0 N-CA-C 113.338 0.866 . . . . 1.0 113.338 173.282 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 82.7 mt -66.23 -40.59 90.37 Favored 'General case' 0 N--CA 1.43 -1.441 0 N-CA-C 114.676 1.361 . . . . 1.0 114.676 -179.161 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -62.79 -48.5 78.87 Favored 'General case' 0 N--CA 1.43 -1.468 0 C-N-CA 124.905 1.282 . . . . 1.0 113.383 178.509 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 58.7 m-20 -66.22 -36.33 82.77 Favored 'General case' 0 N--CA 1.429 -1.485 0 O-C-N 120.829 -1.17 . . . . 1.0 113.071 175.812 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 29.1 mm100 -61.65 -46.73 88.52 Favored 'General case' 0 N--CA 1.43 -1.461 0 O-C-N 120.116 -1.615 . . . . 1.0 114.845 170.398 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 1.2 pp -70.05 -37.18 75.48 Favored 'General case' 0 N--CA 1.43 -1.451 0 O-C-N 119.942 -1.724 . . . . 1.0 114.503 -179.688 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 0.1 OUTLIER -43.82 -62.09 1.22 Allowed 'General case' 0 N--CA 1.43 -1.459 0 C-N-CA 127.786 2.434 . . . . 1.0 112.411 163.348 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 44.7 tp -60.06 -47.85 84.15 Favored 'General case' 0 N--CA 1.43 -1.44 0 C-N-CA 124.738 1.215 . . . . 1.0 113.499 177.88 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 32.6 m -57.33 -50.83 71.71 Favored 'General case' 0 N--CA 1.43 -1.474 0 C-N-CA 125.743 1.617 . . . . 1.0 113.686 179.482 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 95.9 mt -65.32 -45.45 93.37 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.465 0 O-C-N 120.353 -1.467 . . . . 1.0 111.554 179.718 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -57.65 -55.05 39.89 Favored 'General case' 0 N--CA 1.428 -1.532 0 O-C-N 121.774 -0.579 . . . . 1.0 112.542 176.26 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 5.5 tm-20 -58.21 -49.7 76.14 Favored 'General case' 0 N--CA 1.43 -1.467 0 C-N-CA 126.103 1.761 . . . . 1.0 114.591 178.008 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.28 -38.54 77.19 Favored 'General case' 0 N--CA 1.43 -1.471 0 C-N-CA 124.72 1.208 . . . . 1.0 113.912 -179.388 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 2.7 tp -86.08 -38.32 17.92 Favored 'General case' 0 N--CA 1.429 -1.495 0 N-CA-C 113.877 1.065 . . . . 1.0 113.877 177.914 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 37.3 t70 -61.23 -26.41 67.72 Favored 'General case' 0 N--CA 1.43 -1.469 0 O-C-N 119.281 -2.137 . . . . 1.0 113.969 173.709 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 29.8 t70 -59.85 -35.51 74.93 Favored 'General case' 0 N--CA 1.429 -1.478 0 C-N-CA 126.247 1.819 . . . . 1.0 114.506 171.02 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 24' ' ' TRP . . . . . . . . . . . . . 48.7 t90 -83.93 138.78 32.98 Favored 'General case' 0 N--CA 1.43 -1.46 0 CA-C-O 122.062 0.934 . . . . 1.0 113.124 -167.349 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 24.0 t70 -133.64 131.46 39.59 Favored 'General case' 0 N--CA 1.431 -1.393 0 O-C-N 121.236 -0.915 . . . . 1.0 109.298 -179.661 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -125.88 -141.35 5.52 Favored Glycine 0 N--CA 1.43 -1.74 0 N-CA-C 109.843 -1.303 . . . . 1.0 109.843 177.272 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -89.07 -26.83 21.18 Favored 'General case' 0 N--CA 1.43 -1.438 0 O-C-N 120.825 -1.397 . . . . 1.0 109.134 165.632 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 88.1 p -82.12 163.98 21.63 Favored 'General case' 0 N--CA 1.431 -1.4 0 O-C-N 120.375 -1.453 . . . . 1.0 111.935 165.448 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 9.4 t70 -117.48 175.48 5.61 Favored 'General case' 0 N--CA 1.43 -1.448 0 N-CA-C 107.442 -1.318 . . . . 1.0 107.442 177.653 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 9.1 tp -159.08 114.24 0.15 Allowed 'Isoleucine or valine' 0 N--CA 1.429 -1.499 0 CA-C-O 123.81 1.767 . . . . 1.0 109.502 -159.884 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 25.1 t0 -131.21 102.47 6.01 Favored 'General case' 0 N--CA 1.43 -1.44 0 C-N-CA 125.501 1.52 . . . . 1.0 110.247 -168.079 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 28.2 t -85.57 135.22 33.9 Favored 'General case' 0 N--CA 1.429 -1.509 0 O-C-N 118.899 -2.376 . . . . 1.0 111.976 176.631 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 38.5 mt-10 -85.11 139.59 31.6 Favored 'General case' 0 N--CA 1.43 -1.44 0 O-C-N 120.953 -1.092 . . . . 1.0 110.856 171.538 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 7.9 mm -111.85 105.39 18.7 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.419 0 N-CA-C 104.927 -2.249 . . . . 1.0 104.927 166.859 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 8.0 t30 -122.95 68.25 0.98 Allowed 'General case' 0 N--CA 1.431 -1.413 0 C-N-CA 125.696 1.599 . . . . 1.0 108.208 -176.58 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . 66.61 -88.48 0.13 Allowed Glycine 0 N--CA 1.429 -1.771 0 O-C-N 120.524 -1.36 . . . . 1.0 115.986 176.584 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -113.88 4.57 24.18 Favored Glycine 0 N--CA 1.43 -1.708 0 C-N-CA 124.866 1.222 . . . . 1.0 112.955 177.953 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 40.3 t -117.54 131.17 71.04 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.483 0 C-N-CA 124.786 1.234 . . . . 1.0 107.679 176.919 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 40.1 mt -110.82 131.05 55.38 Favored 'General case' 0 N--CA 1.429 -1.478 0 O-C-N 120.702 -1.249 . . . . 1.0 108.14 166.771 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -130.6 111.69 12.46 Favored 'General case' 0 N--CA 1.431 -1.423 0 CA-C-O 123.119 1.438 . . . . 1.0 108.003 -174.245 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 69.9 mt -89.66 114.83 28.2 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.421 0 O-C-N 120.762 -1.211 . . . . 1.0 108.023 -170.153 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 6.4 m -111.99 128.87 56.3 Favored 'General case' 0 N--CA 1.43 -1.451 0 CA-C-O 121.694 0.759 . . . . 1.0 111.295 -170.631 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 43' ' ' PHE . . . . . . . . . . . . . 2.7 m-85 -114.74 149.42 36.89 Favored 'General case' 0 N--CA 1.43 -1.445 0 O-C-N 120.437 -1.414 . . . . 1.0 107.731 -175.408 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 4.5 mt-10 -65.8 -17.01 64.34 Favored 'General case' 0 N--CA 1.43 -1.458 0 N-CA-C 116.304 1.965 . . . . 1.0 116.304 176.248 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 3.6 m-20 -64.7 -17.76 64.39 Favored 'General case' 0 N--CA 1.429 -1.478 0 O-C-N 120.66 -1.275 . . . . 1.0 113.538 172.771 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 104.45 -4.46 43.75 Favored Glycine 0 N--CA 1.429 -1.792 0 O-C-N 120.996 -1.065 . . . . 1.0 111.092 -177.861 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 69.0 m -73.92 164.57 26.47 Favored 'General case' 0 N--CA 1.43 -1.442 0 C-N-CA 129.115 2.966 . . . . 1.0 113.458 -179.865 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 81.8 tttt -168.48 132.25 1.54 Allowed 'General case' 0 N--CA 1.43 -1.466 0 O-C-N 120.778 -1.201 . . . . 1.0 114.088 -167.799 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 5.5 mm -112.98 144.4 20.71 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.471 0 C-N-CA 125.082 1.353 . . . . 1.0 108.401 174.417 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 3.6 mm -120.0 119.39 60.0 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.483 0 C-N-CA 125.494 1.517 . . . . 1.0 109.942 -178.979 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 3.7 mt -126.99 125.6 66.84 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.474 0 O-C-N 120.304 -1.498 . . . . 1.0 111.357 -178.894 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 52' ' ' ASN . . . . . 0.441 ' H ' ' HD1' ' A' ' 61' ' ' TRP . 45.7 t-20 -160.56 166.39 29.12 Favored 'General case' 0 N--CA 1.429 -1.477 0 C-N-CA 126.759 2.024 . . . . 1.0 105.833 -177.206 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 11.1 ptm180 -133.61 145.09 49.71 Favored 'General case' 0 N--CA 1.43 -1.442 0 C-N-CA 125.513 1.525 . . . . 1.0 110.996 -162.49 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 6.2 mm-40 -128.45 -72.61 0.61 Allowed 'General case' 0 N--CA 1.429 -1.476 0 O-C-N 120.728 -1.232 . . . . 1.0 112.623 -175.052 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 54.1 mm-40 -74.12 121.64 85.68 Favored Pre-proline 0 N--CA 1.429 -1.488 0 CA-C-O 117.329 -1.32 . . . . 1.0 112.765 -165.809 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 38.4 Cg_endo -81.13 36.55 0.63 Allowed 'Trans proline' 0 C--N 1.3 -1.998 0 C-N-CA 123.877 3.051 . . . . 1.0 112.918 -174.006 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . 0.418 ' O ' ' HD2' ' A' ' 58' ' ' HIS . 55.4 mt -109.79 -100.42 0.39 Allowed 'General case' 0 N--CA 1.431 -1.413 0 N-CA-C 104.354 -2.462 . . . . 1.0 104.354 171.754 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 58' ' ' HIS . . . . . 0.418 ' HD2' ' O ' ' A' ' 57' ' ' LEU . 56.1 m170 -137.52 79.0 1.72 Allowed 'General case' 0 N--CA 1.43 -1.427 0 C-N-CA 125.57 1.548 . . . . 1.0 111.182 170.22 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 17.9 tt0 -155.5 132.75 10.89 Favored 'General case' 0 N--CA 1.43 -1.451 0 CA-C-N 121.84 2.109 . . . . 1.0 113.155 173.24 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 85.0 t -135.82 164.15 33.03 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.454 0 N-CA-C 107.339 -1.356 . . . . 1.0 107.339 179.933 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 61' ' ' TRP . . . . . 0.441 ' HD1' ' H ' ' A' ' 52' ' ' ASN . 0.1 OUTLIER -105.59 153.97 21.05 Favored 'General case' 0 N--CA 1.43 -1.441 0 O-C-N 119.971 -1.706 . . . . 1.0 114.127 178.298 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 68.9 mt -123.19 97.39 5.4 Favored 'General case' 0 N--CA 1.43 -1.446 0 N-CA-C 107.229 -1.397 . . . . 1.0 107.229 162.605 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -98.24 139.11 34.52 Favored 'General case' 0 N--CA 1.431 -1.417 0 O-C-N 120.811 -1.18 . . . . 1.0 108.744 172.959 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 64' ' ' THR . . . . . . . . . . . . . 6.6 t -152.68 -158.52 0.9 Allowed 'General case' 0 N--CA 1.431 -1.405 0 O-C-N 120.595 -1.316 . . . . 1.0 111.39 -158.794 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 41.3 tptt -57.2 -62.85 1.47 Allowed 'General case' 0 N--CA 1.43 -1.473 0 C-N-CA 127.391 2.276 . . . . 1.0 114.373 178.762 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 31.3 tt0 -76.63 -23.56 53.35 Favored 'General case' 0 N--CA 1.429 -1.51 0 CA-C-O 122.489 1.138 . . . . 1.0 112.933 -171.605 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 155.73 -67.16 0.3 Allowed Glycine 0 N--CA 1.43 -1.704 0 N-CA-C 108.014 -2.034 . . . . 1.0 108.014 -178.398 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 85.92 170.92 47.55 Favored Glycine 0 N--CA 1.43 -1.712 0 C-N-CA 124.245 0.926 . . . . 1.0 114.971 -177.689 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -155.95 164.89 37.91 Favored 'General case' 0 N--CA 1.429 -1.509 0 C-N-CA 123.732 0.813 . . . . 1.0 110.7 -166.375 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 28.2 p80 -82.77 157.76 23.1 Favored 'General case' 0 N--CA 1.431 -1.422 0 N-CA-C 114.952 1.464 . . . . 1.0 114.952 177.518 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 42.6 p90 -121.02 134.42 55.29 Favored 'General case' 0 N--CA 1.431 -1.423 0 CA-C-N 114.835 -1.075 . . . . 1.0 113.55 -175.076 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -131.4 147.33 52.55 Favored 'General case' 0 N--CA 1.43 -1.451 0 C-N-CA 125.207 1.403 . . . . 1.0 108.203 -177.604 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 1.5 tt -85.76 114.0 22.37 Favored 'General case' 0 N--CA 1.43 -1.461 0 O-C-N 119.695 -1.878 . . . . 1.0 112.0 -169.468 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 32.3 mmtp -115.51 72.5 0.8 Allowed 'General case' 0 N--CA 1.43 -1.472 0 O-C-N 120.639 -1.288 . . . . 1.0 111.705 177.944 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . 97.84 -100.27 2.35 Favored Glycine 0 N--CA 1.43 -1.735 0 O-C-N 120.198 -1.564 . . . . 1.0 112.716 175.631 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 34.2 m-20 -115.74 11.09 15.59 Favored 'General case' 0 N--CA 1.431 -1.399 0 C-N-CA 124.436 1.094 . . . . 1.0 111.731 179.908 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 5.3 tp10 -151.44 146.32 25.86 Favored 'General case' 0 N--CA 1.43 -1.467 0 N-CA-C 105.418 -2.068 . . . . 1.0 105.418 -179.957 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 78' ' ' TRP . . . . . 0.444 ' HB2' ' HB2' ' A' ' 87' ' ' PHE . 23.7 m95 -90.25 125.63 35.56 Favored 'General case' 0 N--CA 1.429 -1.499 0 N-CA-C 107.159 -1.423 . . . . 1.0 107.159 176.266 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 2.4 mt -89.44 137.98 20.23 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.469 0 C-N-CA 127.191 2.196 . . . . 1.0 109.396 178.272 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 20.8 m -82.05 141.6 33.05 Favored 'General case' 0 N--CA 1.431 -1.425 0 N-CA-C 108.073 -1.084 . . . . 1.0 108.073 175.655 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 24.7 t70 -78.39 -1.54 33.94 Favored 'General case' 0 N--CA 1.43 -1.426 0 CA-C-N 120.201 1.364 . . . . 1.0 114.555 -175.834 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 2.0 ptt180 -82.29 176.79 9.17 Favored 'General case' 0 N--CA 1.43 -1.446 0 O-C-N 119.171 -2.206 . . . . 1.0 112.312 170.56 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 52.5 m -76.09 65.01 2.03 Favored 'General case' 0 N--CA 1.431 -1.375 0 O-C-N 119.899 -1.751 . . . . 1.0 113.051 170.878 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 170.44 103.14 0.16 Allowed Glycine 0 N--CA 1.43 -1.717 0 N-CA-C 105.577 -3.009 . . . . 1.0 105.577 170.486 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 3.2 pt-20 -116.44 82.08 1.73 Allowed 'General case' 0 N--CA 1.43 -1.444 0 N-CA-C 114.521 1.304 . . . . 1.0 114.521 -146.324 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -162.41 129.41 3.7 Favored 'General case' 0 N--CA 1.431 -1.399 0 N-CA-C 115.545 1.683 . . . . 1.0 115.545 -173.329 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 87' ' ' PHE . . . . . 0.444 ' HB2' ' HB2' ' A' ' 78' ' ' TRP . 4.4 t80 -63.63 -89.24 0.01 OUTLIER 'General case' 0 N--CA 1.43 -1.463 0 N-CA-C 116.432 2.012 . . . . 1.0 116.432 173.048 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 88' ' ' TRP . . . . . . . . . . . . . 68.5 m95 -62.1 -27.31 68.83 Favored 'General case' 0 N--CA 1.429 -1.476 0 C-N-CA 125.313 1.445 . . . . 1.0 113.217 -173.022 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . 0.276 0.6 OUTLIER -78.1 -39.41 41.5 Favored 'General case' 0 N--CA 1.429 -1.479 0 C-N-CA 126.291 1.836 . . . . 1.0 112.916 178.683 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 26.5 tp -72.08 -37.66 69.56 Favored 'General case' 0 N--CA 1.43 -1.436 0 O-C-N 118.419 -2.676 . . . . 1.0 111.784 171.15 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 18.5 tp -54.37 -40.33 68.03 Favored 'General case' 0 N--CA 1.43 -1.435 0 C-N-CA 125.43 1.492 . . . . 1.0 114.144 170.325 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 31.4 tt0 -55.71 -56.23 22.87 Favored 'General case' 0 N--CA 1.431 -1.385 0 C-N-CA 124.535 1.134 . . . . 1.0 112.88 165.908 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 60.7 mt-30 -61.25 -39.38 90.12 Favored 'General case' 0 N--CA 1.43 -1.428 0 N-CA-C 115.14 1.533 . . . . 1.0 115.14 -177.736 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -62.51 -46.7 87.21 Favored 'General case' 0 N--CA 1.43 -1.469 0 O-C-N 119.402 -2.061 . . . . 1.0 112.91 170.622 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -67.59 -36.57 81.14 Favored 'General case' 0 N--CA 1.429 -1.501 0 O-C-N 119.566 -1.959 . . . . 1.0 114.263 176.678 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -57.72 -38.67 75.68 Favored 'General case' 0 N--CA 1.43 -1.448 0 C-N-CA 127.033 2.133 . . . . 1.0 112.474 173.617 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 8.2 pt20 -78.15 -37.11 46.74 Favored 'General case' 0 N--CA 1.431 -1.41 0 O-C-N 121.097 -1.002 . . . . 1.0 113.455 174.963 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 6.9 mm-40 -72.69 -41.91 64.8 Favored 'General case' 0 N--CA 1.43 -1.467 0 N-CA-C 115.308 1.596 . . . . 1.0 115.308 -177.486 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -84.91 -39.15 18.55 Favored 'General case' 0 N--CA 1.429 -1.494 0 C-N-CA 124.804 1.242 . . . . 1.0 112.136 174.255 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . 105.61 12.56 26.24 Favored Glycine 0 N--CA 1.43 -1.715 0 O-C-N 121.004 -1.06 . . . . 1.0 114.256 176.105 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 8.4 pt-20 -165.2 163.44 20.25 Favored 'General case' 0 N--CA 1.43 -1.435 0 N-CA-C 105.439 -2.059 . . . . 1.0 105.439 -175.486 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 94.9 m -67.47 114.06 5.83 Favored 'General case' 0 N--CA 1.43 -1.472 0 CA-C-N 120.286 1.403 . . . . 1.0 113.717 -172.09 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 76.1 t -95.6 122.61 47.23 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.448 0 C-N-CA 126.899 2.08 . . . . 1.0 106.325 171.694 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 59.5 m -103.16 102.63 12.63 Favored 'General case' 0 N--CA 1.43 -1.461 0 C-N-CA 124.556 1.142 . . . . 1.0 112.66 -162.363 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 45.7 m-85 -95.57 -36.67 11.18 Favored 'General case' 0 N--CA 1.43 -1.45 0 O-C-N 120.317 -1.489 . . . . 1.0 111.825 177.363 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 11.7 mmt85 . . . . . 0 C--O 1.26 1.658 0 C-N-CA 124.174 0.99 . . . . 1.0 110.778 -179.42 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 25.0 mmt . . . . . 0 CA--C 1.491 -1.296 0 N-CA-C 112.297 0.48 . . . . 1.0 112.297 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 19.6 m120 -137.77 -179.83 5.99 Favored 'General case' 0 N--CA 1.43 -1.45 0 C-N-CA 124.551 1.14 . . . . 1.0 109.235 175.165 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 25.7 t70 -56.84 -50.35 72.68 Favored 'General case' 0 N--CA 1.43 -1.47 0 C-N-CA 128.239 2.616 . . . . 1.0 112.321 178.947 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 41.9 t -44.7 -50.23 10.07 Favored 'General case' 0 N--CA 1.429 -1.488 0 C-N-CA 128.253 2.621 . . . . 1.0 114.181 170.086 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 14.5 tt0 -74.04 -51.41 15.9 Favored 'General case' 0 N--CA 1.43 -1.457 0 C-N-CA 125.33 1.452 . . . . 1.0 113.024 -177.0 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 11.1 t80 -49.95 -43.51 50.07 Favored 'General case' 0 N--CA 1.431 -1.409 0 N-CA-C 115.753 1.76 . . . . 1.0 115.753 170.698 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 35.2 m170 -69.9 -33.65 72.47 Favored 'General case' 0 N--CA 1.43 -1.425 0 N-CA-C 114.664 1.357 . . . . 1.0 114.664 175.458 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -66.0 -46.39 78.14 Favored 'General case' 0 N--CA 1.43 -1.458 0 O-C-N 120.731 -1.23 . . . . 1.0 112.96 169.742 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 97.7 mt -60.3 -34.73 74.18 Favored 'General case' 0 N--CA 1.43 -1.438 0 O-C-N 120.57 -1.331 . . . . 1.0 113.745 173.647 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -59.05 -46.69 87.62 Favored 'General case' 0 N--CA 1.43 -1.473 0 C-N-CA 125.692 1.597 . . . . 1.0 113.245 170.307 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -58.28 -41.49 84.46 Favored 'General case' 0 N--CA 1.429 -1.482 0 C-N-CA 124.658 1.183 . . . . 1.0 113.11 172.359 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 55.1 mt-30 -58.13 -58.43 8.47 Favored 'General case' 0 N--CA 1.431 -1.42 0 N-CA-C 115.166 1.543 . . . . 1.0 115.166 172.092 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 3.7 pp -66.36 -40.15 89.58 Favored 'General case' 0 N--CA 1.43 -1.433 0 O-C-N 120.15 -1.594 . . . . 1.0 114.996 -176.483 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 33.7 m0 -64.6 -44.19 91.42 Favored 'General case' 0 N--CA 1.429 -1.487 0 C-N-CA 124.814 1.246 . . . . 1.0 112.948 174.548 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 63.0 tp -58.6 -54.77 43.29 Favored 'General case' 0 N--CA 1.431 -1.417 0 O-C-N 120.564 -1.335 . . . . 1.0 112.506 171.533 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 29.4 m -57.42 -53.39 58.66 Favored 'General case' 0 N--CA 1.43 -1.451 0 C-N-CA 125.492 1.517 . . . . 1.0 113.228 -174.381 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 14.4 mt -68.22 -44.24 84.2 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.44 0 O-C-N 120.499 -1.376 . . . . 1.0 113.846 178.826 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 32.3 tt0 -60.86 -47.57 85.78 Favored 'General case' 0 N--CA 1.431 -1.399 0 CA-C-N 120.641 1.564 . . . . 1.0 112.883 179.09 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 34.0 tt0 -58.75 -55.0 40.69 Favored 'General case' 0 N--CA 1.43 -1.438 0 C-N-CA 125.109 1.364 . . . . 1.0 113.551 174.381 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 16.3 tpt180 -58.39 -44.06 88.81 Favored 'General case' 0 N--CA 1.43 -1.462 0 C-N-CA 124.798 1.239 . . . . 1.0 114.11 -176.084 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 84.8 mt -74.83 -43.38 54.88 Favored 'General case' 0 N--CA 1.43 -1.436 0 O-C-N 121.0 -1.062 . . . . 1.0 113.845 179.013 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 21.1 t70 -64.09 -35.14 79.77 Favored 'General case' 0 CA--C 1.488 -1.434 0 O-C-N 120.527 -1.358 . . . . 1.0 114.433 176.092 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 29.4 t70 -71.8 -43.36 65.78 Favored 'General case' 0 N--CA 1.431 -1.404 0 O-C-N 120.33 -1.481 . . . . 1.0 113.84 179.715 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 24' ' ' TRP . . . . . . . . . . . . . 68.8 t-105 -78.71 154.45 30.07 Favored 'General case' 0 N--CA 1.43 -1.474 0 CA-C-O 122.342 1.068 . . . . 1.0 113.523 -173.304 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 52.5 m-20 -96.93 -153.76 0.43 Allowed 'General case' 0 N--CA 1.431 -1.419 0 O-C-N 120.384 -1.447 . . . . 1.0 111.381 -176.165 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 153.16 -173.68 31.99 Favored Glycine 0 N--CA 1.431 -1.639 0 N-CA-C 109.003 -1.639 . . . . 1.0 109.003 -178.275 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 6.6 t70 -78.06 -44.64 25.77 Favored 'General case' 0 N--CA 1.432 -1.351 0 O-C-N 121.418 -1.048 . . . . 1.0 108.322 170.326 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 21.9 t -68.31 156.4 37.79 Favored 'General case' 0 N--CA 1.43 -1.469 0 C-N-CA 125.912 1.685 . . . . 1.0 113.743 172.661 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 4.6 t70 -86.52 175.45 8.34 Favored 'General case' 0 N--CA 1.429 -1.475 0 C-N-CA 125.833 1.653 . . . . 1.0 107.735 164.471 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -162.89 119.63 0.16 Allowed 'Isoleucine or valine' 0 N--CA 1.43 -1.436 0 O-C-N 120.223 -1.548 . . . . 1.0 107.508 -172.051 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 26.3 t70 -131.93 111.26 11.41 Favored 'General case' 0 N--CA 1.43 -1.458 0 O-C-N 120.189 -1.569 . . . . 1.0 108.743 174.258 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 96.3 m -90.25 134.93 33.99 Favored 'General case' 0 N--CA 1.431 -1.385 0 O-C-N 119.231 -2.168 . . . . 1.0 109.857 174.399 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 37.0 mt-10 -101.97 132.78 47.59 Favored 'General case' 0 N--CA 1.431 -1.419 0 C-N-CA 125.012 1.325 . . . . 1.0 109.157 -178.605 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 3.6 tp -112.48 113.59 44.57 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.449 0 CA-C-O 123.792 1.758 . . . . 1.0 106.379 175.756 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -136.42 99.08 3.99 Favored 'General case' 0 N--CA 1.43 -1.45 0 CA-C-N 114.578 -1.192 . . . . 1.0 111.219 -177.849 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . 71.77 26.24 73.25 Favored Glycine 0 N--CA 1.429 -1.774 0 O-C-N 120.251 -1.531 . . . . 1.0 116.34 164.395 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 86.95 20.71 52.76 Favored Glycine 0 N--CA 1.43 -1.752 0 C-N-CA 123.798 0.713 . . . . 1.0 112.889 -173.785 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 84.9 t -125.08 131.48 72.45 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.394 0 N-CA-C 105.815 -1.921 . . . . 1.0 105.815 173.068 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 42.5 mt -102.6 132.25 48.82 Favored 'General case' 0 N--CA 1.431 -1.398 0 CA-C-O 122.56 1.172 . . . . 1.0 109.615 165.785 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -118.13 124.62 48.45 Favored 'General case' 0 N--CA 1.43 -1.427 0 N-CA-C 106.724 -1.584 . . . . 1.0 106.724 171.392 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 69.7 mt -101.42 121.57 52.48 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.475 0 N-CA-C 108.406 -0.961 . . . . 1.0 108.406 -173.626 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 20.2 p -123.72 118.51 27.38 Favored 'General case' 0 N--CA 1.431 -1.397 0 N-CA-C 113.942 1.09 . . . . 1.0 113.942 -173.439 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 43' ' ' PHE . . . . . . . . . . . . . 3.0 p90 -123.32 169.82 10.93 Favored 'General case' 0 N--CA 1.43 -1.44 0 C-N-CA 126.015 1.726 . . . . 1.0 114.088 174.674 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 7.5 mm-40 -53.34 -32.71 50.42 Favored 'General case' 0 N--CA 1.43 -1.441 0 N-CA-C 118.129 2.64 . . . . 1.0 118.129 -174.44 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -66.78 -12.99 60.89 Favored 'General case' 0 N--CA 1.43 -1.449 0 O-C-N 120.478 -1.389 . . . . 1.0 113.527 -179.715 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 100.96 -14.37 58.68 Favored Glycine 0 N--CA 1.43 -1.755 0 O-C-N 120.791 -1.193 . . . . 1.0 113.425 166.008 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 4.3 m -77.09 168.75 19.55 Favored 'General case' 0 N--CA 1.43 -1.451 0 C-N-CA 124.615 1.166 . . . . 1.0 111.661 176.918 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 93.1 mttt -142.91 135.48 27.64 Favored 'General case' 0 N--CA 1.43 -1.451 0 O-C-N 121.03 -1.044 . . . . 1.0 111.154 -172.266 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 4.2 mm -101.36 137.31 29.46 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.414 0 N-CA-C 105.922 -1.881 . . . . 1.0 105.922 175.671 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 2.5 tp -128.06 124.83 63.44 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.469 0 CA-C-O 123.078 1.418 . . . . 1.0 109.687 -176.778 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 2.3 mt -127.45 118.03 48.47 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.496 0 C-N-CA 126.316 1.846 . . . . 1.0 111.906 -172.858 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 48.6 t30 -157.75 171.42 20.34 Favored 'General case' 0 N--CA 1.431 -1.418 0 C-N-CA 127.022 2.129 . . . . 1.0 107.792 -176.305 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -136.74 161.17 36.68 Favored 'General case' 0 N--CA 1.43 -1.474 0 C-N-CA 125.722 1.609 . . . . 1.0 114.547 -167.668 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 13.3 mm100 -108.09 129.03 55.17 Favored 'General case' 0 N--CA 1.429 -1.493 0 C-N-CA 125.998 1.719 . . . . 1.0 106.59 169.572 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 47.1 tt0 -60.69 -38.21 53.96 Favored Pre-proline 0 N--CA 1.428 -1.536 0 CA-C-O 117.132 -1.413 . . . . 1.0 114.528 164.481 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 51.9 Cg_exo -66.55 121.57 8.84 Favored 'Trans proline' 0 C--N 1.299 -2.056 0 CA-C-N 124.97 2.811 . . . . 1.0 113.745 160.716 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . 0.381 5.0 mp 75.3 131.9 0.05 OUTLIER 'General case' 0 N--CA 1.43 -1.43 0 CA-C-O 124.944 2.306 . . . . 1.0 116.336 -179.041 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 29.1 m80 -79.98 55.85 2.22 Favored 'General case' 0 N--CA 1.429 -1.502 0 C-N-CA 126.358 1.863 . . . . 1.0 114.144 -172.661 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -144.06 147.37 33.71 Favored 'General case' 0 N--CA 1.43 -1.453 0 C-N-CA 126.112 1.765 . . . . 1.0 110.528 -178.279 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 43.3 t -121.09 151.16 24.1 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.431 0 O-C-N 120.484 -1.385 . . . . 1.0 109.457 -175.372 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 61' ' ' TRP . . . . . 0.422 ' HA ' ' HA ' ' A' ' 70' ' ' HIS . 0.0 OUTLIER -88.77 152.87 21.51 Favored 'General case' 0 N--CA 1.43 -1.461 0 O-C-N 119.65 -1.906 . . . . 1.0 114.533 -178.565 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 80.6 mt -116.17 93.89 4.42 Favored 'General case' 0 N--CA 1.43 -1.444 0 N-CA-C 106.594 -1.632 . . . . 1.0 106.594 162.422 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -92.96 100.18 12.68 Favored 'General case' 0 N--CA 1.43 -1.429 0 CA-C-O 123.26 1.505 . . . . 1.0 109.872 169.016 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 64' ' ' THR . . . . . . . . . . . . . 3.0 m -111.33 -113.51 0.32 Allowed 'General case' 0 N--CA 1.429 -1.509 0 N-CA-C 106.691 -1.596 . . . . 1.0 106.691 -171.909 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 13.3 tmtt? -82.81 -45.59 14.13 Favored 'General case' 0 N--CA 1.43 -1.45 0 O-C-N 119.745 -1.847 . . . . 1.0 111.01 174.452 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 17.5 mp0 -74.59 -27.02 60.3 Favored 'General case' 0 N--CA 1.43 -1.469 0 N-CA-C 116.099 1.888 . . . . 1.0 116.099 -166.475 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 117.48 26.24 2.94 Favored Glycine 0 N--CA 1.43 -1.752 0 N-CA-C 117.133 1.613 . . . . 1.0 117.133 166.074 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 115.51 74.59 0.58 Allowed Glycine 0 N--CA 1.43 -1.752 0 CA-C-N 119.569 1.685 . . . . 1.0 115.735 165.185 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 18.2 m-30 -102.07 116.67 33.18 Favored 'General case' 0 N--CA 1.43 -1.468 0 N-CA-C 106.858 -1.534 . . . . 1.0 106.858 178.299 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 70' ' ' HIS . . . . . 0.422 ' HA ' ' HA ' ' A' ' 61' ' ' TRP . 40.8 p-80 -81.68 157.51 24.59 Favored 'General case' 0 N--CA 1.43 -1.468 0 O-C-N 119.802 -1.811 . . . . 1.0 113.891 -179.33 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -116.09 129.76 56.49 Favored 'General case' 0 N--CA 1.43 -1.45 0 N-CA-C 113.375 0.879 . . . . 1.0 113.375 -176.193 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 7.1 m-20 -112.32 179.39 4.0 Favored 'General case' 0 N--CA 1.431 -1.382 0 N-CA-C 107.28 -1.378 . . . . 1.0 107.28 172.483 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 26.3 tp -113.3 106.93 15.2 Favored 'General case' 0 N--CA 1.43 -1.45 0 O-C-N 119.117 -2.239 . . . . 1.0 112.079 -174.957 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 2.8 ttpm? -70.81 -45.18 65.07 Favored 'General case' 0 N--CA 1.431 -1.421 0 O-C-N 119.647 -1.908 . . . . 1.0 113.3 168.024 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -170.51 -103.06 0.16 Allowed Glycine 0 N--CA 1.43 -1.735 0 O-C-N 120.365 -1.459 . . . . 1.0 112.184 177.996 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 40.7 m-20 -89.74 17.94 6.06 Favored 'General case' 0 N--CA 1.431 -1.42 0 O-C-N 120.676 -1.485 . . . . 1.0 111.623 179.698 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 9.2 tt0 -168.13 137.12 2.42 Favored 'General case' 0 N--CA 1.43 -1.467 0 N-CA-C 102.864 -3.013 . . . . 1.0 102.864 -163.676 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 78' ' ' TRP . . . . . . . . . . . . . 33.0 m95 -88.53 145.83 25.51 Favored 'General case' 0 N--CA 1.43 -1.469 0 CA-C-O 122.195 0.998 . . . . 1.0 108.822 -177.131 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 2.1 tt -114.1 130.79 67.7 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.47 0 C-N-CA 129.394 3.078 . . . . 1.0 104.587 -168.818 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 81.3 m -89.4 146.13 24.87 Favored 'General case' 0 N--CA 1.43 -1.472 0 O-C-N 120.679 -1.263 . . . . 1.0 113.483 -172.674 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 22.0 t70 -45.0 -53.69 7.44 Favored 'General case' 0 N--CA 1.431 -1.383 0 C-N-CA 128.27 2.628 . . . . 1.0 115.871 174.263 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 16.1 ptm180 -149.65 177.43 9.77 Favored 'General case' 0 N--CA 1.43 -1.431 0 O-C-N 120.677 -1.265 . . . . 1.0 110.19 -174.007 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 3.4 t 78.58 -73.47 0.07 Allowed 'General case' 0 N--CA 1.43 -1.439 0 C-N-CA 126.802 2.041 . . . . 1.0 113.026 -175.701 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -170.89 104.1 0.2 Allowed Glycine 0 N--CA 1.43 -1.719 0 N-CA-C 108.845 -1.702 . . . . 1.0 108.845 -176.131 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -63.41 105.26 0.73 Allowed 'General case' 0 N--CA 1.429 -1.513 0 N-CA-C 119.86 3.281 . . . . 1.0 119.86 -166.807 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -173.81 127.01 0.39 Allowed 'General case' 0 N--CA 1.43 -1.472 0 C-N-CA 124.718 1.207 . . . . 1.0 112.604 166.522 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 1.2 t80 -45.53 -89.5 0.0 OUTLIER 'General case' 0 N--CA 1.43 -1.44 0 N-CA-C 119.059 2.985 . . . . 1.0 119.059 178.187 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 88' ' ' TRP . . . . . . . . . . . . . 85.7 m95 -72.38 -26.07 61.75 Favored 'General case' 0 N--CA 1.43 -1.436 0 O-C-N 120.07 -1.644 . . . . 1.0 111.546 -166.702 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 6.8 m-20 -69.87 -45.73 67.07 Favored 'General case' 0 N--CA 1.43 -1.451 0 C-N-CA 125.476 1.51 . . . . 1.0 113.283 177.578 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 35.3 tp -69.66 -41.83 75.0 Favored 'General case' 0 N--CA 1.429 -1.521 0 O-C-N 119.557 -1.964 . . . . 1.0 111.523 176.278 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 33.5 tp -56.21 -40.75 74.53 Favored 'General case' 0 N--CA 1.429 -1.52 0 C-N-CA 124.846 1.258 . . . . 1.0 114.26 169.384 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 42.2 tt0 -55.24 -49.87 70.92 Favored 'General case' 0 N--CA 1.43 -1.461 0 C-N-CA 126.711 2.004 . . . . 1.0 112.021 172.379 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 2.1 mp0 -59.96 -46.88 87.98 Favored 'General case' 0 N--CA 1.43 -1.431 0 O-C-N 120.205 -1.559 . . . . 1.0 114.649 173.773 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -62.87 -42.18 99.67 Favored 'General case' 0 N--CA 1.43 -1.456 0 N-CA-C 115.068 1.507 . . . . 1.0 115.068 177.833 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -80.2 -37.37 33.32 Favored 'General case' 0 N--CA 1.429 -1.497 0 O-C-N 120.268 -1.52 . . . . 1.0 114.043 -179.472 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 23.2 p -58.52 -38.51 77.87 Favored 'General case' 0 N--CA 1.43 -1.452 0 CA-C-N 120.663 1.574 . . . . 1.0 112.335 170.574 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 34.1 tp60 -59.44 -61.58 2.52 Favored 'General case' 0 N--CA 1.429 -1.484 0 C-N-CA 124.837 1.255 . . . . 1.0 113.354 172.425 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 4.4 mm-40 -64.25 -43.4 95.01 Favored 'General case' 0 N--CA 1.429 -1.496 0 N-CA-C 116.145 1.906 . . . . 1.0 116.145 -179.038 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -77.45 -31.82 54.08 Favored 'General case' 0 CA--C 1.489 -1.386 0 O-C-N 120.644 -1.285 . . . . 1.0 113.427 -178.017 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . 98.26 16.63 31.81 Favored Glycine 0 N--CA 1.428 -1.857 0 C-N-CA 124.568 1.08 . . . . 1.0 115.537 169.735 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 16.4 pt-20 -168.05 174.86 7.01 Favored 'General case' 0 N--CA 1.428 -1.562 0 N-CA-C 108.204 -1.036 . . . . 1.0 108.204 -172.403 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 25.8 m -66.35 121.73 15.91 Favored 'General case' 0 N--CA 1.431 -1.385 0 O-C-N 120.645 -1.285 . . . . 1.0 112.569 -177.268 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 4.7 p -97.83 137.14 26.25 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.508 0 N-CA-C 106.046 -1.835 . . . . 1.0 106.046 179.391 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 2.8 t -117.07 78.88 1.26 Allowed 'General case' 0 N--CA 1.431 -1.396 0 O-C-N 121.181 -0.949 . . . . 1.0 112.161 -162.638 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 61.9 m-85 -103.03 -35.55 8.5 Favored 'General case' 0 N--CA 1.429 -1.486 0 O-C-N 120.06 -1.65 . . . . 1.0 110.306 174.458 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 22.6 mtm180 . . . . . 0 C--O 1.259 1.598 0 C-N-CA 123.411 0.685 . . . . 1.0 110.043 -172.597 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 54.7 mtt . . . . . 0 CA--C 1.489 -1.373 0 CA-C-O 121.681 0.753 . . . . 1.0 111.866 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 56.0 m-80 -128.88 160.73 31.7 Favored 'General case' 0 N--CA 1.43 -1.471 0 O-C-N 120.206 -1.559 . . . . 1.0 112.647 -170.407 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 8.3 p-10 -73.48 -29.2 62.37 Favored 'General case' 0 N--CA 1.43 -1.474 0 C-N-CA 125.19 1.396 . . . . 1.0 112.433 175.786 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 48.3 p -58.66 -52.17 66.84 Favored 'General case' 0 N--CA 1.43 -1.459 0 C-N-CA 125.762 1.625 . . . . 1.0 113.151 168.752 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 95.6 mt-10 -54.31 -54.07 45.34 Favored 'General case' 0 N--CA 1.428 -1.555 0 C-N-CA 126.822 2.049 . . . . 1.0 112.573 172.037 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 43.0 t80 -48.69 -46.94 41.14 Favored 'General case' 0 N--CA 1.429 -1.49 0 N-CA-C 115.343 1.609 . . . . 1.0 115.343 172.728 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 18.0 m170 -60.98 -51.54 68.83 Favored 'General case' 0 N--CA 1.43 -1.428 0 N-CA-C 113.838 1.051 . . . . 1.0 113.838 175.884 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 94.7 mtt180 -61.45 -40.61 95.12 Favored 'General case' 0 N--CA 1.429 -1.493 0 O-C-N 120.542 -1.349 . . . . 1.0 113.92 -179.724 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 72.5 mt -64.33 -45.35 88.23 Favored 'General case' 0 N--CA 1.43 -1.469 0 C-N-CA 125.402 1.481 . . . . 1.0 112.795 173.107 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -60.3 -51.04 71.23 Favored 'General case' 0 N--CA 1.43 -1.459 0 C-N-CA 125.898 1.679 . . . . 1.0 113.641 -179.407 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 -56.64 -49.21 75.68 Favored 'General case' 0 N--CA 1.429 -1.487 0 C-N-CA 124.267 1.027 . . . . 1.0 112.207 172.818 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . 0.315 5.9 pt20 -63.82 -44.73 92.38 Favored 'General case' 0 N--CA 1.431 -1.408 0 O-C-N 120.091 -1.631 . . . . 1.0 115.108 178.705 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 4.2 pp -65.34 -36.7 84.84 Favored 'General case' 0 N--CA 1.43 -1.469 0 CA-C-N 121.375 1.898 . . . . 1.0 115.019 -179.011 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 29.6 m0 -54.9 -60.41 3.4 Favored 'General case' 0 N--CA 1.43 -1.461 0 N-CA-C 113.507 0.929 . . . . 1.0 113.507 166.683 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 35.2 mt -63.67 -33.75 76.32 Favored 'General case' 0 N--CA 1.431 -1.413 0 CA-C-N 120.561 1.528 . . . . 1.0 114.593 -178.416 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 86.0 m -54.86 -59.98 3.99 Favored 'General case' 0 N--CA 1.431 -1.416 0 C-N-CA 125.475 1.51 . . . . 1.0 111.98 173.771 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 38.9 mm -62.12 -39.12 82.71 Favored 'Isoleucine or valine' 0 CA--C 1.489 -1.374 0 N-CA-C 114.596 1.332 . . . . 1.0 114.596 176.844 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 95.4 mt-10 -51.55 -52.33 48.05 Favored 'General case' 0 N--CA 1.43 -1.434 0 CA-C-N 121.434 1.925 . . . . 1.0 113.281 171.529 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 2.4 tp10 -65.4 -36.58 84.38 Favored 'General case' 0 N--CA 1.429 -1.489 0 N-CA-C 114.246 1.202 . . . . 1.0 114.246 -179.819 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 49.8 ttt-85 -54.0 -51.03 65.24 Favored 'General case' 0 N--CA 1.43 -1.465 0 O-C-N 120.793 -1.192 . . . . 1.0 113.053 170.521 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -70.07 -45.05 67.85 Favored 'General case' 0 N--CA 1.43 -1.436 0 N-CA-C 113.085 0.772 . . . . 1.0 113.085 178.302 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 34.8 t0 -55.18 -44.56 75.36 Favored 'General case' 0 N--CA 1.43 -1.449 0 C-N-CA 125.122 1.369 . . . . 1.0 114.075 178.987 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 32.1 t70 -71.04 -28.73 64.6 Favored 'General case' 0 N--CA 1.431 -1.409 0 O-C-N 120.052 -1.655 . . . . 1.0 113.472 177.678 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 24' ' ' TRP . . . . . . . . . . . . . 37.3 t-105 -71.28 149.33 46.26 Favored 'General case' 0 N--CA 1.43 -1.462 0 O-C-N 120.063 -1.648 . . . . 1.0 112.897 -177.831 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 6.8 m-20 -151.66 163.02 40.02 Favored 'General case' 0 N--CA 1.429 -1.488 0 N-CA-C 104.002 -2.592 . . . . 1.0 104.002 163.543 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -161.27 -132.6 1.36 Allowed Glycine 0 N--CA 1.43 -1.72 0 O-C-N 120.622 -1.299 . . . . 1.0 111.417 176.565 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -68.3 -32.6 72.86 Favored 'General case' 0 N--CA 1.43 -1.437 0 O-C-N 121.466 -1.02 . . . . 1.0 110.347 171.743 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 79.9 p -112.86 172.48 6.91 Favored 'General case' 0 N--CA 1.43 -1.452 0 C-N-CA 124.347 1.059 . . . . 1.0 111.212 177.046 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 2.9 t70 -96.12 -168.94 1.83 Allowed 'General case' 0 N--CA 1.43 -1.462 0 C-N-CA 124.811 1.244 . . . . 1.0 110.28 179.091 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 7.1 tp -163.37 119.73 0.15 Allowed 'Isoleucine or valine' 0 N--CA 1.43 -1.456 0 O-C-N 120.502 -1.374 . . . . 1.0 110.652 -169.19 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 37.7 t0 -135.84 108.25 7.35 Favored 'General case' 0 N--CA 1.43 -1.432 0 O-C-N 119.86 -1.775 . . . . 1.0 110.533 169.407 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 33.7 t -81.33 143.97 31.83 Favored 'General case' 0 N--CA 1.43 -1.438 0 O-C-N 119.033 -2.292 . . . . 1.0 112.049 173.012 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 33.4 mt-10 -90.16 139.22 30.84 Favored 'General case' 0 N--CA 1.43 -1.445 0 O-C-N 120.403 -1.436 . . . . 1.0 109.13 168.765 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 3.9 mp -126.28 105.68 14.75 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.425 0 N-CA-C 104.853 -2.277 . . . . 1.0 104.853 173.927 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 48.6 t30 -132.75 76.64 1.7 Allowed 'General case' 0 N--CA 1.429 -1.48 0 C-N-CA 124.882 1.273 . . . . 1.0 110.849 -167.171 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . 78.75 -73.15 2.31 Favored Glycine 0 N--CA 1.43 -1.754 0 O-C-N 120.963 -1.086 . . . . 1.0 115.453 167.343 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -142.93 27.53 2.17 Favored Glycine 0 N--CA 1.431 -1.684 0 C-N-CA 124.906 1.241 . . . . 1.0 110.432 172.116 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 76.4 t -125.44 136.22 61.54 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.419 0 C-N-CA 125.313 1.445 . . . . 1.0 107.198 177.216 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 72.7 mt -109.62 136.66 48.63 Favored 'General case' 0 N--CA 1.43 -1.431 0 N-CA-C 107.084 -1.45 . . . . 1.0 107.084 155.684 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -138.55 111.04 7.51 Favored 'General case' 0 N--CA 1.431 -1.393 0 N-CA-C 106.035 -1.839 . . . . 1.0 106.035 178.368 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 67.9 mt -89.74 126.35 42.65 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.432 0 O-C-N 120.32 -1.488 . . . . 1.0 109.684 -171.097 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 28.3 p -119.85 126.35 50.76 Favored 'General case' 0 N--CA 1.43 -1.435 0 CA-C-O 121.728 0.775 . . . . 1.0 113.004 179.896 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 43' ' ' PHE . . . . . . . . . . . . . 1.0 OUTLIER -122.96 170.27 10.3 Favored 'General case' 0 N--CA 1.43 -1.444 0 O-C-N 120.27 -1.519 . . . . 1.0 112.302 169.909 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 4.4 mm-40 -48.41 -36.75 15.38 Favored 'General case' 0 N--CA 1.429 -1.488 0 N-CA-C 118.557 2.799 . . . . 1.0 118.557 -171.439 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 47.1 m-80 -68.86 -6.0 24.52 Favored 'General case' 0 N--CA 1.43 -1.474 0 N-CA-C 115.535 1.68 . . . . 1.0 115.535 179.716 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 80.24 30.54 41.27 Favored Glycine 0 N--CA 1.43 -1.757 0 O-C-N 120.579 -1.325 . . . . 1.0 112.791 172.142 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 51.0 m -127.12 149.52 49.91 Favored 'General case' 0 N--CA 1.43 -1.46 0 N-CA-C 105.168 -2.16 . . . . 1.0 105.168 -177.571 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 22.8 pttm -140.53 159.07 43.0 Favored 'General case' 0 N--CA 1.431 -1.404 0 N-CA-C 113.826 1.047 . . . . 1.0 113.826 -165.136 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 12.7 mm -110.61 138.56 38.1 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.471 0 N-CA-C 106.195 -1.78 . . . . 1.0 106.195 177.1 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 5.5 mm -120.77 114.91 45.3 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.414 0 CA-C-N 119.937 1.244 . . . . 1.0 110.787 -173.562 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER -125.68 89.26 1.39 Allowed 'Isoleucine or valine' 0 N--CA 1.43 -1.459 0 C-N-CA 126.187 1.795 . . . . 1.0 110.468 -172.565 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 51.3 m-20 -114.25 161.74 17.46 Favored 'General case' 0 N--CA 1.43 -1.448 0 C-N-CA 128.725 2.81 . . . . 1.0 110.239 178.545 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -154.31 151.54 29.22 Favored 'General case' 0 N--CA 1.43 -1.455 0 O-C-N 119.91 -1.744 . . . . 1.0 112.319 -168.666 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -100.33 144.17 29.65 Favored 'General case' 0 N--CA 1.43 -1.433 0 CA-C-O 123.426 1.584 . . . . 1.0 108.192 174.977 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 54.3 mt-10 -70.75 -63.55 1.56 Allowed Pre-proline 0 N--CA 1.431 -1.418 0 CA-C-O 116.034 -1.936 . . . . 1.0 114.479 172.163 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 87.3 Cg_endo -78.85 157.9 27.58 Favored 'Trans proline' 0 C--N 1.3 -1.984 0 CA-C-N 126.135 3.227 . . . . 1.0 112.622 169.959 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . 0.409 5.1 mp 72.18 134.94 0.04 OUTLIER 'General case' 0 N--CA 1.43 -1.456 0 C-N-CA 127.266 2.226 . . . . 1.0 113.588 -165.616 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 17.5 m170 -83.8 50.77 1.88 Allowed 'General case' 0 N--CA 1.431 -1.411 0 O-C-N 120.668 -1.27 . . . . 1.0 112.853 -172.596 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -152.28 158.95 43.51 Favored 'General case' 0 N--CA 1.43 -1.428 0 O-C-N 120.382 -1.449 . . . . 1.0 109.43 -178.401 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 38.2 t -126.5 161.63 32.28 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.438 0 C-N-CA 125.528 1.531 . . . . 1.0 108.55 -169.182 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 61' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -93.52 154.78 17.7 Favored 'General case' 0 N--CA 1.431 -1.413 0 O-C-N 118.792 -2.443 . . . . 1.0 111.028 177.3 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -142.5 101.41 3.88 Favored 'General case' 0 N--CA 1.431 -1.409 0 O-C-N 118.362 -2.711 . . . . 1.0 112.687 169.55 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -112.22 149.62 32.03 Favored 'General case' 0 N--CA 1.43 -1.467 0 O-C-N 119.494 -2.003 . . . . 1.0 114.61 174.313 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 64' ' ' THR . . . . . . . . . . . . . 95.1 m -151.89 -87.12 0.07 Allowed 'General case' 0 N--CA 1.43 -1.436 0 C-N-CA 126.186 1.794 . . . . 1.0 109.977 -179.891 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -131.23 -54.77 1.04 Allowed 'General case' 0 N--CA 1.43 -1.445 0 O-C-N 121.139 -0.976 . . . . 1.0 113.184 -170.556 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 58.8 mt-30 -71.08 -24.75 62.38 Favored 'General case' 0 N--CA 1.431 -1.418 0 N-CA-C 114.639 1.348 . . . . 1.0 114.639 -171.003 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 177.09 -40.42 0.1 OUTLIER Glycine 0 N--CA 1.429 -1.811 0 C-N-CA 117.753 -2.165 . . . . 1.0 115.588 174.207 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 98.8 106.62 2.65 Favored Glycine 0 N--CA 1.43 -1.745 0 CA-C-O 122.557 1.087 . . . . 1.0 111.978 -173.96 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 69' ' ' TYR . . . . . 0.415 ' CD1' ' HG3' ' A' ' 82' ' ' ARG . 14.8 m-85 -128.5 135.77 49.89 Favored 'General case' 0 N--CA 1.43 -1.459 0 N-CA-C 105.802 -1.925 . . . . 1.0 105.802 -167.939 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 70' ' ' HIS . . . . . 0.466 ' HE1' ' OD2' ' A' ' 81' ' ' ASP . 27.2 p80 -83.42 159.8 21.71 Favored 'General case' 0 N--CA 1.43 -1.467 0 O-C-N 119.826 -1.796 . . . . 1.0 112.881 179.905 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 71' ' ' PHE . . . . . . . . . . . . 0.321 24.5 t80 -117.9 112.46 20.37 Favored 'General case' 0 N--CA 1.43 -1.428 0 C-N-CA 127.653 2.381 . . . . 1.0 105.185 -156.875 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -126.45 165.55 18.88 Favored 'General case' 0 N--CA 1.431 -1.394 0 N-CA-C 107.574 -1.269 . . . . 1.0 107.574 -169.689 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 51.4 tp -112.06 124.81 53.21 Favored 'General case' 0 N--CA 1.43 -1.451 0 O-C-N 119.528 -1.982 . . . . 1.0 110.434 -169.963 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 6.2 tmtt? -74.64 -58.73 3.1 Favored 'General case' 0 N--CA 1.429 -1.478 0 O-C-N 121.322 -0.861 . . . . 1.0 109.599 162.277 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -179.3 -61.65 0.07 OUTLIER Glycine 0 N--CA 1.43 -1.716 0 O-C-N 121.098 -1.001 . . . . 1.0 111.551 179.033 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 24.1 t0 -99.32 -18.21 17.66 Favored 'General case' 0 N--CA 1.43 -1.425 0 C-N-CA 126.108 1.763 . . . . 1.0 110.141 179.075 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 1.1 tp10 -130.09 128.43 41.86 Favored 'General case' 0 N--CA 1.431 -1.415 0 N-CA-C 103.377 -2.823 . . . . 1.0 103.377 -170.711 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 78' ' ' TRP . . . . . . . . . . . . . 91.7 m95 -77.47 129.55 35.87 Favored 'General case' 0 N--CA 1.429 -1.481 0 N-CA-C 105.364 -2.088 . . . . 1.0 105.364 162.498 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -131.34 153.24 38.65 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.377 0 O-C-N 119.976 -1.703 . . . . 1.0 106.865 -173.876 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 5.2 m -80.55 132.37 35.65 Favored 'General case' 0 N--CA 1.429 -1.488 0 O-C-N 119.873 -1.767 . . . . 1.0 112.922 -172.378 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 81' ' ' ASP . . . . . 0.466 ' OD2' ' HE1' ' A' ' 70' ' ' HIS . 24.0 t70 -86.61 62.8 7.63 Favored 'General case' 0 N--CA 1.431 -1.42 0 O-C-N 118.928 -2.357 . . . . 1.0 110.932 177.32 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 82' ' ' ARG . . . . . 0.415 ' HG3' ' CD1' ' A' ' 69' ' ' TYR . 0.2 OUTLIER -155.71 -135.73 0.05 OUTLIER 'General case' 0 N--CA 1.43 -1.441 0 O-C-N 120.608 -1.307 . . . . 1.0 111.858 -176.027 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 35.1 p -86.0 -12.44 50.32 Favored 'General case' 0 N--CA 1.428 -1.551 0 O-C-N 119.347 -2.096 . . . . 1.0 113.887 -170.524 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -161.93 92.32 0.11 Allowed Glycine 0 N--CA 1.429 -1.768 0 O-C-N 120.684 -1.26 . . . . 1.0 113.331 -177.534 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 8.2 pt-20 -77.55 113.41 15.35 Favored 'General case' 0 N--CA 1.431 -1.398 0 N-CA-C 119.014 2.968 . . . . 1.0 119.014 -169.845 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 86.1 m -174.46 125.25 0.31 Allowed 'General case' 0 N--CA 1.431 -1.422 0 C-N-CA 126.315 1.846 . . . . 1.0 110.574 161.775 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 2.0 t80 -52.77 -84.21 0.01 OUTLIER 'General case' 0 N--CA 1.429 -1.508 0 N-CA-C 115.378 1.621 . . . . 1.0 115.378 170.265 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 88' ' ' TRP . . . . . . . . . . . . . 56.0 m95 -58.95 -29.43 67.15 Favored 'General case' 0 N--CA 1.43 -1.445 0 N-CA-C 116.283 1.957 . . . . 1.0 116.283 -166.1 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 24.0 m-20 -76.99 -41.35 43.25 Favored 'General case' 0 N--CA 1.429 -1.479 0 C-N-CA 124.489 1.116 . . . . 1.0 112.254 175.668 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 41.9 tp -69.65 -43.23 73.03 Favored 'General case' 0 N--CA 1.43 -1.425 0 O-C-N 119.521 -1.987 . . . . 1.0 111.88 176.249 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 2.6 tm? -48.38 -50.69 29.71 Favored 'General case' 0 N--CA 1.43 -1.471 0 C-N-CA 128.941 2.896 . . . . 1.0 113.08 172.608 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 37.5 tt0 -51.66 -54.44 27.96 Favored 'General case' 0 N--CA 1.431 -1.423 0 C-N-CA 125.823 1.649 . . . . 1.0 114.547 166.852 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 4.1 tt0 -58.5 -44.73 89.54 Favored 'General case' 0 N--CA 1.43 -1.471 0 N-CA-C 114.372 1.249 . . . . 1.0 114.372 179.929 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -58.75 -48.49 81.03 Favored 'General case' 0 N--CA 1.431 -1.412 0 C-N-CA 127.53 2.332 . . . . 1.0 113.554 174.895 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -64.89 -46.56 81.24 Favored 'General case' 0 N--CA 1.429 -1.483 0 O-C-N 119.426 -2.046 . . . . 1.0 113.131 176.191 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 96.5 m -53.61 -48.89 68.87 Favored 'General case' 0 N--CA 1.431 -1.409 0 C-N-CA 127.224 2.21 . . . . 1.0 114.176 174.037 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 2.1 pt20 -70.18 -28.02 64.98 Favored 'General case' 0 N--CA 1.43 -1.45 0 O-C-N 121.061 -1.025 . . . . 1.0 113.607 -178.911 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 15.7 mm-40 -75.91 -39.02 57.13 Favored 'General case' 0 N--CA 1.43 -1.459 0 N-CA-C 114.309 1.226 . . . . 1.0 114.309 171.988 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -85.85 -46.58 10.49 Favored 'General case' 0 N--CA 1.43 -1.461 0 O-C-N 120.229 -1.545 . . . . 1.0 114.963 -176.436 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . 91.28 43.25 4.7 Favored Glycine 0 N--CA 1.43 -1.745 0 O-C-N 120.418 -1.426 . . . . 1.0 112.55 -170.825 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 18.6 tt0 -170.04 145.75 2.93 Favored 'General case' 0 N--CA 1.43 -1.455 0 N-CA-C 103.712 -2.699 . . . . 1.0 103.712 -172.865 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 13.4 m -74.49 99.95 3.72 Favored 'General case' 0 N--CA 1.429 -1.484 0 CA-C-N 121.792 2.087 . . . . 1.0 111.033 179.282 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 12.2 t -95.36 84.1 1.55 Allowed 'Isoleucine or valine' 0 N--CA 1.432 -1.362 0 CA-C-O 124.231 1.967 . . . . 1.0 107.953 178.769 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 8.2 t -92.36 177.07 6.25 Favored 'General case' 0 N--CA 1.43 -1.438 0 C-N-CA 125.718 1.607 . . . . 1.0 112.695 -168.259 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 30.8 t80 -138.58 -29.32 0.8 Allowed 'General case' 0 N--CA 1.43 -1.434 0 O-C-N 120.83 -1.169 . . . . 1.0 111.04 156.83 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 89.1 mtt180 . . . . . 0 C--O 1.26 1.634 0 O-C-N 120.368 -1.457 . . . . 1.0 110.437 179.27 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 26.4 mmt . . . . . 0 CA--C 1.49 -1.341 0 N-CA-C 113.682 0.994 . . . . 1.0 113.682 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 91.9 m-20 -118.24 57.95 0.83 Allowed 'General case' 0 N--CA 1.431 -1.416 0 O-C-N 120.766 -1.209 . . . . 1.0 109.995 -178.377 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 22.5 m-20 -65.78 -39.16 90.72 Favored 'General case' 0 N--CA 1.429 -1.477 0 C-N-CA 125.272 1.429 . . . . 1.0 113.581 179.131 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 8.6 t -65.07 -43.29 92.7 Favored 'General case' 0 N--CA 1.43 -1.473 0 O-C-N 120.951 -1.093 . . . . 1.0 111.786 -178.854 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 14.0 mt-10 -58.36 -60.83 3.16 Favored 'General case' 0 N--CA 1.429 -1.483 0 C-N-CA 124.694 1.197 . . . . 1.0 112.364 171.148 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 1.1 t80 -53.26 -38.48 63.06 Favored 'General case' 0 N--CA 1.43 -1.425 0 N-CA-C 115.911 1.819 . . . . 1.0 115.911 179.229 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 2.5 m-70 -61.18 -50.56 72.66 Favored 'General case' 0 N--CA 1.43 -1.439 0 N-CA-C 115.524 1.676 . . . . 1.0 115.524 170.224 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 23.1 ttm180 -67.81 -45.38 74.91 Favored 'General case' 0 N--CA 1.43 -1.47 0 C-N-CA 124.17 0.988 . . . . 1.0 112.207 -176.106 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 83.4 mt -55.26 -45.59 76.12 Favored 'General case' 0 N--CA 1.43 -1.464 0 C-N-CA 126.507 1.923 . . . . 1.0 113.611 172.367 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -56.84 -55.49 33.77 Favored 'General case' 0 N--CA 1.43 -1.467 0 C-N-CA 125.27 1.428 . . . . 1.0 113.152 173.949 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -56.3 -43.53 79.01 Favored 'General case' 0 N--CA 1.431 -1.415 0 C-N-CA 124.228 1.011 . . . . 1.0 112.617 -176.05 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 28.3 mm100 -63.4 -53.86 45.76 Favored 'General case' 0 N--CA 1.43 -1.441 0 N-CA-C 115.165 1.542 . . . . 1.0 115.165 173.846 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 2.4 pp -65.2 -47.18 77.79 Favored 'General case' 0 N--CA 1.43 -1.443 0 O-C-N 120.387 -1.446 . . . . 1.0 114.272 -177.697 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 39.8 m0 -52.87 -50.04 64.61 Favored 'General case' 0 N--CA 1.43 -1.468 0 C-N-CA 126.953 2.101 . . . . 1.0 113.447 174.256 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 44.0 tp -60.79 -49.34 77.87 Favored 'General case' 0 N--CA 1.429 -1.517 0 C-N-CA 123.651 0.78 . . . . 1.0 112.719 177.49 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 36.5 m -59.11 -53.15 61.63 Favored 'General case' 0 N--CA 1.431 -1.398 0 C-N-CA 125.818 1.647 . . . . 1.0 113.276 -178.676 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 78.8 mt -57.64 -54.1 35.87 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.464 0 C-N-CA 125.839 1.656 . . . . 1.0 114.169 174.989 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 31.8 tt0 -60.18 -48.42 81.82 Favored 'General case' 0 N--CA 1.429 -1.496 0 CA-C-N 120.072 1.306 . . . . 1.0 113.117 -177.774 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 42.9 tt0 -57.85 -48.57 79.41 Favored 'General case' 0 N--CA 1.429 -1.511 0 C-N-CA 125.102 1.361 . . . . 1.0 114.164 178.144 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -71.15 -29.64 65.48 Favored 'General case' 0 N--CA 1.43 -1.456 0 N-CA-C 113.056 0.761 . . . . 1.0 113.056 -177.548 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 5.3 tp -67.14 -50.92 59.59 Favored 'General case' 0 N--CA 1.43 -1.446 0 O-C-N 120.919 -1.113 . . . . 1.0 112.597 171.393 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 11.3 t70 -62.31 -36.42 82.1 Favored 'General case' 0 N--CA 1.429 -1.507 0 O-C-N 121.023 -1.048 . . . . 1.0 112.889 -177.425 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 21.2 t0 -90.81 21.89 3.88 Favored 'General case' 0 N--CA 1.43 -1.438 0 O-C-N 120.486 -1.384 . . . . 1.0 113.847 177.515 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 24' ' ' TRP . . . . . . . . . . . . . 47.0 t-105 -84.56 -59.7 2.29 Favored 'General case' 0 N--CA 1.43 -1.452 0 O-C-N 119.025 -2.297 . . . . 1.0 113.691 -179.445 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 7.0 t70 67.03 -132.0 0.14 Allowed 'General case' 0 N--CA 1.43 -1.453 0 C-N-CA 126.784 2.034 . . . . 1.0 112.603 -176.32 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 93.1 -138.38 14.09 Favored Glycine 0 N--CA 1.43 -1.709 0 O-C-N 120.737 -1.227 . . . . 1.0 112.691 176.116 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -82.23 -26.27 33.4 Favored 'General case' 0 N--CA 1.429 -1.489 0 O-C-N 120.592 -1.534 . . . . 1.0 109.79 172.589 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 4.4 p -75.36 144.27 42.4 Favored 'General case' 0 N--CA 1.429 -1.498 0 C-N-CA 126.506 1.923 . . . . 1.0 114.434 174.642 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 13.8 t70 -104.36 138.43 40.8 Favored 'General case' 0 N--CA 1.43 -1.469 0 N-CA-C 104.137 -2.542 . . . . 1.0 104.137 162.925 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -146.15 115.48 1.47 Allowed 'Isoleucine or valine' 0 N--CA 1.429 -1.481 0 CA-C-O 122.84 1.305 . . . . 1.0 108.62 -157.653 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 13.8 m-20 -126.47 143.3 51.24 Favored 'General case' 0 N--CA 1.429 -1.493 0 C-N-CA 124.103 0.961 . . . . 1.0 109.291 168.625 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 17.8 t -109.67 149.9 29.05 Favored 'General case' 0 N--CA 1.43 -1.432 0 O-C-N 119.832 -1.793 . . . . 1.0 108.203 164.627 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 17.2 mt-10 -113.65 142.39 46.06 Favored 'General case' 0 N--CA 1.429 -1.511 0 O-C-N 120.829 -1.169 . . . . 1.0 108.113 176.822 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 3.3 tp -122.47 110.34 26.62 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.484 0 CA-C-O 124.086 1.898 . . . . 1.0 107.259 -178.099 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 48.3 m-80 -108.95 73.75 0.87 Allowed 'General case' 0 N--CA 1.431 -1.396 0 CA-C-N 114.477 -1.238 . . . . 1.0 109.088 176.677 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . 73.35 -7.65 11.3 Favored Glycine 0 N--CA 1.43 -1.761 0 N-CA-C 117.618 1.807 . . . . 1.0 117.618 171.503 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 151.91 -33.7 0.87 Allowed Glycine 0 N--CA 1.43 -1.764 0 N-CA-C 109.127 -1.589 . . . . 1.0 109.127 -168.734 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 64.7 t -79.27 105.94 9.47 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.43 0 O-C-N 120.397 -1.649 . . . . 1.0 109.595 175.5 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 18.5 mt -94.8 129.16 41.87 Favored 'General case' 0 N--CA 1.43 -1.464 0 CA-C-O 123.074 1.416 . . . . 1.0 110.206 175.667 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 18.6 p -126.52 121.89 33.61 Favored 'General case' 0 N--CA 1.43 -1.455 0 N-CA-C 107.358 -1.349 . . . . 1.0 107.358 -179.713 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 74.2 mt -97.2 122.28 48.59 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.479 0 C-N-CA 124.721 1.208 . . . . 1.0 109.32 -169.866 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 21.8 p -123.74 108.38 12.46 Favored 'General case' 0 N--CA 1.431 -1.396 0 N-CA-C 114.863 1.431 . . . . 1.0 114.863 -171.55 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 43' ' ' PHE . . . . . . . . . . . . . 9.0 p90 -114.55 164.86 13.42 Favored 'General case' 0 N--CA 1.429 -1.49 0 O-C-N 119.633 -1.917 . . . . 1.0 113.894 178.75 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -61.76 -20.18 63.27 Favored 'General case' 0 N--CA 1.43 -1.442 0 C-N-CA 128.77 2.828 . . . . 1.0 118.371 -166.779 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 22.5 t30 -66.69 -15.08 63.26 Favored 'General case' 0 N--CA 1.429 -1.491 0 C-N-CA 124.674 1.19 . . . . 1.0 113.618 173.583 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 101.48 -5.25 54.72 Favored Glycine 0 N--CA 1.431 -1.686 0 O-C-N 120.508 -1.37 . . . . 1.0 113.066 171.197 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 70.0 m -93.73 159.28 15.28 Favored 'General case' 0 N--CA 1.43 -1.425 0 O-C-N 121.467 -1.02 . . . . 1.0 111.33 178.493 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 24.0 pttm -142.29 140.08 32.08 Favored 'General case' 0 N--CA 1.429 -1.497 0 O-C-N 121.526 -0.734 . . . . 1.0 111.566 -178.784 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -108.45 143.95 17.88 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.453 0 C-N-CA 126.701 2.0 . . . . 1.0 107.572 179.549 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 9.7 mm -126.38 122.43 61.21 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.458 0 C-N-CA 124.227 1.011 . . . . 1.0 110.816 -163.33 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 3.7 mt -124.61 108.18 19.79 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.428 0 CA-C-O 123.328 1.537 . . . . 1.0 112.874 -179.77 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 52' ' ' ASN . . . . . 0.476 ' H ' ' HD1' ' A' ' 61' ' ' TRP . 29.1 m-80 -120.44 160.63 22.73 Favored 'General case' 0 N--CA 1.429 -1.481 0 C-N-CA 128.224 2.61 . . . . 1.0 108.445 173.497 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 10.3 ptt180 -141.68 140.21 33.15 Favored 'General case' 0 N--CA 1.43 -1.453 0 C-N-CA 124.713 1.205 . . . . 1.0 111.737 174.083 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 24.6 mm100 -110.02 114.46 28.01 Favored 'General case' 0 N--CA 1.431 -1.406 0 C-N-CA 126.004 1.722 . . . . 1.0 108.522 174.558 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 54.8 mt-10 -48.09 -47.48 65.37 Favored Pre-proline 0 N--CA 1.431 -1.414 0 N-CA-C 119.479 3.14 . . . . 1.0 119.479 -175.548 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 50.9 Cg_exo -73.01 -11.41 25.4 Favored 'Trans proline' 0 N--CA 1.434 -2.021 0 CA-C-N 126.022 3.186 . . . . 1.0 114.829 -175.468 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 38.5 mt -84.18 -39.67 19.09 Favored 'General case' 0 N--CA 1.43 -1.443 0 CA-C-N 119.269 0.941 . . . . 1.0 111.191 -174.977 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 19.8 m80 71.33 23.73 3.91 Favored 'General case' 0 CA--C 1.488 -1.433 0 C-N-CA 125.448 1.499 . . . . 1.0 113.866 -179.423 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 1.7 pt20 -131.32 156.58 45.24 Favored 'General case' 0 N--CA 1.429 -1.483 0 C-N-CA 127.898 2.479 . . . . 1.0 106.072 172.903 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 48.0 t -116.41 158.19 16.98 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.43 0 O-C-N 121.185 -0.947 . . . . 1.0 108.687 -171.732 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 61' ' ' TRP . . . . . 0.476 ' HD1' ' H ' ' A' ' 52' ' ' ASN . 0.0 OUTLIER -101.67 152.55 20.7 Favored 'General case' 0 N--CA 1.43 -1.436 0 O-C-N 119.831 -1.793 . . . . 1.0 114.194 176.018 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 93.7 mt -125.83 97.99 5.36 Favored 'General case' 0 N--CA 1.428 -1.55 0 C-N-CA 125.957 1.703 . . . . 1.0 109.056 164.71 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -94.49 141.75 28.23 Favored 'General case' 0 N--CA 1.43 -1.44 0 O-C-N 120.285 -1.509 . . . . 1.0 110.478 167.451 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 64' ' ' THR . . . . . . . . . . . . . 74.5 p -142.49 -119.71 0.1 Allowed 'General case' 0 N--CA 1.43 -1.452 0 C-N-CA 124.79 1.236 . . . . 1.0 108.223 -165.43 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 3.5 tmtt? -101.53 -40.83 6.85 Favored 'General case' 0 N--CA 1.431 -1.419 0 O-C-N 120.503 -1.373 . . . . 1.0 109.717 170.134 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 51.2 tt0 -74.22 -25.93 59.95 Favored 'General case' 0 N--CA 1.429 -1.484 0 N-CA-C 116.863 2.171 . . . . 1.0 116.863 -164.101 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 157.7 -34.99 0.54 Allowed Glycine 0 N--CA 1.43 -1.728 0 O-C-N 119.585 -1.947 . . . . 1.0 115.65 175.501 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 117.17 115.05 2.76 Favored Glycine 0 N--CA 1.429 -1.775 0 C-N-CA 125.625 1.583 . . . . 1.0 112.806 -179.19 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -104.34 142.81 33.9 Favored 'General case' 0 N--CA 1.43 -1.445 0 C-N-CA 125.498 1.519 . . . . 1.0 106.963 175.444 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 3.4 p-80 -109.25 152.79 24.74 Favored 'General case' 0 N--CA 1.43 -1.438 0 O-C-N 119.082 -2.262 . . . . 1.0 110.545 165.68 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 48.8 p90 -129.77 131.37 46.21 Favored 'General case' 0 N--CA 1.43 -1.472 0 N-CA-C 113.975 1.102 . . . . 1.0 113.975 -166.068 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 32.7 m-20 -110.01 169.7 8.55 Favored 'General case' 0 N--CA 1.429 -1.49 0 C-N-CA 126.356 1.863 . . . . 1.0 109.21 -176.197 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 50.9 tp -115.97 114.22 24.32 Favored 'General case' 0 N--CA 1.43 -1.447 0 O-C-N 119.984 -1.698 . . . . 1.0 110.584 -178.164 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 18.5 mttm -71.05 -60.21 2.36 Favored 'General case' 0 N--CA 1.431 -1.408 0 O-C-N 120.124 -1.61 . . . . 1.0 112.984 164.729 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -171.56 -73.65 0.04 OUTLIER Glycine 0 N--CA 1.429 -1.775 0 O-C-N 120.622 -1.299 . . . . 1.0 113.518 -179.38 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 4.2 t70 -107.34 26.98 9.54 Favored 'General case' 0 N--CA 1.43 -1.45 0 CA-C-O 123.141 1.448 . . . . 1.0 107.831 174.615 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 1.7 pm0 -161.19 116.71 2.14 Favored 'General case' 0 N--CA 1.43 -1.427 0 N-CA-C 105.205 -2.146 . . . . 1.0 105.205 -168.949 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 78' ' ' TRP . . . . . . . . . . . . . 97.0 m95 -80.95 130.51 35.06 Favored 'General case' 0 N--CA 1.429 -1.505 0 N-CA-C 105.011 -2.218 . . . . 1.0 105.011 162.206 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -126.36 135.32 64.14 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.482 0 O-C-N 119.529 -1.982 . . . . 1.0 108.041 -171.325 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 30.1 m -84.38 122.14 28.52 Favored 'General case' 0 N--CA 1.43 -1.46 0 O-C-N 120.05 -1.656 . . . . 1.0 114.553 -171.275 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 13.2 t70 -84.86 55.21 3.36 Favored 'General case' 0 N--CA 1.429 -1.489 0 O-C-N 119.757 -1.84 . . . . 1.0 112.608 -177.228 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 1.1 tmt_? -148.38 81.7 1.47 Allowed 'General case' 0 N--CA 1.43 -1.428 0 O-C-N 120.36 -1.463 . . . . 1.0 107.347 179.884 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 83' ' ' SER . . . . . . . . . . . . 0.268 16.3 m 79.23 -44.69 0.34 Allowed 'General case' 0 N--CA 1.429 -1.488 0 C-N-CA 127.397 2.279 . . . . 1.0 116.754 175.117 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -159.48 103.19 0.22 Allowed Glycine 0 N--CA 1.431 -1.693 0 N-CA-C 109.128 -1.589 . . . . 1.0 109.128 -167.063 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 1.8 pm0 -87.43 105.97 17.65 Favored 'General case' 0 N--CA 1.429 -1.521 0 N-CA-C 119.424 3.12 . . . . 1.0 119.424 -153.421 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 7.3 m -160.74 122.53 3.08 Favored 'General case' 0 N--CA 1.43 -1.434 0 O-C-N 118.8 -2.438 . . . . 1.0 112.34 174.823 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 41.5 t80 -63.35 -80.17 0.03 OUTLIER 'General case' 0 N--CA 1.43 -1.46 0 N-CA-C 117.254 2.316 . . . . 1.0 117.254 -176.614 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 88' ' ' TRP . . . . . . . . . . . . . 72.6 m95 -63.21 -24.46 67.89 Favored 'General case' 0 N--CA 1.43 -1.432 0 O-C-N 120.442 -1.411 . . . . 1.0 113.892 -169.809 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 1.3 t70 -79.37 -42.76 24.86 Favored 'General case' 0 N--CA 1.428 -1.531 0 C-N-CA 125.87 1.668 . . . . 1.0 113.049 178.568 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 38.5 tp -69.49 -40.2 77.19 Favored 'General case' 0 N--CA 1.431 -1.417 0 O-C-N 119.137 -2.227 . . . . 1.0 111.135 175.514 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 21.4 tp -51.37 -41.4 60.62 Favored 'General case' 0 N--CA 1.43 -1.434 0 C-N-CA 126.926 2.09 . . . . 1.0 114.85 168.049 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 2.0 tm-20 -61.33 -46.42 90.32 Favored 'General case' 0 N--CA 1.43 -1.426 0 C-N-CA 125.627 1.571 . . . . 1.0 113.31 171.085 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 15.4 tt0 -60.96 -46.04 92.31 Favored 'General case' 0 N--CA 1.429 -1.477 0 O-C-N 120.785 -1.197 . . . . 1.0 113.09 176.209 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -58.16 -36.99 73.82 Favored 'General case' 0 N--CA 1.43 -1.425 0 C-N-CA 127.001 2.12 . . . . 1.0 114.703 172.101 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -75.31 -41.34 57.14 Favored 'General case' 0 N--CA 1.428 -1.542 0 O-C-N 119.787 -1.821 . . . . 1.0 113.09 178.42 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 29.8 m -58.23 -28.5 64.92 Favored 'General case' 0 N--CA 1.429 -1.509 0 C-N-CA 126.809 2.044 . . . . 1.0 112.954 169.912 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -69.94 -55.93 8.37 Favored 'General case' 0 N--CA 1.431 -1.413 0 C-N-CA 127.706 2.402 . . . . 1.0 111.891 171.672 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 47.5 mt-30 -75.14 -40.47 59.64 Favored 'General case' 0 N--CA 1.43 -1.453 0 N-CA-C 115.829 1.788 . . . . 1.0 115.829 -175.868 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -81.24 -36.02 30.48 Favored 'General case' 0 N--CA 1.431 -1.402 0 O-C-N 120.376 -1.453 . . . . 1.0 112.619 -179.241 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . 79.44 36.0 27.89 Favored Glycine 0 N--CA 1.429 -1.824 0 O-C-N 120.972 -1.08 . . . . 1.0 111.782 -173.551 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 19.4 tt0 -170.79 145.98 2.52 Favored 'General case' 0 N--CA 1.429 -1.496 0 N-CA-C 103.93 -2.619 . . . . 1.0 103.93 -168.911 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 57.4 m -72.25 97.12 1.93 Allowed 'General case' 0 N--CA 1.429 -1.476 0 CA-C-N 120.851 1.66 . . . . 1.0 111.883 178.957 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 85.6 t -95.91 106.7 18.65 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.434 0 N-CA-C 106.314 -1.735 . . . . 1.0 106.314 171.802 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 35.6 p -132.24 136.89 47.3 Favored 'General case' 0 N--CA 1.429 -1.497 0 C-N-CA 124.171 0.988 . . . . 1.0 109.995 -171.862 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 37.2 m-85 -93.68 -10.35 34.75 Favored 'General case' 0 N--CA 1.43 -1.429 0 C-N-CA 124.265 1.026 . . . . 1.0 112.129 178.904 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 9.7 mmm180 . . . . . 0 C--O 1.26 1.63 0 C-N-CA 124.489 1.116 . . . . 1.0 109.332 177.582 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 26.5 mmt . . . . . 0 CA--C 1.49 -1.361 0 CA-C-O 121.369 0.604 . . . . 1.0 110.964 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 7.1 p30 -93.27 -51.21 5.11 Favored 'General case' 0 N--CA 1.43 -1.458 0 O-C-N 120.185 -1.572 . . . . 1.0 113.842 -170.172 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 35.3 t70 -55.92 -40.08 72.59 Favored 'General case' 0 N--CA 1.429 -1.479 0 C-N-CA 127.125 2.17 . . . . 1.0 113.46 -178.543 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 5.2 p -68.49 -37.94 80.55 Favored 'General case' 0 N--CA 1.43 -1.467 0 C-N-CA 126.274 1.83 . . . . 1.0 114.359 174.972 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 14.2 tp10 -67.74 -53.06 30.44 Favored 'General case' 0 N--CA 1.43 -1.435 0 C-N-CA 125.226 1.41 . . . . 1.0 110.115 177.925 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 16.3 t80 -47.25 -50.94 20.17 Favored 'General case' 0 N--CA 1.431 -1.425 0 C-N-CA 127.425 2.29 . . . . 1.0 114.821 169.657 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 35.2 m-70 -63.97 -41.43 97.56 Favored 'General case' 0 N--CA 1.43 -1.452 0 N-CA-C 114.907 1.447 . . . . 1.0 114.907 177.989 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -70.76 -37.19 73.38 Favored 'General case' 0 N--CA 1.43 -1.435 0 O-C-N 120.366 -1.459 . . . . 1.0 114.074 178.887 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 79.7 mt -59.58 -51.55 69.37 Favored 'General case' 0 N--CA 1.43 -1.444 0 C-N-CA 124.99 1.316 . . . . 1.0 111.747 168.239 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -54.06 -50.34 66.95 Favored 'General case' 0 N--CA 1.431 -1.416 0 C-N-CA 125.011 1.324 . . . . 1.0 113.458 176.991 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -51.58 -49.71 61.57 Favored 'General case' 0 N--CA 1.43 -1.425 0 N-CA-C 114.783 1.401 . . . . 1.0 114.783 173.136 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 12.2 pt20 -68.9 -33.27 73.49 Favored 'General case' 0 N--CA 1.43 -1.433 0 N-CA-C 115.583 1.697 . . . . 1.0 115.583 179.764 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 84.8 mt -66.74 -59.07 3.89 Favored 'General case' 0 N--CA 1.431 -1.419 0 O-C-N 120.087 -1.633 . . . . 1.0 111.02 174.753 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 1.2 m-90 -50.3 -50.11 51.58 Favored 'General case' 0 N--CA 1.429 -1.487 0 C-N-CA 125.65 1.58 . . . . 1.0 113.27 -179.565 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 41.0 tp -61.85 -59.05 5.71 Favored 'General case' 0 N--CA 1.43 -1.447 0 N-CA-C 113.626 0.973 . . . . 1.0 113.626 175.775 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 59.6 m -64.88 -37.42 87.58 Favored 'General case' 0 N--CA 1.431 -1.4 0 N-CA-C 114.252 1.204 . . . . 1.0 114.252 -173.621 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 93.5 mt -64.63 -54.24 32.7 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.458 0 C-N-CA 124.923 1.289 . . . . 1.0 111.686 174.83 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 1.7 tt0 -55.48 -49.66 71.94 Favored 'General case' 0 N--CA 1.43 -1.473 0 C-N-CA 123.984 0.914 . . . . 1.0 113.386 178.565 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 44.4 tt0 -54.65 -49.1 71.38 Favored 'General case' 0 N--CA 1.429 -1.493 0 C-N-CA 125.966 1.706 . . . . 1.0 114.025 174.173 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 7.4 tpm_? -58.95 -45.92 89.29 Favored 'General case' 0 N--CA 1.431 -1.406 0 O-C-N 120.726 -1.234 . . . . 1.0 114.291 179.818 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 3.8 pp -83.51 -26.97 29.71 Favored 'General case' 0 N--CA 1.431 -1.384 0 N-CA-C 115.097 1.517 . . . . 1.0 115.097 -177.387 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 8.7 t70 -62.71 -34.09 76.44 Favored 'General case' 0 CA--C 1.488 -1.405 0 O-C-N 120.336 -1.478 . . . . 1.0 113.342 163.591 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 19.2 t70 -70.59 -55.08 9.65 Favored 'General case' 0 N--CA 1.43 -1.472 0 C-N-CA 126.201 1.8 . . . . 1.0 114.559 178.405 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 24' ' ' TRP . . . . . . . . . . . . . 32.4 t-105 -73.03 138.68 46.11 Favored 'General case' 0 N--CA 1.43 -1.456 0 O-C-N 120.703 -1.248 . . . . 1.0 113.104 -172.643 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 63.3 m-20 -84.16 -141.33 0.07 Allowed 'General case' 0 N--CA 1.431 -1.408 0 O-C-N 120.327 -1.483 . . . . 1.0 112.054 177.519 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 164.3 -164.8 36.9 Favored Glycine 0 N--CA 1.431 -1.664 0 O-C-N 118.592 -2.568 . . . . 1.0 114.181 -175.221 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 37.4 t70 -86.84 -53.43 4.92 Favored 'General case' 0 N--CA 1.43 -1.463 0 C-N-CA 125.238 1.415 . . . . 1.0 107.911 169.242 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 4.5 t -82.7 -176.48 6.3 Favored 'General case' 0 N--CA 1.431 -1.414 0 C-N-CA 125.728 1.611 . . . . 1.0 109.691 178.94 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 32.9 t0 -99.85 178.63 4.76 Favored 'General case' 0 N--CA 1.43 -1.449 0 O-C-N 120.26 -1.525 . . . . 1.0 108.142 175.218 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 9.3 tp -152.26 126.58 1.41 Allowed 'Isoleucine or valine' 0 N--CA 1.43 -1.431 0 N-CA-C 106.936 -1.505 . . . . 1.0 106.936 -173.974 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 28.4 t70 -131.73 119.07 20.82 Favored 'General case' 0 N--CA 1.43 -1.439 0 CA-C-O 122.956 1.36 . . . . 1.0 109.13 163.299 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 17.3 p -86.21 131.17 34.3 Favored 'General case' 0 N--CA 1.43 -1.445 0 O-C-N 120.088 -1.632 . . . . 1.0 111.228 174.349 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 41.0 mm-40 -100.06 137.5 38.42 Favored 'General case' 0 N--CA 1.429 -1.488 0 C-N-CA 124.708 1.203 . . . . 1.0 108.916 174.651 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 3.5 tp -127.42 114.1 34.79 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.407 0 CA-C-O 124.046 1.879 . . . . 1.0 106.245 178.81 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 35' ' ' ASN . . . . . 0.419 ' HB3' ' HB ' ' A' ' 38' ' ' VAL . 1.6 t-20 -125.81 179.98 4.93 Favored 'General case' 0 N--CA 1.43 -1.427 0 C-N-CA 124.805 1.242 . . . . 1.0 107.828 176.663 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -71.36 87.36 0.41 Allowed Glycine 0 N--CA 1.431 -1.653 0 O-C-N 120.566 -1.334 . . . . 1.0 115.898 -168.657 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 82.2 23.57 56.67 Favored Glycine 0 N--CA 1.429 -1.792 0 C-N-CA 125.379 1.466 . . . . 1.0 112.526 -171.889 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . 0.419 ' HB ' ' HB3' ' A' ' 35' ' ' ASN . 61.8 t -138.84 135.05 42.92 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.475 0 CA-C-N 118.307 1.053 . . . . 1.0 109.109 -173.253 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 31.1 mt -118.07 142.01 47.86 Favored 'General case' 0 N--CA 1.43 -1.427 0 CA-C-O 122.919 1.343 . . . . 1.0 108.799 166.273 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -138.49 111.3 7.71 Favored 'General case' 0 N--CA 1.43 -1.426 0 O-C-N 120.422 -1.424 . . . . 1.0 108.436 178.032 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 70.3 mt -96.83 105.41 17.07 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.467 0 N-CA-C 107.362 -1.347 . . . . 1.0 107.362 -165.859 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 14.0 m -118.44 131.2 56.28 Favored 'General case' 0 N--CA 1.43 -1.457 0 CA-C-N 118.896 0.771 . . . . 1.0 112.994 -163.053 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 43' ' ' PHE . . . . . . . . . . . . . 1.4 m-85 -99.56 173.68 6.61 Favored 'General case' 0 N--CA 1.43 -1.431 0 O-C-N 120.608 -1.308 . . . . 1.0 111.193 -179.381 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -71.77 -19.03 62.08 Favored 'General case' 0 N--CA 1.429 -1.481 0 O-C-N 119.219 -2.175 . . . . 1.0 113.476 -179.466 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 29.0 t-20 -67.21 -17.97 65.05 Favored 'General case' 0 N--CA 1.429 -1.502 0 C-N-CA 126.811 2.044 . . . . 1.0 113.512 170.731 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 92.34 -14.9 63.5 Favored Glycine 0 N--CA 1.43 -1.74 0 O-C-N 119.962 -1.712 . . . . 1.0 113.683 179.666 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 13.8 m -77.8 167.86 20.86 Favored 'General case' 0 N--CA 1.431 -1.425 0 O-C-N 121.082 -1.246 . . . . 1.0 111.077 172.943 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 12.9 ptpt -169.93 157.68 6.82 Favored 'General case' 0 N--CA 1.43 -1.439 0 O-C-N 121.156 -0.965 . . . . 1.0 113.07 -162.668 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 5.3 mm -101.54 137.11 30.39 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.438 0 C-N-CA 125.791 1.636 . . . . 1.0 107.389 171.823 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 16.1 mm -111.17 116.85 53.61 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.437 0 C-N-CA 125.032 1.333 . . . . 1.0 109.382 -178.013 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 3.0 mt -125.43 124.76 67.68 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.506 0 O-C-N 120.717 -1.239 . . . . 1.0 110.695 179.297 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 52' ' ' ASN . . . . . 0.413 ' H ' ' HD1' ' A' ' 61' ' ' TRP . 26.6 t30 -162.52 172.93 14.7 Favored 'General case' 0 N--CA 1.43 -1.471 0 N-CA-C 103.142 -2.91 . . . . 1.0 103.142 -172.815 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 1.9 ptm180 -139.76 150.57 44.93 Favored 'General case' 0 N--CA 1.429 -1.524 0 CA-C-O 122.546 1.165 . . . . 1.0 112.337 -158.913 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 15.8 mm-40 -107.16 -108.42 0.31 Allowed 'General case' 0 N--CA 1.43 -1.448 0 C-N-CA 124.653 1.181 . . . . 1.0 109.562 -167.173 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 33.2 mm-40 -79.23 135.75 57.6 Favored Pre-proline 0 N--CA 1.43 -1.446 0 CA-C-O 117.718 -1.134 . . . . 1.0 112.799 -172.041 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 98.5 Cg_endo -73.45 62.69 4.46 Favored 'Trans proline' 0 N--CA 1.434 -1.999 0 C-N-CA 123.277 2.651 . . . . 1.0 112.319 162.997 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . 0.404 ' O ' ' HD2' ' A' ' 58' ' ' HIS . 73.1 mt -120.32 -103.0 0.41 Allowed 'General case' 0 N--CA 1.429 -1.493 0 N-CA-C 102.841 -3.022 . . . . 1.0 102.841 164.483 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 58' ' ' HIS . . . . . 0.404 ' HD2' ' O ' ' A' ' 57' ' ' LEU . 42.0 m170 -132.47 92.02 3.01 Favored 'General case' 0 N--CA 1.429 -1.489 0 N-CA-C 106.622 -1.622 . . . . 1.0 106.622 159.412 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 22.1 tt0 -158.68 122.05 3.84 Favored 'General case' 0 N--CA 1.429 -1.516 0 CA-C-N 121.687 2.04 . . . . 1.0 114.161 173.005 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 86.4 t -133.36 157.57 42.63 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.451 0 C-N-CA 127.031 2.132 . . . . 1.0 109.437 -179.013 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 61' ' ' TRP . . . . . 0.413 ' HD1' ' H ' ' A' ' 52' ' ' ASN . 0.0 OUTLIER -111.36 156.06 22.16 Favored 'General case' 0 N--CA 1.429 -1.505 0 C-N-CA 127.867 2.467 . . . . 1.0 109.755 -174.169 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . 0.277 2.3 pt? -150.91 134.01 16.03 Favored 'General case' 0 N--CA 1.432 -1.364 0 CA-C-N 120.686 1.584 . . . . 1.0 113.916 150.939 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -120.08 147.29 45.03 Favored 'General case' 0 N--CA 1.429 -1.514 0 C-N-CA 125.367 1.467 . . . . 1.0 114.429 -179.557 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 64' ' ' THR . . . . . . . . . . . . . 12.5 t -153.96 -149.52 0.29 Allowed 'General case' 0 N--CA 1.429 -1.509 0 C-N-CA 126.745 2.018 . . . . 1.0 112.388 -172.694 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 5.6 tmtm? -63.56 -53.57 49.64 Favored 'General case' 0 N--CA 1.43 -1.456 0 C-N-CA 130.116 3.366 . . . . 1.0 114.362 -174.404 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 31.3 tt0 -82.24 2.19 33.02 Favored 'General case' 0 N--CA 1.429 -1.492 0 CA-C-O 122.581 1.181 . . . . 1.0 111.602 -177.008 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 117.5 -72.92 0.29 Allowed Glycine 0 N--CA 1.43 -1.732 0 N-CA-C 107.343 -2.303 . . . . 1.0 107.343 -177.4 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 106.06 -173.43 19.85 Favored Glycine 0 N--CA 1.43 -1.733 0 C-N-CA 124.229 0.918 . . . . 1.0 112.486 -176.382 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -162.05 169.83 20.29 Favored 'General case' 0 N--CA 1.431 -1.423 0 N-CA-C 107.284 -1.376 . . . . 1.0 107.284 -173.008 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 19.8 p80 -79.87 159.9 26.25 Favored 'General case' 0 N--CA 1.431 -1.422 0 O-C-N 119.775 -1.828 . . . . 1.0 114.653 174.504 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 71' ' ' PHE . . . . . . . . . . . . 0.3 72.3 t80 -112.21 113.77 26.2 Favored 'General case' 0 N--CA 1.431 -1.402 0 C-N-CA 127.744 2.418 . . . . 1.0 107.019 -158.565 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 5.7 m-20 -134.12 155.1 50.66 Favored 'General case' 0 N--CA 1.43 -1.459 0 CA-C-O 121.851 0.834 . . . . 1.0 110.546 -173.99 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 8.0 tt -97.37 133.53 41.84 Favored 'General case' 0 N--CA 1.431 -1.42 0 O-C-N 119.68 -1.888 . . . . 1.0 111.869 -166.677 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 53.5 tttm -101.81 -56.39 2.29 Favored 'General case' 0 N--CA 1.43 -1.471 0 O-C-N 120.823 -1.173 . . . . 1.0 109.556 174.539 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -157.03 -96.91 0.12 Allowed Glycine 0 N--CA 1.431 -1.677 0 O-C-N 121.035 -1.041 . . . . 1.0 111.346 175.863 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 27.9 m-20 -89.72 16.31 8.17 Favored 'General case' 0 N--CA 1.429 -1.479 0 O-C-N 121.047 -1.266 . . . . 1.0 111.405 179.94 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 32.9 tt0 -166.02 132.83 2.66 Favored 'General case' 0 N--CA 1.43 -1.427 0 N-CA-C 102.046 -3.316 . . . . 1.0 102.046 -161.484 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 78' ' ' TRP . . . . . . . . . . . . . 50.2 m95 -87.75 144.88 26.39 Favored 'General case' 0 N--CA 1.432 -1.37 0 N-CA-C 106.322 -1.732 . . . . 1.0 106.322 175.186 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 9.4 pt -102.35 167.54 2.33 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.485 0 N-CA-C 106.618 -1.623 . . . . 1.0 106.618 174.083 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 1.4 m -89.79 135.65 33.5 Favored 'General case' 0 N--CA 1.429 -1.484 0 O-C-N 120.195 -1.565 . . . . 1.0 107.193 155.29 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 36.8 t70 -59.94 -38.87 83.66 Favored 'General case' 0 N--CA 1.43 -1.447 0 CA-C-N 120.689 1.586 . . . . 1.0 115.069 -174.238 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -9.85 -84.34 0.0 OUTLIER 'General case' 0 N--CA 1.43 -1.467 0 C-N-CA 131.628 3.971 . . . . 1.0 118.457 176.634 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 58.8 m -111.19 -12.79 14.09 Favored 'General case' 0 CA--C 1.489 -1.371 0 O-C-N 120.485 -1.384 . . . . 1.0 109.588 158.126 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 115.85 76.41 0.63 Allowed Glycine 0 N--CA 1.43 -1.763 0 N-CA-C 108.041 -2.023 . . . . 1.0 108.041 -173.509 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 5.2 mm-40 -100.74 -136.4 0.31 Allowed 'General case' 0 N--CA 1.431 -1.419 0 N-CA-C 109.141 -0.688 . . . . 1.0 109.141 -175.583 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 95.5 m -154.2 133.95 12.94 Favored 'General case' 0 N--CA 1.43 -1.445 0 O-C-N 120.156 -1.59 . . . . 1.0 110.402 -171.317 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 1.1 t80 -38.02 -92.13 0.0 OUTLIER 'General case' 0 CA--C 1.489 -1.375 0 C-N-CA 128.432 2.693 . . . . 1.0 115.842 168.895 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 88' ' ' TRP . . . . . . . . . . . . . 50.7 m95 -63.16 -32.69 74.14 Favored 'General case' 0 N--CA 1.431 -1.419 0 C-N-CA 125.649 1.58 . . . . 1.0 113.454 -167.195 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 35.7 t70 -77.96 -42.94 31.24 Favored 'General case' 0 N--CA 1.43 -1.456 0 C-N-CA 125.088 1.355 . . . . 1.0 113.027 -175.898 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 35.0 tp -75.3 -38.9 60.08 Favored 'General case' 0 N--CA 1.43 -1.46 0 O-C-N 119.427 -2.045 . . . . 1.0 111.332 179.335 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 41.9 tp -54.78 -38.64 67.51 Favored 'General case' 0 N--CA 1.43 -1.427 0 C-N-CA 126.33 1.852 . . . . 1.0 113.626 168.106 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 3.4 tm-20 -56.85 -59.9 4.35 Favored 'General case' 0 N--CA 1.429 -1.506 0 C-N-CA 124.611 1.164 . . . . 1.0 112.043 165.875 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 35.9 mt-30 -51.92 -41.81 62.29 Favored 'General case' 0 N--CA 1.43 -1.425 0 N-CA-C 116.28 1.956 . . . . 1.0 116.28 177.394 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -59.19 -58.39 8.84 Favored 'General case' 0 N--CA 1.43 -1.473 0 C-N-CA 126.523 1.929 . . . . 1.0 113.906 172.424 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -62.77 -49.11 76.3 Favored 'General case' 0 N--CA 1.429 -1.507 0 O-C-N 120.41 -1.431 . . . . 1.0 113.446 179.783 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 66.1 m -48.18 -47.55 35.11 Favored 'General case' 0 N--CA 1.43 -1.437 0 C-N-CA 127.859 2.464 . . . . 1.0 114.913 170.501 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 6.6 pt20 -73.4 -30.93 63.59 Favored 'General case' 0 N--CA 1.43 -1.441 0 O-C-N 120.306 -1.496 . . . . 1.0 114.428 -179.222 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 49.7 mt-30 -81.03 -37.93 28.3 Favored 'General case' 0 N--CA 1.431 -1.379 0 O-C-N 120.323 -1.486 . . . . 1.0 113.868 174.715 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -79.42 -42.76 24.73 Favored 'General case' 0 N--CA 1.43 -1.456 0 O-C-N 120.32 -1.488 . . . . 1.0 114.98 -179.686 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . 106.98 17.75 11.35 Favored Glycine 0 N--CA 1.431 -1.695 0 O-C-N 120.683 -1.261 . . . . 1.0 115.762 175.408 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 4.9 tt0 -162.41 152.78 16.81 Favored 'General case' 0 N--CA 1.43 -1.455 0 N-CA-C 104.946 -2.242 . . . . 1.0 104.946 179.527 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 35.1 m -53.48 108.31 0.33 Allowed 'General case' 0 N--CA 1.43 -1.463 0 C-N-CA 125.238 1.415 . . . . 1.0 114.571 175.317 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 49.0 t -89.43 110.49 21.69 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.414 0 CA-C-O 123.258 1.504 . . . . 1.0 108.244 176.892 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 61.5 m -94.19 98.98 11.33 Favored 'General case' 0 N--CA 1.43 -1.46 0 N-CA-C 113.615 0.968 . . . . 1.0 113.615 -162.525 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 88.5 m-85 -89.17 -32.91 17.24 Favored 'General case' 0 N--CA 1.429 -1.485 0 O-C-N 120.961 -1.087 . . . . 1.0 112.884 176.738 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 30.7 mmt180 . . . . . 0 C--O 1.26 1.647 0 N-CA-C 107.3 -1.37 . . . . 1.0 107.3 172.78 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 14.1 ttt . . . . . 0 CA--C 1.489 -1.373 0 CA-C-O 121.891 0.853 . . . . 0.0 110.883 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 62.2 t30 -162.75 163.63 26.67 Favored 'General case' 0 N--CA 1.43 -1.438 0 O-C-N 120.177 -1.577 . . . . 0.0 109.979 -164.028 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 31.1 t70 -64.61 -54.92 24.39 Favored 'General case' 0 N--CA 1.429 -1.48 0 C-N-CA 126.701 2.0 . . . . 0.0 113.678 -175.513 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 9.5 t -65.71 -35.25 80.21 Favored 'General case' 0 N--CA 1.429 -1.479 0 O-C-N 120.066 -1.646 . . . . 0.0 112.696 178.392 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 6.6 tp10 -60.51 -54.93 39.61 Favored 'General case' 0 N--CA 1.431 -1.424 0 C-N-CA 125.433 1.493 . . . . 0.0 112.446 175.616 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 23.2 t80 -46.12 -50.46 15.4 Favored 'General case' 0 N--CA 1.428 -1.54 0 C-N-CA 126.504 1.922 . . . . 0.0 115.2 168.89 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 34.1 t60 -67.56 -46.01 73.96 Favored 'General case' 0 N--CA 1.429 -1.5 0 O-C-N 121.189 -0.944 . . . . 0.0 113.125 179.775 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 51.1 ttt180 -63.04 -45.82 90.43 Favored 'General case' 0 N--CA 1.431 -1.384 0 O-C-N 120.872 -1.142 . . . . 0.0 113.268 -178.224 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 76.8 mt -58.66 -48.08 82.29 Favored 'General case' 0 N--CA 1.429 -1.476 0 C-N-CA 124.818 1.247 . . . . 0.0 112.774 172.959 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -58.94 -48.75 80.38 Favored 'General case' 0 N--CA 1.432 -1.368 0 C-N-CA 124.549 1.14 . . . . 0.0 113.712 178.402 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -62.7 -36.45 82.97 Favored 'General case' 0 N--CA 1.431 -1.4 0 C-N-CA 124.776 1.23 . . . . 0.0 114.148 175.967 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 27.1 mm-40 -64.72 -47.93 76.49 Favored 'General case' 0 N--CA 1.43 -1.45 0 O-C-N 120.491 -1.381 . . . . 0.0 114.435 174.218 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 2.9 pp -69.1 -40.34 78.44 Favored 'General case' 0 N--CA 1.43 -1.458 0 O-C-N 120.12 -1.613 . . . . 0.0 113.884 175.969 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 0.3 OUTLIER -40.76 -58.87 1.54 Allowed 'General case' 0 N--CA 1.43 -1.442 0 C-N-CA 127.445 2.298 . . . . 0.0 113.8 164.584 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 41.4 tp -63.89 -43.05 97.16 Favored 'General case' 0 N--CA 1.43 -1.468 0 C-N-CA 126.137 1.775 . . . . 0.0 113.515 -178.462 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 58.5 m -61.03 -49.7 76.32 Favored 'General case' 0 N--CA 1.431 -1.408 0 C-N-CA 125.043 1.337 . . . . 0.0 113.269 175.192 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 93.8 mt -55.99 -54.02 31.79 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.447 0 C-N-CA 126.037 1.735 . . . . 0.0 112.943 173.899 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 2.3 tm-20 -56.5 -55.11 37.82 Favored 'General case' 0 N--CA 1.429 -1.485 0 C-N-CA 124.912 1.285 . . . . 0.0 113.213 -178.042 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 34.3 mt-10 -68.13 -35.2 77.72 Favored 'General case' 0 N--CA 1.43 -1.441 0 N-CA-C 116.099 1.889 . . . . 0.0 116.099 -179.382 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 22.7 tpp180 -65.11 -40.06 93.99 Favored 'General case' 0 N--CA 1.43 -1.45 0 O-C-N 119.839 -1.788 . . . . 0.0 112.503 175.743 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 69.1 mt -74.65 -43.1 57.03 Favored 'General case' 0 N--CA 1.431 -1.397 0 N-CA-C 114.354 1.242 . . . . 0.0 114.354 176.91 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 12.5 t70 -54.42 -31.98 56.37 Favored 'General case' 0 N--CA 1.431 -1.415 0 C-N-CA 125.414 1.485 . . . . 0.0 113.697 171.792 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 32.9 t70 -78.51 -15.08 59.0 Favored 'General case' 0 N--CA 1.431 -1.401 0 O-C-N 119.642 -1.911 . . . . 0.0 116.085 174.33 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 24' ' ' TRP . . . . . . . . . . . . . 14.5 t-105 -90.77 121.42 32.63 Favored 'General case' 0 N--CA 1.43 -1.446 0 O-C-N 118.962 -2.336 . . . . 0.0 112.872 -170.347 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 6.5 t70 -120.76 171.77 8.36 Favored 'General case' 0 N--CA 1.43 -1.454 0 O-C-N 119.987 -1.696 . . . . 0.0 110.744 -175.099 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 171.89 -135.42 3.4 Favored Glycine 0 N--CA 1.43 -1.751 0 O-C-N 119.987 -1.695 . . . . 0.0 114.123 -174.971 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 31.5 t0 -84.39 -39.25 19.27 Favored 'General case' 0 N--CA 1.431 -1.39 0 C-N-CA 125.576 1.55 . . . . 0.0 108.667 177.741 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 68.3 m -101.88 143.39 31.83 Favored 'General case' 0 N--CA 1.431 -1.405 0 C-N-CA 124.714 1.206 . . . . 0.0 111.568 -178.363 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 31.2 t0 -86.03 160.12 19.4 Favored 'General case' 0 N--CA 1.43 -1.445 0 O-C-N 121.295 -0.878 . . . . 0.0 109.428 174.554 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -157.35 114.92 0.22 Allowed 'Isoleucine or valine' 0 N--CA 1.43 -1.46 0 CA-C-O 123.067 1.413 . . . . 0.0 107.932 -168.048 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 11.4 m-20 -123.17 131.41 53.67 Favored 'General case' 0 N--CA 1.429 -1.501 0 N-CA-C 107.042 -1.466 . . . . 0.0 107.042 171.334 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 71.3 m -92.64 148.48 22.03 Favored 'General case' 0 N--CA 1.429 -1.503 0 O-C-N 119.471 -2.018 . . . . 0.0 110.431 171.053 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 50.6 mt-10 -102.5 138.12 39.83 Favored 'General case' 0 N--CA 1.43 -1.455 0 C-N-CA 125.54 1.536 . . . . 0.0 109.329 -176.753 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 3.7 mp -124.8 109.08 21.44 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.416 0 CA-C-O 123.745 1.736 . . . . 0.0 107.472 -176.644 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 47.5 t30 -130.73 71.14 1.46 Allowed 'General case' 0 N--CA 1.43 -1.439 0 C-N-CA 125.812 1.645 . . . . 0.0 110.486 179.981 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . 72.27 -101.42 1.05 Allowed Glycine 0 N--CA 1.43 -1.733 0 O-C-N 119.784 -1.822 . . . . 0.0 114.572 174.571 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -105.9 24.55 26.47 Favored Glycine 0 N--CA 1.43 -1.75 0 O-C-N 121.607 -0.937 . . . . 0.0 111.366 173.489 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 95.9 t -122.04 124.71 71.85 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.43 0 C-N-CA 125.539 1.536 . . . . 0.0 107.775 174.532 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 58.3 mt -111.62 140.75 45.98 Favored 'General case' 0 N--CA 1.429 -1.503 0 N-CA-C 107.604 -1.258 . . . . 0.0 107.604 161.83 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 1.2 m -134.57 125.07 26.52 Favored 'General case' 0 N--CA 1.431 -1.38 0 O-C-N 120.292 -1.505 . . . . 0.0 107.979 175.883 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 36.4 mt -96.32 116.62 38.74 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.437 0 N-CA-C 107.236 -1.394 . . . . 0.0 107.236 -175.601 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 86.4 m -127.6 111.61 13.94 Favored 'General case' 0 N--CA 1.43 -1.434 0 CA-C-O 123.713 1.721 . . . . 0.0 113.107 -169.292 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 43' ' ' PHE . . . . . . . . . . . . . 7.5 p90 -120.31 160.14 23.61 Favored 'General case' 0 N--CA 1.43 -1.461 0 C-N-CA 126.546 1.938 . . . . 0.0 112.209 178.938 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 25.8 mt-10 -52.88 -25.55 12.03 Favored 'General case' 0 N--CA 1.431 -1.421 0 N-CA-C 119.402 3.112 . . . . 0.0 119.402 -165.605 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 2.2 t-20 -66.77 -9.19 34.31 Favored 'General case' 0 N--CA 1.429 -1.495 0 C-N-CA 124.625 1.17 . . . . 0.0 113.998 177.686 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 94.56 25.2 16.21 Favored Glycine 0 N--CA 1.43 -1.747 0 O-C-N 120.506 -1.371 . . . . 0.0 110.712 177.107 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 18.3 m -89.52 163.88 15.03 Favored 'General case' 0 N--CA 1.429 -1.479 0 C-N-CA 125.523 1.529 . . . . 0.0 113.298 -170.528 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 36.5 ttmt -151.58 99.37 2.6 Favored 'General case' 0 N--CA 1.431 -1.401 0 O-C-N 121.549 -0.719 . . . . 0.0 111.237 -170.697 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 4.1 mm -101.58 107.91 22.5 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.457 0 N-CA-C 105.028 -2.212 . . . . 0.0 105.028 174.737 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 3.4 tp -111.49 120.88 62.99 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.478 0 CA-C-O 123.438 1.59 . . . . 0.0 109.246 -169.824 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 2.4 mt -124.26 120.98 60.71 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.474 0 C-N-CA 125.653 1.581 . . . . 0.0 109.766 -173.994 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 7.5 t-20 -158.42 158.8 34.87 Favored 'General case' 0 N--CA 1.431 -1.389 0 CA-C-O 123.681 1.705 . . . . 0.0 106.843 -172.184 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 37.2 ptt180 -133.25 138.25 46.4 Favored 'General case' 0 N--CA 1.43 -1.454 0 C-N-CA 126.546 1.938 . . . . 0.0 111.077 -163.813 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 13.7 pt20 -100.36 137.58 38.59 Favored 'General case' 0 N--CA 1.43 -1.429 0 CA-C-O 122.496 1.141 . . . . 0.0 108.528 176.977 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 15.5 mm-40 -59.72 -49.02 93.87 Favored Pre-proline 0 N--CA 1.428 -1.531 0 CA-C-O 116.166 -1.874 . . . . 0.0 115.916 174.618 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 88.4 Cg_endo -75.21 139.78 24.16 Favored 'Trans proline' 0 C--N 1.301 -1.972 0 CA-C-N 126.04 3.193 . . . . 0.0 112.056 165.058 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . 0.368 5.5 mp 74.65 127.38 0.04 OUTLIER 'General case' 0 N--CA 1.431 -1.387 0 CA-C-O 124.354 2.026 . . . . 0.0 115.927 -176.22 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 24.1 m80 -76.94 40.24 0.25 Allowed 'General case' 0 N--CA 1.43 -1.438 0 C-N-CA 126.712 2.005 . . . . 0.0 115.016 -177.756 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 7.1 mp0 -127.61 132.18 49.82 Favored 'General case' 0 N--CA 1.43 -1.466 0 C-N-CA 128.591 2.756 . . . . 0.0 107.851 -171.567 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 60' ' ' VAL . . . . . 0.466 ' HB ' ' CE1' ' A' ' 71' ' ' PHE . 29.4 t -113.58 154.49 14.96 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.4 0 O-C-N 119.941 -1.724 . . . . 0.0 108.368 177.745 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 61' ' ' TRP . . . . . . . . . . . . 0.28 0.0 OUTLIER -89.3 154.0 20.44 Favored 'General case' 0 N--CA 1.429 -1.477 0 N-CA-C 115.045 1.498 . . . . 0.0 115.045 -178.67 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -117.77 92.31 3.8 Favored 'General case' 0 N--CA 1.43 -1.46 0 N-CA-C 104.916 -2.253 . . . . 0.0 104.916 165.842 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -104.22 100.89 10.63 Favored 'General case' 0 N--CA 1.431 -1.389 0 CA-C-O 123.689 1.709 . . . . 0.0 110.972 177.534 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 64' ' ' THR . . . . . . . . . . . . . 9.2 t -149.74 172.67 14.72 Favored 'General case' 0 N--CA 1.431 -1.4 0 C-N-CA 126.259 1.824 . . . . 0.0 106.893 -171.234 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 42.4 tptt -78.88 53.36 1.37 Allowed 'General case' 0 N--CA 1.43 -1.468 0 C-N-CA 126.579 1.952 . . . . 0.0 114.77 -166.439 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 38.4 tp60 -130.33 -24.33 2.56 Favored 'General case' 0 N--CA 1.43 -1.434 0 O-C-N 119.992 -1.693 . . . . 0.0 109.363 163.5 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 132.21 112.9 1.44 Allowed Glycine 0 N--CA 1.43 -1.71 0 N-CA-C 107.227 -2.349 . . . . 0.0 107.227 -167.199 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . -71.21 120.48 8.5 Favored Glycine 0 N--CA 1.429 -1.789 0 O-C-N 120.695 -1.473 . . . . 0.0 116.105 -177.195 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 18.6 m-30 -118.11 170.79 8.57 Favored 'General case' 0 N--CA 1.43 -1.459 0 C-N-CA 126.265 1.826 . . . . 0.0 108.7 -175.993 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 3.0 p80 -120.74 159.25 25.78 Favored 'General case' 0 N--CA 1.43 -1.465 0 O-C-N 119.226 -2.171 . . . . 0.0 110.93 165.318 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 71' ' ' PHE . . . . . 0.466 ' CE1' ' HB ' ' A' ' 60' ' ' VAL . 0.0 OUTLIER -117.66 153.66 32.94 Favored 'General case' 0 N--CA 1.429 -1.491 0 N-CA-C 117.471 2.397 . . . . 0.0 117.471 -165.43 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 -127.98 145.47 50.96 Favored 'General case' 0 N--CA 1.43 -1.433 0 C-N-CA 124.659 1.184 . . . . 0.0 110.286 178.126 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 60.0 tp -96.1 114.26 25.94 Favored 'General case' 0 N--CA 1.429 -1.477 0 O-C-N 119.883 -1.761 . . . . 0.0 111.609 -178.108 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 74.1 mmtt -82.95 -11.79 57.86 Favored 'General case' 0 N--CA 1.43 -1.451 0 C-N-CA 124.875 1.27 . . . . 0.0 113.185 174.037 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . 121.96 -61.28 0.55 Allowed Glycine 0 N--CA 1.429 -1.768 0 N-CA-C 109.137 -1.585 . . . . 0.0 109.137 178.486 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 6.2 p-10 -89.51 -20.32 23.97 Favored 'General case' 0 N--CA 1.431 -1.392 0 C-N-CA 124.909 1.284 . . . . 0.0 113.162 179.039 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 6.5 tp10 -147.76 136.48 21.86 Favored 'General case' 0 N--CA 1.43 -1.458 0 N-CA-C 107.115 -1.439 . . . . 0.0 107.115 -174.422 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 78' ' ' TRP . . . . . . . . . . . . . 95.7 m95 -80.94 111.22 17.22 Favored 'General case' 0 N--CA 1.431 -1.405 0 N-CA-C 105.927 -1.879 . . . . 0.0 105.927 159.94 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -106.08 155.7 6.96 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.473 0 N-CA-C 105.657 -1.979 . . . . 0.0 105.657 179.658 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 66.4 m -85.4 146.87 26.78 Favored 'General case' 0 N--CA 1.43 -1.457 0 O-C-N 119.597 -1.939 . . . . 0.0 111.946 -175.987 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 51.6 t0 -66.68 -52.07 48.87 Favored 'General case' 0 N--CA 1.43 -1.46 0 C-N-CA 126.011 1.724 . . . . 0.0 112.301 179.261 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 4.4 mmp_? -67.65 129.38 39.73 Favored 'General case' 0 N--CA 1.43 -1.456 0 C-N-CA 124.812 1.245 . . . . 0.0 110.916 173.756 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 71.2 m 70.94 -59.48 0.54 Allowed 'General case' 0 N--CA 1.43 -1.458 0 C-N-CA 126.84 2.056 . . . . 0.0 115.054 -179.175 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 119.99 63.39 0.26 Allowed Glycine 0 N--CA 1.431 -1.665 0 C-N-CA 126.286 1.898 . . . . 0.0 108.751 -172.589 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 15.2 mm-40 -108.64 -152.83 0.5 Allowed 'General case' 0 N--CA 1.43 -1.448 0 N-CA-C 108.092 -1.077 . . . . 0.0 108.092 -170.994 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 8.9 m -150.33 129.83 13.02 Favored 'General case' 0 N--CA 1.431 -1.413 0 O-C-N 119.428 -2.045 . . . . 0.0 109.861 -158.397 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 4.0 t80 -53.12 -81.85 0.01 OUTLIER 'General case' 0 N--CA 1.431 -1.409 0 N-CA-C 119.12 3.008 . . . . 0.0 119.12 -175.945 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 88' ' ' TRP . . . . . . . . . . . . . 84.9 m95 -67.25 -26.43 66.57 Favored 'General case' 0 N--CA 1.43 -1.429 0 O-C-N 119.841 -1.787 . . . . 0.0 113.423 -167.751 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 17.4 t70 -77.94 -36.97 48.65 Favored 'General case' 0 N--CA 1.432 -1.358 0 C-N-CA 126.171 1.788 . . . . 0.0 113.034 179.428 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 42.2 tp -70.76 -44.41 66.79 Favored 'General case' 0 N--CA 1.43 -1.449 0 O-C-N 119.862 -1.774 . . . . 0.0 111.241 173.046 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 9.0 tt -51.03 -48.17 61.53 Favored 'General case' 0 N--CA 1.431 -1.391 0 C-N-CA 127.238 2.215 . . . . 0.0 112.721 171.622 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 23.8 tt0 -53.08 -55.77 21.34 Favored 'General case' 0 N--CA 1.43 -1.438 0 C-N-CA 126.109 1.764 . . . . 0.0 113.468 168.739 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 9.1 tt0 -52.42 -52.91 51.35 Favored 'General case' 0 N--CA 1.428 -1.551 0 C-N-CA 125.424 1.49 . . . . 0.0 113.958 -178.419 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -66.62 -42.45 86.78 Favored 'General case' 0 N--CA 1.43 -1.466 0 N-CA-C 113.926 1.084 . . . . 0.0 113.926 -178.979 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -67.56 -35.82 79.77 Favored 'General case' 0 N--CA 1.43 -1.446 0 O-C-N 120.674 -1.266 . . . . 0.0 113.294 176.516 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 78.9 m -61.05 -47.07 88.07 Favored 'General case' 0 N--CA 1.431 -1.388 0 C-N-CA 125.835 1.654 . . . . 0.0 112.248 174.268 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 16.3 pt20 -78.29 -10.67 59.77 Favored 'General case' 0 N--CA 1.43 -1.456 0 N-CA-C 114.783 1.401 . . . . 0.0 114.783 177.688 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 4.0 mm-40 -76.79 -50.38 13.64 Favored 'General case' 0 N--CA 1.429 -1.495 0 O-C-N 120.261 -1.524 . . . . 0.0 112.913 163.299 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -80.15 -42.97 22.45 Favored 'General case' 0 N--CA 1.43 -1.469 0 N-CA-C 115.493 1.664 . . . . 0.0 115.493 -174.795 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . 95.51 21.43 24.33 Favored Glycine 0 N--CA 1.43 -1.753 0 C-N-CA 124.567 1.08 . . . . 0.0 112.957 -173.713 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 16.4 pt-20 -157.56 164.18 37.59 Favored 'General case' 0 N--CA 1.43 -1.438 0 N-CA-C 105.914 -1.884 . . . . 0.0 105.914 173.399 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 49.1 m -72.43 102.93 3.31 Favored 'General case' 0 N--CA 1.431 -1.4 0 CA-C-N 119.936 1.243 . . . . 0.0 113.053 -173.0 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 4.3 t -98.49 85.68 1.32 Allowed 'Isoleucine or valine' 0 N--CA 1.429 -1.475 0 CA-C-O 123.359 1.552 . . . . 0.0 109.84 -179.024 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 27.9 p -115.84 156.75 25.53 Favored 'General case' 0 N--CA 1.43 -1.454 0 C-N-CA 125.669 1.587 . . . . 0.0 114.064 -170.322 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 29.6 m-85 -102.96 -34.61 8.87 Favored 'General case' 0 N--CA 1.429 -1.493 0 C-N-CA 125.834 1.654 . . . . 0.0 110.011 165.949 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 30.7 mmt180 . . . . . 0 C--O 1.26 1.65 0 O-C-N 121.513 -0.742 . . . . 0.0 109.539 -177.643 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 68.2 mtm . . . . . 0 CA--C 1.49 -1.352 0 CA-C-O 122.23 1.014 . . . . 1.0 111.518 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 33.9 p-10 -60.8 -36.61 79.48 Favored 'General case' 0 N--CA 1.43 -1.465 0 C-N-CA 126.167 1.787 . . . . 1.0 113.458 170.203 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 11.2 t70 -56.15 -54.36 46.03 Favored 'General case' 0 N--CA 1.43 -1.458 0 C-N-CA 127.554 2.342 . . . . 1.0 112.862 179.297 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 62.5 m -52.92 -53.64 46.39 Favored 'General case' 0 N--CA 1.43 -1.462 0 C-N-CA 126.516 1.926 . . . . 1.0 113.994 176.237 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 5.8 mm-40 -65.17 -49.04 71.36 Favored 'General case' 0 N--CA 1.43 -1.445 0 C-N-CA 125.616 1.566 . . . . 1.0 113.601 -178.034 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 12.9 t80 -61.96 -38.25 87.81 Favored 'General case' 0 N--CA 1.43 -1.43 0 N-CA-C 114.272 1.212 . . . . 1.0 114.272 173.373 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 23.6 t60 -65.56 -37.53 86.96 Favored 'General case' 0 N--CA 1.43 -1.445 0 O-C-N 119.882 -1.761 . . . . 1.0 113.2 176.422 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 1.7 tpm_? -59.12 -54.5 46.27 Favored 'General case' 0 N--CA 1.431 -1.422 0 C-N-CA 125.565 1.546 . . . . 1.0 112.353 171.796 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 81.5 mt -57.03 -49.13 76.74 Favored 'General case' 0 N--CA 1.429 -1.506 0 C-N-CA 125.043 1.337 . . . . 1.0 113.806 174.629 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -56.67 -48.34 77.82 Favored 'General case' 0 N--CA 1.431 -1.384 0 C-N-CA 127.087 2.155 . . . . 1.0 114.511 -178.283 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -59.78 -52.57 64.89 Favored 'General case' 0 N--CA 1.429 -1.502 0 O-C-N 121.29 -0.881 . . . . 1.0 112.498 171.639 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 39.6 mt-30 -55.2 -45.9 75.86 Favored 'General case' 0 N--CA 1.43 -1.458 0 N-CA-C 117.839 2.533 . . . . 1.0 117.839 177.637 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 4.0 pp -65.67 -38.51 89.52 Favored 'General case' 0 N--CA 1.43 -1.474 0 O-C-N 120.707 -1.246 . . . . 1.0 113.669 175.679 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 0.1 OUTLIER -49.84 -56.52 10.09 Favored 'General case' 0 N--CA 1.429 -1.506 0 N-CA-C 113.988 1.107 . . . . 1.0 113.988 167.894 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 38.1 mt -56.46 -44.21 80.31 Favored 'General case' 0 N--CA 1.43 -1.431 0 CA-C-O 122.183 0.992 . . . . 1.0 113.313 178.743 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 14.9 m -57.56 -54.21 49.44 Favored 'General case' 0 N--CA 1.431 -1.411 0 C-N-CA 125.047 1.339 . . . . 1.0 113.323 178.981 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 80.9 mt -59.62 -46.86 92.79 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.416 0 C-N-CA 126.879 2.072 . . . . 1.0 113.541 177.213 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 26.1 mt-10 -52.67 -57.61 9.52 Favored 'General case' 0 N--CA 1.43 -1.469 0 C-N-CA 126.225 1.81 . . . . 1.0 112.248 176.526 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -53.45 -54.93 29.86 Favored 'General case' 0 CA--C 1.489 -1.391 0 C-N-CA 125.174 1.39 . . . . 1.0 113.545 174.421 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 3.4 tpt180 -57.9 -49.05 78.05 Favored 'General case' 0 N--CA 1.431 -1.42 0 N-CA-C 114.992 1.479 . . . . 1.0 114.992 -171.508 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -80.9 -32.82 34.63 Favored 'General case' 0 N--CA 1.43 -1.458 0 N-CA-C 114.255 1.206 . . . . 1.0 114.255 177.84 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 15.0 t70 -56.02 -49.32 74.0 Favored 'General case' 0 N--CA 1.428 -1.532 0 O-C-N 119.738 -1.851 . . . . 1.0 114.064 172.448 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 13.6 t70 -52.83 -45.41 67.31 Favored 'General case' 0 N--CA 1.43 -1.427 0 C-N-CA 128.081 2.553 . . . . 1.0 117.206 -175.356 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 24' ' ' TRP . . . . . . . . . . . . . 76.9 t-105 -43.9 -65.12 0.54 Allowed 'General case' 0 N--CA 1.43 -1.472 0 C-N-CA 127.677 2.391 . . . . 1.0 116.57 -169.594 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 40.4 t0 59.34 70.03 0.67 Allowed 'General case' 0 N--CA 1.43 -1.46 0 C-N-CA 126.653 1.981 . . . . 1.0 114.161 173.231 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -99.65 -134.29 8.44 Favored Glycine 0 N--CA 1.429 -1.818 0 CA-C-O 122.823 1.235 . . . . 1.0 113.386 -175.45 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -72.69 -34.52 67.22 Favored 'General case' 0 N--CA 1.43 -1.447 0 C-N-CA 125.024 1.329 . . . . 1.0 109.64 174.547 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 36.1 m -89.3 148.84 23.33 Favored 'General case' 0 N--CA 1.43 -1.429 0 CA-C-O 122.899 1.333 . . . . 1.0 113.033 -179.926 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 22.5 t0 -76.84 172.84 12.47 Favored 'General case' 0 N--CA 1.431 -1.381 0 C-N-CA 125.187 1.395 . . . . 1.0 110.135 170.432 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 5.4 tp -157.04 114.78 0.23 Allowed 'Isoleucine or valine' 0 N--CA 1.43 -1.464 0 CA-C-O 123.477 1.608 . . . . 1.0 108.253 -164.78 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 7.5 t0 -131.68 102.31 5.84 Favored 'General case' 0 N--CA 1.431 -1.388 0 O-C-N 120.507 -1.371 . . . . 1.0 108.806 170.767 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 27.3 p -89.58 124.45 34.56 Favored 'General case' 0 N--CA 1.431 -1.424 0 O-C-N 120.241 -1.537 . . . . 1.0 111.669 -178.697 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 5.2 mm-40 -94.34 135.13 36.09 Favored 'General case' 0 N--CA 1.429 -1.478 0 O-C-N 120.087 -1.633 . . . . 1.0 110.623 -177.191 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 1.6 tp -131.42 115.89 30.31 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.422 0 C-N-CA 126.758 2.023 . . . . 1.0 107.357 -176.929 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 4.9 t-20 -147.66 81.42 1.51 Allowed 'General case' 0 N--CA 1.431 -1.423 0 O-C-N 121.62 -0.675 . . . . 1.0 111.374 172.281 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . 68.27 -70.49 0.34 Allowed Glycine 0 N--CA 1.429 -1.808 0 C-N-CA 126.777 2.132 . . . . 1.0 118.221 167.815 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -119.5 -3.07 12.93 Favored Glycine 0 N--CA 1.43 -1.762 0 C-N-CA 126.125 1.821 . . . . 1.0 112.24 179.693 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 21.5 t -120.99 123.78 70.85 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.457 0 CA-C-N 118.538 1.169 . . . . 1.0 109.689 -177.707 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 42.1 mt -110.23 135.67 50.63 Favored 'General case' 0 N--CA 1.431 -1.408 0 O-C-N 120.286 -1.509 . . . . 1.0 108.707 163.254 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -136.91 107.51 6.54 Favored 'General case' 0 N--CA 1.431 -1.407 0 N-CA-C 107.183 -1.414 . . . . 1.0 107.183 -178.329 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 6.5 mt -100.46 114.62 39.8 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.513 0 O-C-N 119.457 -2.027 . . . . 1.0 108.664 -168.075 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 23.0 m -116.03 131.94 56.8 Favored 'General case' 0 N--CA 1.43 -1.436 0 CA-C-O 121.473 0.654 . . . . 1.0 111.265 -167.102 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 43' ' ' PHE . . . . . . . . . . . . 0.263 0.2 OUTLIER -120.55 173.03 7.42 Favored 'General case' 0 N--CA 1.429 -1.486 0 C-N-CA 124.624 1.17 . . . . 1.0 112.481 177.142 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -57.88 -33.32 68.59 Favored 'General case' 0 N--CA 1.431 -1.418 0 N-CA-C 118.256 2.687 . . . . 1.0 118.256 -160.097 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -69.46 -13.78 62.53 Favored 'General case' 0 N--CA 1.43 -1.459 0 C-N-CA 125.543 1.537 . . . . 1.0 113.283 -179.775 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 82.27 38.32 13.12 Favored Glycine 0 N--CA 1.429 -1.772 0 O-C-N 119.868 -1.77 . . . . 1.0 109.228 -168.793 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 68.8 m -120.86 151.61 39.43 Favored 'General case' 0 CA--C 1.489 -1.4 0 N-CA-C 106.145 -1.798 . . . . 1.0 106.145 179.456 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 47.6 pttt -161.3 165.64 28.82 Favored 'General case' 0 N--CA 1.431 -1.411 0 N-CA-C 113.905 1.076 . . . . 1.0 113.905 -165.54 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 5.7 mm -112.86 135.23 52.95 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.506 0 C-N-CA 127.327 2.251 . . . . 1.0 106.269 175.517 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 3.2 mm -117.88 114.46 45.42 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.466 0 C-N-CA 124.577 1.151 . . . . 1.0 108.737 -179.912 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 4.7 mt -128.08 128.25 68.62 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.5 0 CA-C-O 123.006 1.384 . . . . 1.0 111.617 -176.902 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 14.0 t-20 -160.96 174.41 13.83 Favored 'General case' 0 N--CA 1.43 -1.452 0 N-CA-C 102.809 -3.034 . . . . 1.0 102.809 -178.349 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 12.6 ptt180 -142.46 135.26 28.25 Favored 'General case' 0 CA--C 1.489 -1.374 0 N-CA-C 108.66 -0.867 . . . . 1.0 108.66 -169.263 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 55.2 mm-40 -139.46 67.02 1.39 Allowed 'General case' 0 N--CA 1.431 -1.393 0 N-CA-C 106.892 -1.522 . . . . 1.0 106.892 -171.401 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -70.91 126.82 92.17 Favored Pre-proline 0 N--CA 1.43 -1.438 0 N-CA-C 117.24 2.311 . . . . 1.0 117.24 -157.655 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 49.6 Cg_endo -76.63 -55.62 0.06 OUTLIER 'Trans proline' 0 C--N 1.299 -2.069 0 C-N-CA 122.052 1.835 . . . . 1.0 109.812 150.908 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 40.8 mt -115.96 -93.23 0.5 Allowed 'General case' 0 N--CA 1.429 -1.508 0 C-N-CA 124.932 1.293 . . . . 1.0 109.307 -177.692 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 51.4 m170 -132.76 78.96 1.82 Allowed 'General case' 0 N--CA 1.43 -1.436 0 C-N-CA 126.68 1.992 . . . . 1.0 106.604 175.892 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 12.0 tt0 -138.47 140.43 39.23 Favored 'General case' 0 N--CA 1.43 -1.45 0 O-C-N 119.908 -1.745 . . . . 1.0 108.252 -170.389 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 48.9 t -119.85 154.43 22.71 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.381 0 N-CA-C 106.198 -1.778 . . . . 1.0 106.198 -177.611 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 61' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -99.42 148.44 24.21 Favored 'General case' 0 N--CA 1.43 -1.45 0 O-C-N 120.555 -1.341 . . . . 1.0 110.092 178.228 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -133.55 92.21 2.95 Favored 'General case' 0 N--CA 1.429 -1.477 0 O-C-N 120.38 -1.45 . . . . 1.0 111.829 176.862 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -103.71 149.9 24.54 Favored 'General case' 0 N--CA 1.43 -1.429 0 CA-C-O 123.628 1.68 . . . . 1.0 112.011 173.712 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 64' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -151.15 -82.92 0.09 Allowed 'General case' 0 N--CA 1.43 -1.438 0 N-CA-C 107.197 -1.409 . . . . 1.0 107.197 -171.161 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 42.8 tttp -122.88 -59.03 1.63 Allowed 'General case' 0 N--CA 1.43 -1.431 0 C-N-CA 123.696 0.798 . . . . 1.0 111.881 178.432 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 51.7 tt0 -121.1 -23.35 5.83 Favored 'General case' 0 N--CA 1.431 -1.417 0 N-CA-C 112.969 0.729 . . . . 1.0 112.969 -160.066 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . -90.84 -83.79 1.41 Allowed Glycine 0 N--CA 1.431 -1.668 0 O-C-N 120.627 -1.295 . . . . 1.0 114.762 -175.958 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 74.69 51.1 8.37 Favored Glycine 0 N--CA 1.43 -1.748 0 O-C-N 121.375 -1.074 . . . . 1.0 112.845 -166.425 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 11.0 m-30 -99.44 125.78 45.22 Favored 'General case' 0 N--CA 1.429 -1.475 0 O-C-N 121.257 -1.143 . . . . 1.0 108.648 -169.358 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 12.0 p-80 -92.37 156.45 17.22 Favored 'General case' 0 N--CA 1.43 -1.459 0 O-C-N 120.214 -1.554 . . . . 1.0 112.072 179.26 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 50.9 p90 -144.13 142.9 30.85 Favored 'General case' 0 N--CA 1.43 -1.448 0 N-CA-C 115.164 1.542 . . . . 1.0 115.164 -156.381 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -119.54 155.69 31.71 Favored 'General case' 0 N--CA 1.429 -1.476 0 C-N-CA 126.834 2.054 . . . . 1.0 110.866 -172.001 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 58.5 tp -92.35 117.4 29.86 Favored 'General case' 0 N--CA 1.43 -1.426 0 O-C-N 120.318 -1.489 . . . . 1.0 111.427 178.801 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 68.3 mmtt -79.99 -45.74 17.89 Favored 'General case' 0 N--CA 1.43 -1.473 0 O-C-N 120.746 -1.221 . . . . 1.0 113.122 170.034 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -174.92 -76.18 0.05 OUTLIER Glycine 0 N--CA 1.43 -1.73 0 O-C-N 121.001 -1.062 . . . . 1.0 112.453 -179.459 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 4.0 p-10 -101.67 0.33 35.94 Favored 'General case' 0 N--CA 1.429 -1.509 0 C-N-CA 124.876 1.27 . . . . 1.0 112.149 173.675 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 20.6 pt-20 -153.44 148.8 27.08 Favored 'General case' 0 N--CA 1.431 -1.404 0 N-CA-C 106.127 -1.805 . . . . 1.0 106.127 -174.764 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 78' ' ' TRP . . . . . . . . . . . . . 27.4 m95 -97.86 135.36 39.72 Favored 'General case' 0 N--CA 1.43 -1.442 0 N-CA-C 106.982 -1.488 . . . . 1.0 106.982 177.413 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 3.1 mt -104.87 134.38 46.45 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.426 0 C-N-CA 125.502 1.521 . . . . 1.0 107.186 177.832 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 80' ' ' CYS . . . . . 0.46 ' HG ' ' CD2' ' A' ' 90' ' ' LEU . 75.4 m -82.58 127.6 33.51 Favored 'General case' 0 N--CA 1.432 -1.368 0 CA-C-N 115.403 -0.817 . . . . 1.0 108.841 -179.376 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 30.1 t70 -70.08 -37.9 75.57 Favored 'General case' 0 N--CA 1.43 -1.438 0 C-N-CA 124.16 0.984 . . . . 1.0 112.827 -166.894 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -75.51 121.0 21.71 Favored 'General case' 0 N--CA 1.43 -1.461 0 O-C-N 121.234 -0.916 . . . . 1.0 110.017 176.743 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 83' ' ' SER . . . . . . . . . . . . 0.378 80.2 p 72.59 -53.2 0.7 Allowed 'General case' 0 N--CA 1.43 -1.449 0 C-N-CA 128.065 2.546 . . . . 1.0 115.954 -173.028 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 116.54 80.12 0.79 Allowed Glycine 0 N--CA 1.43 -1.719 0 N-CA-C 109.123 -1.591 . . . . 1.0 109.123 -176.375 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 4.6 mm-40 -135.11 -156.02 0.69 Allowed 'General case' 0 N--CA 1.43 -1.458 0 N-CA-C 105.467 -2.049 . . . . 1.0 105.467 -172.158 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 18.8 m -145.71 137.64 25.31 Favored 'General case' 0 N--CA 1.431 -1.413 0 O-C-N 119.866 -1.771 . . . . 1.0 109.087 -154.267 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 1.3 t80 -30.72 -91.23 0.0 OUTLIER 'General case' 0 N--CA 1.43 -1.447 0 C-N-CA 128.702 2.801 . . . . 1.0 118.309 176.551 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 88' ' ' TRP . . . . . . . . . . . . . 56.0 m95 -73.72 -28.09 61.53 Favored 'General case' 0 N--CA 1.43 -1.463 0 O-C-N 120.794 -1.191 . . . . 1.0 111.499 -169.653 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 59.3 m-20 -74.75 -38.82 62.13 Favored 'General case' 0 N--CA 1.429 -1.506 0 C-N-CA 124.603 1.161 . . . . 1.0 114.06 -178.636 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . 0.46 ' CD2' ' HG ' ' A' ' 80' ' ' CYS . 58.2 tp -69.64 -45.5 68.32 Favored 'General case' 0 N--CA 1.43 -1.435 0 O-C-N 119.611 -1.931 . . . . 1.0 109.79 174.338 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 60.9 tp -50.93 -44.84 60.36 Favored 'General case' 0 N--CA 1.43 -1.469 0 C-N-CA 125.678 1.591 . . . . 1.0 114.35 170.278 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 2.9 tm-20 -55.78 -49.04 74.24 Favored 'General case' 0 N--CA 1.431 -1.384 0 C-N-CA 126.495 1.918 . . . . 1.0 113.505 172.193 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 1.8 tm0? -61.27 -50.92 71.08 Favored 'General case' 0 N--CA 1.429 -1.499 0 N-CA-C 114.253 1.205 . . . . 1.0 114.253 176.288 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -54.43 -44.26 72.29 Favored 'General case' 0 N--CA 1.431 -1.41 0 C-N-CA 128.019 2.528 . . . . 1.0 115.256 174.544 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -72.97 -45.82 55.82 Favored 'General case' 0 N--CA 1.431 -1.418 0 O-C-N 120.299 -1.5 . . . . 1.0 113.868 178.203 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 91.9 m -50.52 -45.77 56.85 Favored 'General case' 0 N--CA 1.428 -1.549 0 C-N-CA 127.125 2.17 . . . . 1.0 112.891 168.997 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 2.7 tp60 -57.28 -54.75 43.29 Favored 'General case' 0 N--CA 1.432 -1.371 0 C-N-CA 126.31 1.844 . . . . 1.0 113.188 172.795 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 10.1 mm100 -58.41 -45.18 88.91 Favored 'General case' 0 N--CA 1.43 -1.449 0 N-CA-C 116.345 1.98 . . . . 1.0 116.345 176.648 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -78.51 -43.21 27.43 Favored 'General case' 0 N--CA 1.429 -1.481 0 O-C-N 120.302 -1.499 . . . . 1.0 113.402 -178.926 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . 97.27 13.69 44.45 Favored Glycine 0 N--CA 1.431 -1.699 0 C-N-CA 125.085 1.326 . . . . 1.0 111.7 -172.98 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 8.0 tt0 -157.13 144.99 19.12 Favored 'General case' 0 N--CA 1.43 -1.455 0 N-CA-C 106.226 -1.768 . . . . 1.0 106.226 -174.665 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 57.0 m -58.86 119.2 6.74 Favored 'General case' 0 N--CA 1.429 -1.515 0 C-N-CA 125.078 1.351 . . . . 1.0 114.51 -178.726 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 92.2 t -96.19 130.42 44.88 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.45 0 C-N-CA 125.53 1.532 . . . . 1.0 108.816 -179.025 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 7.5 t -93.2 96.76 10.21 Favored 'General case' 0 N--CA 1.429 -1.487 0 C-N-CA 125.449 1.5 . . . . 1.0 114.448 -170.346 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 14.9 m-85 -118.23 -18.97 9.16 Favored 'General case' 0 N--CA 1.431 -1.421 0 C-N-CA 124.87 1.268 . . . . 1.0 111.278 172.17 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.26 1.658 0 O-C-N 120.965 -1.085 . . . . 1.0 113.849 -168.911 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 11.8 tpt . . . . . 0 CA--C 1.489 -1.387 0 CA-C-O 121.81 0.814 . . . . 1.0 111.087 . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 80.6 m-20 -109.89 76.09 0.97 Allowed 'General case' 0 N--CA 1.431 -1.413 0 O-C-N 120.905 -1.122 . . . . 1.0 111.081 -172.164 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 9.0 t70 -68.5 -42.31 78.79 Favored 'General case' 0 N--CA 1.429 -1.52 0 C-N-CA 124.635 1.174 . . . . 1.0 114.08 -172.328 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 15.9 t -64.17 -43.63 94.53 Favored 'General case' 0 N--CA 1.429 -1.478 0 O-C-N 120.473 -1.392 . . . . 1.0 112.904 175.846 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 9.4 mm-40 -55.02 -58.32 8.12 Favored 'General case' 0 N--CA 1.43 -1.433 0 C-N-CA 124.893 1.277 . . . . 1.0 113.168 172.908 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 31.3 t80 -50.59 -57.65 7.68 Favored 'General case' 0 N--CA 1.43 -1.426 0 N-CA-C 114.625 1.343 . . . . 1.0 114.625 172.873 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 37.4 m80 -65.07 -38.98 92.54 Favored 'General case' 0 N--CA 1.43 -1.436 0 N-CA-C 115.759 1.763 . . . . 1.0 115.759 -175.588 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 47.6 mtt-85 -62.79 -53.5 53.29 Favored 'General case' 0 N--CA 1.43 -1.432 0 CA-C-N 120.239 1.381 . . . . 1.0 112.972 172.14 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 98.2 mt -62.11 -42.86 99.65 Favored 'General case' 0 N--CA 1.43 -1.465 0 O-C-N 120.752 -1.217 . . . . 1.0 113.571 -178.394 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -62.78 -36.27 82.54 Favored 'General case' 0 N--CA 1.431 -1.424 0 N-CA-C 114.424 1.268 . . . . 1.0 114.424 174.965 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 10.8 t70 -61.17 -45.18 95.66 Favored 'General case' 0 N--CA 1.429 -1.491 0 O-C-N 120.569 -1.332 . . . . 1.0 111.762 172.741 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 29.4 mm100 -57.19 -39.85 76.2 Favored 'General case' 0 N--CA 1.429 -1.49 0 N-CA-C 115.019 1.488 . . . . 1.0 115.019 173.759 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 28.5 mt -59.78 -52.49 65.24 Favored 'General case' 0 N--CA 1.43 -1.452 0 O-C-N 120.312 -1.493 . . . . 1.0 112.942 171.436 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 0.7 OUTLIER -42.67 -56.11 3.28 Favored 'General case' 0 N--CA 1.43 -1.466 0 C-N-CA 127.028 2.131 . . . . 1.0 114.305 174.606 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 44.1 mt -60.32 -48.8 80.19 Favored 'General case' 0 N--CA 1.429 -1.51 0 C-N-CA 124.437 1.095 . . . . 1.0 113.701 176.279 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 24.1 m -64.67 -45.88 84.84 Favored 'General case' 0 N--CA 1.43 -1.43 0 C-N-CA 124.831 1.253 . . . . 1.0 113.539 -175.132 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 65.7 mt -59.53 -51.23 75.17 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.499 0 C-N-CA 126.018 1.727 . . . . 1.0 111.024 175.821 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 4.8 tt0 -55.62 -51.2 67.99 Favored 'General case' 0 N--CA 1.43 -1.438 0 N-CA-C 112.972 0.731 . . . . 1.0 112.972 176.064 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 13.0 tt0 -60.49 -44.75 95.61 Favored 'General case' 0 N--CA 1.429 -1.522 0 N-CA-C 115.3 1.592 . . . . 1.0 115.3 -178.493 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -67.54 -39.14 85.01 Favored 'General case' 0 N--CA 1.431 -1.42 0 O-C-N 119.925 -1.734 . . . . 1.0 112.465 178.113 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 15.2 mt -62.1 -57.11 12.78 Favored 'General case' 0 N--CA 1.431 -1.393 0 N-CA-C 114.628 1.344 . . . . 1.0 114.628 170.724 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 7.6 t70 -52.92 -37.99 61.35 Favored 'General case' 0 N--CA 1.432 -1.368 0 C-N-CA 127.092 2.157 . . . . 1.0 114.962 179.441 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 29.0 t70 -74.96 -0.42 18.66 Favored 'General case' 0 N--CA 1.429 -1.485 0 O-C-N 120.102 -1.624 . . . . 1.0 115.109 179.81 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 24' ' ' TRP . . . . . . . . . . . . . 68.4 t-105 -75.27 129.38 37.34 Favored 'General case' 0 N--CA 1.431 -1.385 0 O-C-N 118.433 -2.667 . . . . 1.0 112.496 172.237 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 34.3 m-20 -117.74 136.5 53.33 Favored 'General case' 0 N--CA 1.43 -1.465 0 N-CA-C 106.788 -1.56 . . . . 1.0 106.788 167.814 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -172.31 -149.01 6.46 Favored Glycine 0 N--CA 1.431 -1.672 0 N-CA-C 110.043 -1.223 . . . . 1.0 110.043 178.724 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 1.5 t70 -79.36 -28.8 41.98 Favored 'General case' 0 N--CA 1.43 -1.462 0 CA-C-O 122.293 1.044 . . . . 1.0 110.694 179.867 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 96.1 p -86.31 -164.41 1.04 Allowed 'General case' 0 N--CA 1.43 -1.465 0 C-N-CA 127.873 2.469 . . . . 1.0 113.749 -179.677 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 3.4 t70 -142.29 179.09 7.13 Favored 'General case' 0 N--CA 1.43 -1.444 0 O-C-N 120.313 -1.492 . . . . 1.0 109.851 176.21 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 7.4 tp -162.77 113.82 0.09 OUTLIER 'Isoleucine or valine' 0 N--CA 1.431 -1.411 0 CA-C-O 123.247 1.498 . . . . 1.0 110.626 -175.149 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -121.36 107.27 12.3 Favored 'General case' 0 N--CA 1.43 -1.458 0 O-C-N 120.363 -1.46 . . . . 1.0 108.991 169.593 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 91.2 m -87.03 139.02 30.99 Favored 'General case' 0 N--CA 1.43 -1.425 0 O-C-N 119.588 -1.945 . . . . 1.0 109.224 164.752 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -105.93 140.13 39.41 Favored 'General case' 0 N--CA 1.43 -1.429 0 C-N-CA 126.083 1.753 . . . . 1.0 110.85 -171.249 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 5.0 mm -115.32 106.85 21.35 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.453 0 C-N-CA 125.333 1.453 . . . . 1.0 107.796 -170.758 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 69.2 m-80 -128.36 -179.37 4.99 Favored 'General case' 0 N--CA 1.429 -1.481 0 O-C-N 120.465 -1.397 . . . . 1.0 110.636 176.069 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -73.22 94.86 0.73 Allowed Glycine 0 N--CA 1.431 -1.666 0 O-C-N 120.112 -1.618 . . . . 1.0 114.326 -167.174 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 78.19 25.33 61.89 Favored Glycine 0 N--CA 1.43 -1.741 0 C-N-CA 125.855 1.693 . . . . 1.0 112.675 -173.067 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 54.8 t -139.82 129.37 28.95 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.454 0 C-N-CA 124.176 0.99 . . . . 1.0 110.45 -167.139 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 14.4 mt -111.69 132.41 54.63 Favored 'General case' 0 N--CA 1.43 -1.445 0 N-CA-C 108.159 -1.052 . . . . 1.0 108.159 154.814 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 2.7 m -124.99 119.89 30.02 Favored 'General case' 0 N--CA 1.429 -1.481 0 N-CA-C 106.989 -1.486 . . . . 1.0 106.989 178.644 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 73.7 mt -93.92 120.53 43.47 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.437 0 O-C-N 120.767 -1.208 . . . . 1.0 108.206 -168.919 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 43.4 p -126.64 129.11 47.85 Favored 'General case' 0 N--CA 1.43 -1.438 0 CA-C-O 122.183 0.992 . . . . 1.0 111.619 178.577 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 43' ' ' PHE . . . . . . . . . . . . . 7.2 p90 -120.28 168.41 11.29 Favored 'General case' 0 N--CA 1.431 -1.424 0 O-C-N 120.372 -1.455 . . . . 1.0 109.57 172.563 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -64.52 -28.88 69.95 Favored 'General case' 0 N--CA 1.431 -1.423 0 N-CA-C 116.16 1.911 . . . . 1.0 116.16 -166.981 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 15.8 m-80 -66.82 -4.94 10.4 Favored 'General case' 0 N--CA 1.43 -1.461 0 C-N-CA 126.068 1.747 . . . . 1.0 114.824 173.181 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 103.23 15.74 22.69 Favored Glycine 0 N--CA 1.43 -1.717 0 O-C-N 120.063 -1.648 . . . . 1.0 116.894 158.874 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 3.2 t -91.86 -175.77 4.23 Favored 'General case' 0 N--CA 1.431 -1.404 0 CA-C-N 118.54 1.17 . . . . 1.0 113.639 -178.072 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -160.81 99.44 1.24 Allowed 'General case' 0 N--CA 1.43 -1.461 0 CA-C-O 122.967 1.365 . . . . 1.0 110.938 -174.401 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -107.58 119.95 58.08 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.443 0 N-CA-C 105.798 -1.927 . . . . 1.0 105.798 -174.468 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 3.7 tp -112.95 128.65 69.58 Favored 'Isoleucine or valine' 0 CA--C 1.488 -1.408 0 O-C-N 119.611 -1.931 . . . . 1.0 111.789 -165.897 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 4.1 mt -124.99 127.59 72.5 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.489 0 C-N-CA 126.749 2.02 . . . . 1.0 110.558 -179.173 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 52' ' ' ASN . . . . . 0.444 ' H ' ' HD1' ' A' ' 61' ' ' TRP . 6.8 t-20 -162.47 169.71 19.92 Favored 'General case' 0 N--CA 1.431 -1.416 0 N-CA-C 105.347 -2.094 . . . . 1.0 105.347 -165.706 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 34.4 ttp180 -155.03 136.17 13.91 Favored 'General case' 0 N--CA 1.431 -1.418 0 O-C-N 120.761 -1.212 . . . . 1.0 110.754 -156.651 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 4.7 mm100 -97.26 127.59 43.35 Favored 'General case' 0 N--CA 1.429 -1.512 0 N-CA-C 107.115 -1.439 . . . . 1.0 107.115 177.673 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 87.4 mt-10 -58.58 -37.62 56.32 Favored Pre-proline 0 N--CA 1.429 -1.502 0 CA-C-O 114.812 -2.518 . . . . 1.0 117.004 167.132 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 68.5 Cg_endo -79.33 155.85 25.34 Favored 'Trans proline' 0 N--CA 1.434 -2.025 0 CA-C-N 127.694 3.783 . . . . 1.0 111.793 161.379 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . 0.361 5.5 mp 67.06 134.94 0.02 OUTLIER 'General case' 0 N--CA 1.431 -1.411 0 CA-C-O 124.553 2.12 . . . . 1.0 115.95 -174.213 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 22.0 m170 -76.15 41.72 0.24 Allowed 'General case' 0 N--CA 1.429 -1.51 0 C-N-CA 126.416 1.886 . . . . 1.0 114.869 -176.23 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 2.1 pt20 -146.91 158.34 43.89 Favored 'General case' 0 N--CA 1.431 -1.379 0 O-C-N 119.402 -2.061 . . . . 1.0 110.073 -171.657 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 93.0 t -118.28 162.28 16.48 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.402 0 N-CA-C 107.03 -1.47 . . . . 1.0 107.03 -177.305 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 61' ' ' TRP . . . . . 0.444 ' HD1' ' H ' ' A' ' 52' ' ' ASN . 0.0 OUTLIER -104.17 153.24 21.19 Favored 'General case' 0 N--CA 1.43 -1.453 0 O-C-N 119.654 -1.904 . . . . 1.0 109.907 178.963 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 2.0 pt? -143.68 126.39 16.08 Favored 'General case' 0 N--CA 1.431 -1.408 0 O-C-N 120.24 -1.538 . . . . 1.0 108.564 158.897 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -120.18 146.79 45.67 Favored 'General case' 0 N--CA 1.429 -1.499 0 CA-C-O 122.46 1.124 . . . . 1.0 112.486 176.09 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 64' ' ' THR . . . . . . . . . . . . . 72.0 p -136.52 -148.99 0.3 Allowed 'General case' 0 N--CA 1.429 -1.513 0 C-N-CA 125.702 1.601 . . . . 1.0 110.503 -152.206 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 12.2 tmtt? -60.7 -67.5 0.39 Allowed 'General case' 0 N--CA 1.429 -1.498 0 C-N-CA 126.654 1.982 . . . . 1.0 112.675 173.817 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 13.1 tt0 -131.0 -22.04 2.62 Favored 'General case' 0 N--CA 1.43 -1.433 0 O-C-N 121.098 -1.001 . . . . 1.0 113.458 176.97 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . -82.98 -99.29 0.52 Allowed Glycine 0 N--CA 1.43 -1.719 0 O-C-N 119.838 -1.789 . . . . 1.0 114.033 -176.397 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 69.3 149.01 0.29 Allowed Glycine 0 N--CA 1.43 -1.72 0 N-CA-C 116.261 1.264 . . . . 1.0 116.261 -171.951 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 1.4 t80 -166.44 169.19 14.16 Favored 'General case' 0 N--CA 1.43 -1.448 0 N-CA-C 107.408 -1.33 . . . . 1.0 107.408 168.262 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 3.7 p-80 -95.23 159.29 15.08 Favored 'General case' 0 N--CA 1.429 -1.492 0 O-C-N 120.17 -1.582 . . . . 1.0 111.811 172.817 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 43.5 p90 -138.48 133.49 32.78 Favored 'General case' 0 N--CA 1.43 -1.471 0 N-CA-C 114.817 1.414 . . . . 1.0 114.817 -158.825 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 43.0 m-20 -105.43 176.28 5.22 Favored 'General case' 0 N--CA 1.431 -1.422 0 C-N-CA 126.361 1.865 . . . . 1.0 109.445 -176.403 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 45.8 tp -110.6 125.46 53.43 Favored 'General case' 0 N--CA 1.431 -1.397 0 O-C-N 119.588 -1.945 . . . . 1.0 110.551 177.974 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 94.5 mttt -73.91 -99.13 0.01 OUTLIER 'General case' 0 N--CA 1.43 -1.472 0 O-C-N 120.645 -1.285 . . . . 1.0 112.238 154.3 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -131.46 -57.51 0.09 OUTLIER Glycine 0 N--CA 1.43 -1.74 0 O-C-N 120.165 -1.584 . . . . 1.0 113.544 -174.547 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 48.6 m-20 -111.34 3.63 18.41 Favored 'General case' 0 N--CA 1.43 -1.469 0 C-N-CA 125.724 1.609 . . . . 1.0 109.99 178.535 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -147.91 120.89 8.79 Favored 'General case' 0 N--CA 1.429 -1.522 0 N-CA-C 105.484 -2.043 . . . . 1.0 105.484 -162.038 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 78' ' ' TRP . . . . . . . . . . . . . 71.5 m95 -84.41 124.39 31.27 Favored 'General case' 0 N--CA 1.431 -1.406 0 N-CA-C 104.099 -2.556 . . . . 1.0 104.099 168.435 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -126.01 139.17 52.29 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.474 0 O-C-N 119.92 -1.738 . . . . 1.0 110.304 -166.589 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 79.9 m -78.09 134.79 37.67 Favored 'General case' 0 N--CA 1.429 -1.488 0 O-C-N 119.837 -1.789 . . . . 1.0 113.306 -174.767 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 25.7 t0 -81.86 55.07 2.62 Favored 'General case' 0 N--CA 1.431 -1.413 0 O-C-N 120.145 -1.597 . . . . 1.0 113.532 -174.401 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -149.82 -152.1 0.42 Allowed 'General case' 0 N--CA 1.43 -1.466 0 O-C-N 120.126 -1.609 . . . . 1.0 108.381 -175.7 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 58.2 p -72.62 -19.74 61.4 Favored 'General case' 0 N--CA 1.43 -1.451 0 O-C-N 119.909 -1.745 . . . . 1.0 114.582 -175.216 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -132.36 78.98 0.35 Allowed Glycine 0 N--CA 1.432 -1.628 0 N-CA-C 109.189 -1.564 . . . . 1.0 109.189 -173.93 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 11.8 pt-20 -73.42 88.38 1.59 Allowed 'General case' 0 N--CA 1.431 -1.411 0 N-CA-C 116.334 1.976 . . . . 1.0 116.334 -174.566 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 24.8 m -166.63 124.52 1.37 Allowed 'General case' 0 N--CA 1.429 -1.498 0 C-N-CA 125.245 1.418 . . . . 1.0 111.485 172.942 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 3.0 t80 -53.63 -81.97 0.01 OUTLIER 'General case' 0 N--CA 1.43 -1.449 0 C-N-CA 127.031 2.133 . . . . 1.0 116.129 176.617 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 88' ' ' TRP . . . . . . . . . . . . . 0.3 OUTLIER -64.38 -35.11 79.83 Favored 'General case' 0 N--CA 1.43 -1.458 0 O-C-N 120.343 -1.473 . . . . 1.0 114.095 -170.344 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -68.01 -33.1 73.96 Favored 'General case' 0 N--CA 1.429 -1.476 0 C-N-CA 125.136 1.374 . . . . 1.0 114.64 175.577 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 52.8 tp -71.78 -44.44 63.99 Favored 'General case' 0 N--CA 1.429 -1.478 0 O-C-N 119.387 -2.071 . . . . 1.0 110.791 173.204 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 8.1 tt -52.54 -43.12 64.98 Favored 'General case' 0 N--CA 1.43 -1.474 0 C-N-CA 126.571 1.948 . . . . 1.0 113.575 170.985 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 4.9 tt0 -53.09 -60.31 3.45 Favored 'General case' 0 N--CA 1.429 -1.488 0 C-N-CA 126.503 1.921 . . . . 1.0 112.548 168.216 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 20.1 tt0 -52.28 -48.26 65.39 Favored 'General case' 0 N--CA 1.431 -1.414 0 C-N-CA 125.032 1.333 . . . . 1.0 114.314 -177.51 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -55.92 -57.53 11.69 Favored 'General case' 0 N--CA 1.429 -1.519 0 C-N-CA 127.961 2.504 . . . . 1.0 116.16 171.246 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -73.79 -37.0 65.1 Favored 'General case' 0 N--CA 1.43 -1.44 0 O-C-N 118.945 -2.347 . . . . 1.0 112.891 -173.964 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 3.1 m -62.35 -40.12 95.36 Favored 'General case' 0 N--CA 1.43 -1.465 0 C-N-CA 125.141 1.376 . . . . 1.0 112.533 170.8 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 3.0 pt20 -67.59 -30.85 70.56 Favored 'General case' 0 N--CA 1.429 -1.502 0 O-C-N 120.424 -1.422 . . . . 1.0 113.989 178.05 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 15.9 mm-40 -74.07 -47.43 36.62 Favored 'General case' 0 N--CA 1.43 -1.469 0 N-CA-C 114.816 1.413 . . . . 1.0 114.816 168.729 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -72.19 -42.45 65.8 Favored 'General case' 0 N--CA 1.429 -1.502 0 N-CA-C 115.933 1.827 . . . . 1.0 115.933 -176.502 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . 92.31 29.07 11.7 Favored Glycine 0 N--CA 1.43 -1.766 0 C-N-CA 125.078 1.323 . . . . 1.0 113.159 -177.442 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 11.9 pt-20 -167.95 171.65 9.58 Favored 'General case' 0 N--CA 1.43 -1.432 0 O-C-N 121.514 -0.992 . . . . 1.0 110.372 -170.256 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 16.5 m -67.48 121.46 15.86 Favored 'General case' 0 N--CA 1.43 -1.433 0 O-C-N 120.827 -1.171 . . . . 1.0 111.144 176.531 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 9.8 p -98.39 160.42 3.15 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.492 0 C-N-CA 125.107 1.363 . . . . 1.0 107.984 -178.799 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 11.5 t -109.08 107.51 17.85 Favored 'General case' 0 N--CA 1.429 -1.513 0 O-C-N 121.025 -1.047 . . . . 1.0 112.875 -165.706 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 34.5 p90 -138.95 -37.54 0.52 Allowed 'General case' 0 N--CA 1.431 -1.398 0 O-C-N 120.515 -1.365 . . . . 1.0 113.056 -172.232 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 4.9 mtm180 . . . . . 0 C--O 1.259 1.595 0 C-N-CA 124.857 1.263 . . . . 1.0 110.034 177.484 . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 51.9 mtt . . . . . 0 CA--C 1.491 -1.293 0 CA-C-O 121.242 0.544 . . . . 1.0 112.282 . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 48.8 m-80 49.59 83.66 0.04 OUTLIER 'General case' 0 N--CA 1.43 -1.46 0 N-CA-C 117.309 2.337 . . . . 1.0 117.309 173.093 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 30.4 t70 -56.26 -49.4 74.3 Favored 'General case' 0 N--CA 1.43 -1.433 0 C-N-CA 125.978 1.711 . . . . 1.0 113.189 -178.225 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 12.9 m -58.95 -38.15 78.38 Favored 'General case' 0 N--CA 1.43 -1.462 0 N-CA-C 114.598 1.333 . . . . 1.0 114.598 -179.812 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 29.0 tt0 -67.67 -54.44 19.52 Favored 'General case' 0 N--CA 1.431 -1.411 0 C-N-CA 125.04 1.336 . . . . 1.0 111.907 176.051 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 1.1 t80 -49.23 -47.79 46.09 Favored 'General case' 0 N--CA 1.431 -1.4 0 C-N-CA 125.93 1.692 . . . . 1.0 113.94 170.182 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 1.0 OUTLIER -57.12 -50.17 73.62 Favored 'General case' 0 N--CA 1.431 -1.392 0 O-C-N 120.239 -1.538 . . . . 1.0 114.231 173.905 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 26.3 ttm-85 -62.24 -47.67 83.38 Favored 'General case' 0 N--CA 1.431 -1.407 0 CA-C-N 119.463 1.028 . . . . 1.0 112.406 -179.376 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 90.6 mt -55.17 -57.53 11.37 Favored 'General case' 0 N--CA 1.429 -1.481 0 C-N-CA 126.534 1.933 . . . . 1.0 112.167 173.172 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -53.52 -47.36 69.99 Favored 'General case' 0 N--CA 1.429 -1.516 0 O-C-N 120.563 -1.335 . . . . 1.0 114.024 178.863 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -61.85 -40.69 96.22 Favored 'General case' 0 N--CA 1.43 -1.437 0 N-CA-C 113.942 1.089 . . . . 1.0 113.942 178.643 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . 0.25 11.6 pt20 -71.87 -38.41 70.04 Favored 'General case' 0 N--CA 1.43 -1.467 0 N-CA-C 114.833 1.42 . . . . 1.0 114.833 175.452 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 82.8 mt -62.13 -50.5 71.66 Favored 'General case' 0 N--CA 1.43 -1.452 0 O-C-N 120.186 -1.572 . . . . 1.0 111.171 174.67 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 0.1 OUTLIER -52.25 -49.97 62.99 Favored 'General case' 0 N--CA 1.43 -1.445 0 C-N-CA 126.079 1.752 . . . . 1.0 111.903 177.264 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 55.2 tp -58.79 -54.01 51.95 Favored 'General case' 0 N--CA 1.431 -1.395 0 C-N-CA 125.441 1.496 . . . . 1.0 113.554 174.413 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 75.0 m -58.68 -57.16 14.22 Favored 'General case' 0 N--CA 1.431 -1.404 0 C-N-CA 124.716 1.207 . . . . 1.0 113.296 178.442 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 29.8 mt -50.74 -52.9 15.25 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.402 0 C-N-CA 125.711 1.604 . . . . 1.0 114.32 176.072 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 29.9 tt0 -57.96 -54.09 50.9 Favored 'General case' 0 N--CA 1.43 -1.429 0 O-C-N 120.709 -1.244 . . . . 1.0 113.639 178.169 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 7.0 tp10 -75.42 -32.45 60.72 Favored 'General case' 0 N--CA 1.431 -1.415 0 N-CA-C 114.838 1.422 . . . . 1.0 114.838 -172.142 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 20.0 tpt180 -75.87 -33.48 59.99 Favored 'General case' 0 N--CA 1.43 -1.434 0 O-C-N 119.943 -1.723 . . . . 1.0 112.981 175.686 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -76.66 -31.83 57.58 Favored 'General case' 0 N--CA 1.43 -1.428 0 O-C-N 120.269 -1.519 . . . . 1.0 110.927 175.659 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 19.7 t70 -58.86 -65.39 0.67 Allowed 'General case' 0 N--CA 1.43 -1.434 0 C-N-CA 125.959 1.704 . . . . 1.0 113.976 168.38 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 32.3 t70 -84.92 112.31 20.45 Favored 'General case' 0 N--CA 1.43 -1.433 0 CA-C-O 123.11 1.433 . . . . 1.0 111.426 178.826 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 24' ' ' TRP . . . . . . . . . . . . . 51.8 t-105 -132.95 -166.1 1.71 Allowed 'General case' 0 N--CA 1.431 -1.412 0 C-N-CA 125.429 1.492 . . . . 1.0 108.108 -174.167 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 5.7 t0 -138.86 85.59 2.09 Favored 'General case' 0 N--CA 1.429 -1.481 0 N-CA-C 106.006 -1.85 . . . . 1.0 106.006 172.211 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -161.12 -159.83 10.29 Favored Glycine 0 N--CA 1.43 -1.74 0 O-C-N 120.428 -1.42 . . . . 1.0 112.916 -173.315 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 9.1 t0 -113.1 -34.59 5.65 Favored 'General case' 0 N--CA 1.431 -1.397 0 C-N-CA 125.387 1.475 . . . . 1.0 111.096 -177.705 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 49.3 m -60.28 149.82 32.26 Favored 'General case' 0 N--CA 1.43 -1.43 0 C-N-CA 125.79 1.636 . . . . 1.0 113.602 178.032 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 2.4 t70 -110.11 151.54 27.11 Favored 'General case' 0 N--CA 1.431 -1.407 0 O-C-N 120.966 -1.084 . . . . 1.0 109.356 174.277 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 50.8 mm -139.83 115.68 8.49 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.426 0 C-N-CA 126.811 2.044 . . . . 1.0 105.487 -161.245 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 41.8 m-20 -119.55 100.65 7.41 Favored 'General case' 0 N--CA 1.432 -1.373 0 CA-C-O 122.126 0.965 . . . . 1.0 109.27 167.51 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 24.7 t -73.95 137.73 43.75 Favored 'General case' 0 N--CA 1.43 -1.446 0 O-C-N 119.372 -2.08 . . . . 1.0 111.363 162.585 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -94.66 149.51 21.17 Favored 'General case' 0 N--CA 1.429 -1.507 0 C-N-CA 126.625 1.97 . . . . 1.0 108.679 179.81 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 3.3 mp -135.51 106.6 6.5 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.439 0 CA-C-O 123.787 1.756 . . . . 1.0 109.278 -171.345 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 4.7 m120 -113.09 172.34 7.0 Favored 'General case' 0 N--CA 1.431 -1.418 0 N-CA-C 106.829 -1.545 . . . . 1.0 106.829 167.109 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -69.75 85.09 0.28 Allowed Glycine 0 N--CA 1.43 -1.729 0 N-CA-C 117.019 1.568 . . . . 1.0 117.019 -168.745 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 94.87 12.47 55.42 Favored Glycine 0 N--CA 1.431 -1.698 0 C-N-CA 126.19 1.853 . . . . 1.0 112.882 -177.27 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 44.9 t -132.28 131.88 60.72 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.452 0 N-CA-C 107.083 -1.451 . . . . 1.0 107.083 -175.6 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 68.5 mt -121.77 137.94 54.56 Favored 'General case' 0 N--CA 1.43 -1.436 0 O-C-N 120.698 -1.251 . . . . 1.0 109.558 174.187 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -128.68 107.18 9.47 Favored 'General case' 0 N--CA 1.432 -1.372 0 N-CA-C 107.193 -1.41 . . . . 1.0 107.193 -174.654 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 42.6 mt -89.55 122.67 41.15 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.451 0 O-C-N 119.456 -2.027 . . . . 1.0 109.355 -167.397 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 27.2 p -123.9 135.01 53.43 Favored 'General case' 0 N--CA 1.43 -1.465 0 CA-C-O 122.114 0.959 . . . . 1.0 113.389 -179.741 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 43' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -121.41 171.74 8.55 Favored 'General case' 0 N--CA 1.43 -1.459 0 O-C-N 120.444 -1.41 . . . . 1.0 111.534 173.406 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 14.7 mm-40 -52.12 -32.69 36.51 Favored 'General case' 0 N--CA 1.43 -1.446 0 N-CA-C 118.495 2.776 . . . . 1.0 118.495 -169.694 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 31.5 t30 -66.05 -12.41 55.11 Favored 'General case' 0 N--CA 1.432 -1.367 0 N-CA-C 114.783 1.401 . . . . 1.0 114.783 175.712 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 90.04 17.27 54.18 Favored Glycine 0 N--CA 1.43 -1.718 0 O-C-N 120.14 -1.6 . . . . 1.0 111.528 -179.485 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 73.4 m -91.72 157.8 16.72 Favored 'General case' 0 N--CA 1.429 -1.486 0 C-N-CA 126.019 1.728 . . . . 1.0 110.907 -174.074 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 5.2 ptmm? -149.21 121.47 8.39 Favored 'General case' 0 N--CA 1.431 -1.381 0 N-CA-C 114.089 1.144 . . . . 1.0 114.089 -151.211 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 1.7 mm -116.1 134.91 57.98 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.491 0 N-CA-C 107.012 -1.477 . . . . 1.0 107.012 176.415 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 3.5 tp -125.13 119.67 56.3 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.504 0 CA-C-N 121.887 2.13 . . . . 1.0 110.543 -179.969 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 3.9 mt -130.57 125.83 59.61 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.394 0 CA-C-O 123.588 1.661 . . . . 1.0 113.098 -167.728 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 7.6 t-20 -161.8 175.73 11.62 Favored 'General case' 0 N--CA 1.43 -1.445 0 N-CA-C 105.661 -1.977 . . . . 1.0 105.661 -171.302 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 1.4 ptp85 -108.86 153.97 22.77 Favored 'General case' 0 N--CA 1.43 -1.471 0 O-C-N 120.04 -1.663 . . . . 1.0 111.966 -173.444 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 15.7 mm100 -103.92 86.05 2.52 Favored 'General case' 0 N--CA 1.43 -1.429 0 C-N-CA 125.0 1.32 . . . . 1.0 108.187 173.209 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . 0.281 28.6 tt0 -61.43 -39.34 61.38 Favored Pre-proline 0 N--CA 1.43 -1.46 0 N-CA-C 118.923 2.934 . . . . 1.0 118.923 -161.682 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 77.0 Cg_exo -64.62 -7.71 15.33 Favored 'Trans proline' 0 C--N 1.298 -2.086 0 CA-C-N 126.474 3.348 . . . . 1.0 117.198 -178.447 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . 0.485 HD11 HE22 ' A' ' 59' ' ' GLN . 61.4 mt -117.75 -113.08 0.34 Allowed 'General case' 0 N--CA 1.43 -1.437 0 CA-C-N 120.115 1.325 . . . . 1.0 110.395 173.972 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 58' ' ' HIS . . . . . 0.439 ' C ' ' CD2' ' A' ' 58' ' ' HIS . 7.8 t60 -146.53 -30.23 0.37 Allowed 'General case' 0 N--CA 1.431 -1.411 0 C-N-CA 124.784 1.234 . . . . 1.0 111.484 -168.221 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 59' ' ' GLN . . . . . 0.485 HE22 HD11 ' A' ' 57' ' ' LEU . 16.5 pm0 -80.88 152.58 28.06 Favored 'General case' 0 N--CA 1.431 -1.409 0 CA-C-O 124.977 2.323 . . . . 1.0 116.845 -169.967 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 59.5 t -91.29 147.29 5.35 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.469 0 CA-C-N 113.008 -1.905 . . . . 1.0 108.096 171.615 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 61' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -106.8 148.06 28.94 Favored 'General case' 0 N--CA 1.43 -1.462 0 O-C-N 120.139 -1.601 . . . . 1.0 107.972 175.681 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 2.4 pt? -146.49 115.93 7.11 Favored 'General case' 0 N--CA 1.428 -1.536 0 CA-C-O 123.248 1.499 . . . . 1.0 111.122 166.019 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -100.29 140.27 34.78 Favored 'General case' 0 N--CA 1.431 -1.39 0 CA-C-O 123.255 1.502 . . . . 1.0 113.779 172.644 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 64' ' ' THR . . . . . . . . . . . . . 9.0 t -151.86 -167.15 2.7 Favored 'General case' 0 N--CA 1.431 -1.421 0 C-N-CA 126.364 1.866 . . . . 1.0 107.318 -169.137 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 33.1 tptt -69.49 -29.96 67.73 Favored 'General case' 0 N--CA 1.43 -1.466 0 N-CA-C 116.286 1.958 . . . . 1.0 116.286 -165.847 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 11.1 tt0 -77.7 -13.3 59.94 Favored 'General case' 0 N--CA 1.429 -1.485 0 O-C-N 120.208 -1.557 . . . . 1.0 113.874 176.079 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 146.67 -56.42 0.51 Allowed Glycine 0 N--CA 1.43 -1.748 0 O-C-N 119.529 -1.982 . . . . 1.0 112.133 174.123 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 123.67 124.44 2.9 Favored Glycine 0 N--CA 1.43 -1.714 0 O-C-N 121.723 -0.869 . . . . 1.0 115.002 -176.704 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 19.6 m-30 -120.56 170.16 9.67 Favored 'General case' 0 N--CA 1.43 -1.442 0 C-N-CA 125.727 1.611 . . . . 1.0 107.392 -177.227 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 28.4 p80 -114.54 159.34 20.51 Favored 'General case' 0 N--CA 1.43 -1.434 0 O-C-N 119.796 -1.815 . . . . 1.0 111.905 170.221 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 71' ' ' PHE . . . . . . . . . . . . 0.259 20.0 t80 -118.48 113.27 21.08 Favored 'General case' 0 N--CA 1.432 -1.361 0 C-N-CA 127.291 2.236 . . . . 1.0 108.587 -160.607 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -128.58 166.45 18.83 Favored 'General case' 0 N--CA 1.429 -1.49 0 C-N-CA 124.713 1.205 . . . . 1.0 108.689 -170.371 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -112.35 121.31 44.5 Favored 'General case' 0 N--CA 1.43 -1.447 0 O-C-N 119.02 -2.3 . . . . 1.0 112.865 -163.633 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 12.1 mmtm -110.97 79.64 1.22 Allowed 'General case' 0 N--CA 1.431 -1.399 0 O-C-N 120.057 -1.652 . . . . 1.0 110.143 167.572 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . 72.36 -79.92 0.64 Allowed Glycine 0 N--CA 1.431 -1.675 0 C-N-CA 125.668 1.604 . . . . 1.0 115.93 173.452 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -116.75 -7.49 11.49 Favored 'General case' 0 N--CA 1.429 -1.504 0 C-N-CA 125.233 1.413 . . . . 1.0 110.862 -178.739 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 53.9 mt-10 -131.16 125.47 33.11 Favored 'General case' 0 N--CA 1.43 -1.469 0 N-CA-C 105.537 -2.023 . . . . 1.0 105.537 -171.687 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 78' ' ' TRP . . . . . 0.427 ' HB2' ' HB3' ' A' ' 87' ' ' PHE . 71.3 m95 -82.82 111.51 18.8 Favored 'General case' 0 N--CA 1.43 -1.428 0 N-CA-C 107.391 -1.337 . . . . 1.0 107.391 174.472 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 8.6 mt -90.21 124.85 43.04 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.433 0 CA-C-O 124.032 1.872 . . . . 1.0 107.437 178.373 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 80' ' ' CYS . . . . . 0.445 ' HG ' HD22 ' A' ' 90' ' ' LEU . 38.5 m -76.96 121.36 23.36 Favored 'General case' 0 N--CA 1.429 -1.496 0 CA-C-N 113.971 -1.468 . . . . 1.0 108.7 177.935 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 11.8 t70 -71.75 -41.62 68.23 Favored 'General case' 0 N--CA 1.429 -1.51 0 N-CA-C 114.634 1.346 . . . . 1.0 114.634 -154.223 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 24.1 mmt85 -70.94 129.63 39.52 Favored 'General case' 0 N--CA 1.43 -1.46 0 O-C-N 121.195 -0.941 . . . . 1.0 109.057 173.545 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 83' ' ' SER . . . . . . . . . . . . 0.257 29.6 t 69.8 -71.09 0.13 Allowed 'General case' 0 N--CA 1.43 -1.446 0 C-N-CA 125.91 1.684 . . . . 1.0 112.21 -159.482 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 120.85 68.09 0.27 Allowed Glycine 0 N--CA 1.431 -1.663 0 N-CA-C 108.066 -2.013 . . . . 1.0 108.066 -168.467 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 85' ' ' GLU . . . . . 0.4 ' HB2' ' HB2' ' A' ' 80' ' ' CYS . 60.1 mm-40 -113.83 -145.48 0.4 Allowed 'General case' 0 N--CA 1.429 -1.477 0 C-N-CA 124.737 1.215 . . . . 1.0 108.306 -171.252 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 93.2 m -150.57 133.99 16.38 Favored 'General case' 0 N--CA 1.43 -1.474 0 O-C-N 119.561 -1.962 . . . . 1.0 108.945 -160.685 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 87' ' ' PHE . . . . . 0.427 ' HB3' ' HB2' ' A' ' 78' ' ' TRP 0.278 0.0 OUTLIER -39.91 -85.95 0.0 OUTLIER 'General case' 0 N--CA 1.43 -1.447 0 N-CA-C 120.373 3.471 . . . . 1.0 120.373 179.923 . . . . . . . . 4 4 . 1 . 012 nuclear orig full ' A' A ' 88' ' ' TRP . . . . . . . . . . . . . 65.9 m95 -68.85 -29.62 67.97 Favored 'General case' 0 N--CA 1.43 -1.433 0 O-C-N 120.682 -1.261 . . . . 1.0 113.321 -172.956 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 24.0 m-20 -71.31 -38.81 71.73 Favored 'General case' 0 N--CA 1.429 -1.485 0 O-C-N 120.987 -1.071 . . . . 1.0 113.607 175.87 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . 0.445 HD22 ' HG ' ' A' ' 80' ' ' CYS . 45.3 tp -69.06 -44.07 73.35 Favored 'General case' 0 N--CA 1.43 -1.447 0 O-C-N 119.817 -1.802 . . . . 1.0 110.658 175.987 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 10.2 tt -49.14 -50.55 37.0 Favored 'General case' 0 N--CA 1.43 -1.429 0 C-N-CA 126.494 1.917 . . . . 1.0 113.371 172.272 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 37.4 tt0 -54.97 -57.93 9.68 Favored 'General case' 0 N--CA 1.431 -1.41 0 C-N-CA 126.706 2.002 . . . . 1.0 113.133 171.694 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 30.4 tt0 -50.58 -48.27 57.65 Favored 'General case' 0 CA--C 1.488 -1.414 0 C-N-CA 127.337 2.255 . . . . 1.0 114.595 178.364 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -65.85 -45.96 80.25 Favored 'General case' 0 N--CA 1.431 -1.421 0 C-N-CA 127.39 2.276 . . . . 1.0 114.377 174.919 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -63.19 -43.87 96.98 Favored 'General case' 0 N--CA 1.43 -1.46 0 O-C-N 120.03 -1.669 . . . . 1.0 112.97 177.453 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 15.5 m -55.46 -43.41 75.43 Favored 'General case' 0 N--CA 1.43 -1.472 0 C-N-CA 126.17 1.788 . . . . 1.0 114.087 170.017 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 2.2 pt20 -72.41 -28.55 63.05 Favored 'General case' 0 N--CA 1.43 -1.439 0 N-CA-C 114.893 1.442 . . . . 1.0 114.893 177.154 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 14.3 mm-40 -66.91 -57.37 7.09 Favored 'General case' 0 N--CA 1.43 -1.47 0 O-C-N 120.906 -1.122 . . . . 1.0 111.992 171.235 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -80.02 -46.21 17.01 Favored 'General case' 0 N--CA 1.43 -1.448 0 N-CA-C 115.723 1.749 . . . . 1.0 115.723 -172.323 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . 87.6 49.52 3.86 Favored Glycine 0 N--CA 1.43 -1.721 0 O-C-N 120.935 -1.103 . . . . 1.0 112.048 -168.37 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 19.3 tt0 -164.81 159.53 18.59 Favored 'General case' 0 N--CA 1.429 -1.513 0 N-CA-C 106.252 -1.759 . . . . 1.0 106.252 -176.268 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 45.9 m -72.16 99.09 2.26 Favored 'General case' 0 N--CA 1.431 -1.406 0 O-C-N 119.554 -1.966 . . . . 1.0 110.681 166.227 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 46.2 t -110.51 112.7 41.71 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.433 0 N-CA-C 105.643 -1.984 . . . . 1.0 105.643 178.066 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 7.5 t -141.42 176.44 8.86 Favored 'General case' 0 N--CA 1.431 -1.413 0 O-C-N 121.328 -0.857 . . . . 1.0 109.591 -171.043 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 5.7 m-85 -111.69 -14.99 13.53 Favored 'General case' 0 N--CA 1.43 -1.439 0 C-N-CA 125.147 1.379 . . . . 1.0 110.288 174.418 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 37.1 mmt180 . . . . . 0 C--O 1.26 1.649 0 O-C-N 120.619 -1.301 . . . . 1.0 111.554 -176.87 . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 46.8 ttp . . . . . 0 CA--C 1.489 -1.394 0 CA-C-O 121.079 0.466 . . . . 1.0 111.878 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 1.4 t-20 -106.7 -172.25 2.05 Favored 'General case' 0 N--CA 1.43 -1.426 0 O-C-N 120.294 -1.504 . . . . 1.0 113.251 -166.024 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . 0.266 1.3 p-10 -61.54 -48.9 78.93 Favored 'General case' 0 N--CA 1.431 -1.395 0 N-CA-C 116.153 1.908 . . . . 1.0 116.153 -164.752 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 63.2 p -61.97 -37.53 85.11 Favored 'General case' 0 N--CA 1.43 -1.44 0 C-N-CA 124.855 1.262 . . . . 1.0 113.04 179.146 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 28.9 mt-10 -69.85 -49.61 50.72 Favored 'General case' 0 N--CA 1.43 -1.435 0 C-N-CA 126.501 1.92 . . . . 1.0 112.102 179.725 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 2.3 m-85 -60.14 -38.6 83.6 Favored 'General case' 0 N--CA 1.431 -1.392 0 C-N-CA 124.177 0.991 . . . . 1.0 112.93 172.815 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 25.2 t60 -65.76 -48.38 72.02 Favored 'General case' 0 N--CA 1.43 -1.459 0 C-N-CA 125.744 1.618 . . . . 1.0 111.792 177.684 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 41.8 ttp-105 -56.03 -57.04 13.81 Favored 'General case' 0 N--CA 1.431 -1.425 0 C-N-CA 124.808 1.243 . . . . 1.0 112.888 177.708 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 36.9 mt -57.74 -42.06 83.12 Favored 'General case' 0 N--CA 1.431 -1.412 0 C-N-CA 124.212 1.005 . . . . 1.0 113.235 178.147 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -57.23 -57.96 10.32 Favored 'General case' 0 N--CA 1.431 -1.376 0 C-N-CA 124.3 1.04 . . . . 1.0 113.123 173.006 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 14.6 t70 -54.43 -45.75 73.07 Favored 'General case' 0 CA--C 1.489 -1.396 0 C-N-CA 125.613 1.565 . . . . 1.0 113.877 -177.005 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 18.4 mt-30 -57.23 -55.2 37.88 Favored 'General case' 0 N--CA 1.431 -1.424 0 N-CA-C 115.194 1.553 . . . . 1.0 115.194 170.694 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 3.1 pp -70.9 -37.04 72.96 Favored 'General case' 0 N--CA 1.43 -1.463 0 O-C-N 119.738 -1.851 . . . . 1.0 115.789 -178.113 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 0.8 OUTLIER -43.91 -60.15 1.96 Allowed 'General case' 0 N--CA 1.429 -1.489 0 C-N-CA 128.155 2.582 . . . . 1.0 112.425 165.859 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 50.7 tp -62.01 -42.72 99.46 Favored 'General case' 0 N--CA 1.429 -1.478 0 C-N-CA 124.299 1.04 . . . . 1.0 113.611 178.396 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 87.4 m -55.44 -52.07 64.8 Favored 'General case' 0 N--CA 1.431 -1.41 0 C-N-CA 125.609 1.564 . . . . 1.0 112.986 176.61 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 78.0 mt -58.78 -52.26 62.26 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.462 0 C-N-CA 125.825 1.65 . . . . 1.0 112.27 175.71 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 2.1 tt0 -56.2 -49.93 72.66 Favored 'General case' 0 N--CA 1.43 -1.432 0 N-CA-C 114.194 1.183 . . . . 1.0 114.194 -177.729 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 34.1 tt0 -65.32 -48.54 72.72 Favored 'General case' 0 N--CA 1.43 -1.436 0 O-C-N 120.928 -1.108 . . . . 1.0 113.637 178.361 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 7.9 tpt180 -61.8 -49.83 74.76 Favored 'General case' 0 N--CA 1.43 -1.454 0 C-N-CA 124.045 0.938 . . . . 1.0 112.647 -176.843 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 11.2 mp -72.62 -30.2 64.13 Favored 'General case' 0 N--CA 1.43 -1.45 0 C-N-CA 124.494 1.118 . . . . 1.0 113.733 -177.756 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 7.9 t70 -66.48 -51.97 51.08 Favored 'General case' 0 N--CA 1.429 -1.509 0 O-C-N 120.371 -1.455 . . . . 1.0 113.506 171.356 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 2.0 t70 -69.82 -24.35 63.45 Favored 'General case' 0 N--CA 1.429 -1.494 0 O-C-N 120.15 -1.594 . . . . 1.0 113.597 -176.525 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 24' ' ' TRP . . . . . . . . . . . . . 59.3 t-105 -45.9 -54.01 8.9 Favored 'General case' 0 N--CA 1.429 -1.492 0 C-N-CA 128.201 2.6 . . . . 1.0 116.989 178.366 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 28.6 t0 66.27 173.6 0.24 Allowed 'General case' 0 N--CA 1.429 -1.492 0 C-N-CA 127.033 2.133 . . . . 1.0 112.884 -175.406 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -168.3 -151.83 7.31 Favored Glycine 0 N--CA 1.429 -1.801 0 O-C-N 119.053 -2.279 . . . . 1.0 112.574 -172.599 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 36.7 t70 -83.45 -47.23 11.61 Favored 'General case' 0 N--CA 1.43 -1.427 0 N-CA-C 107.697 -1.223 . . . . 1.0 107.697 161.736 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 83.2 p -87.62 167.61 13.75 Favored 'General case' 0 N--CA 1.429 -1.506 0 C-N-CA 124.807 1.243 . . . . 1.0 110.988 173.566 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . 0.436 ' H ' ' HG2' ' A' ' 44' ' ' GLU . 2.9 t70 -110.09 179.21 4.17 Favored 'General case' 0 N--CA 1.43 -1.453 0 O-C-N 120.763 -1.211 . . . . 1.0 109.583 -173.016 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -157.61 129.24 0.95 Allowed 'Isoleucine or valine' 0 N--CA 1.43 -1.46 0 CA-C-O 123.117 1.437 . . . . 1.0 108.933 -161.874 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 26.7 m-20 -132.72 105.31 7.1 Favored 'General case' 0 N--CA 1.429 -1.489 0 C-N-CA 126.707 2.003 . . . . 1.0 110.343 170.041 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 10.4 t -85.23 142.44 29.41 Favored 'General case' 0 N--CA 1.43 -1.469 0 O-C-N 118.92 -2.362 . . . . 1.0 110.809 170.811 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 2.2 tp10 -113.5 137.88 50.92 Favored 'General case' 0 N--CA 1.428 -1.546 0 C-N-CA 124.13 0.972 . . . . 1.0 109.9 178.708 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 5.1 tp -117.44 121.03 66.63 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.428 0 C-N-CA 126.516 1.926 . . . . 1.0 107.079 178.759 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 32.0 m120 -124.77 -176.33 3.51 Favored 'General case' 0 N--CA 1.43 -1.45 0 C-N-CA 126.1 1.76 . . . . 1.0 108.52 168.31 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -65.52 91.08 0.13 Allowed Glycine 0 N--CA 1.43 -1.703 0 O-C-N 120.105 -1.622 . . . . 1.0 116.047 -171.0 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 85.65 2.93 86.62 Favored Glycine 0 N--CA 1.429 -1.815 0 C-N-CA 125.115 1.341 . . . . 1.0 113.898 -176.258 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 33.4 t -124.53 125.38 70.07 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.449 0 C-N-CA 124.045 0.938 . . . . 1.0 109.983 -168.88 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 27.7 mt -115.73 130.63 56.92 Favored 'General case' 0 N--CA 1.43 -1.462 0 CA-C-O 122.623 1.202 . . . . 1.0 108.239 165.242 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 5.2 p -120.87 119.44 32.67 Favored 'General case' 0 N--CA 1.429 -1.482 0 N-CA-C 106.995 -1.483 . . . . 1.0 106.995 170.773 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 33.5 mt -92.82 113.09 27.19 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.455 0 N-CA-C 106.8 -1.556 . . . . 1.0 106.8 -177.203 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -99.35 128.04 45.43 Favored 'General case' 0 N--CA 1.43 -1.464 0 N-CA-C 108.434 -0.95 . . . . 1.0 108.434 -175.979 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 43' ' ' PHE . . . . . . . . . . . . . 5.4 p90 -116.14 151.06 36.38 Favored 'General case' 0 N--CA 1.43 -1.435 0 N-CA-C 107.394 -1.336 . . . . 1.0 107.394 171.386 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . 0.436 ' HG2' ' H ' ' A' ' 29' ' ' ASP . 0.2 OUTLIER -71.18 -13.42 61.92 Favored 'General case' 0 N--CA 1.43 -1.444 0 N-CA-C 116.334 1.976 . . . . 1.0 116.334 -153.986 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 19.7 t-20 -64.95 -19.56 66.02 Favored 'General case' 0 N--CA 1.43 -1.447 0 C-N-CA 127.457 2.303 . . . . 1.0 113.219 172.909 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 102.32 13.81 29.85 Favored Glycine 0 N--CA 1.429 -1.796 0 O-C-N 120.37 -1.456 . . . . 1.0 114.186 170.145 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 3.5 m -112.3 174.02 6.08 Favored 'General case' 0 N--CA 1.43 -1.458 0 C-N-CA 124.473 1.109 . . . . 1.0 109.036 172.083 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 20.9 pttm -156.9 148.92 22.85 Favored 'General case' 0 N--CA 1.431 -1.393 0 O-C-N 120.938 -1.101 . . . . 1.0 113.378 -160.863 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 7.5 mm -97.13 138.44 22.07 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.454 0 N-CA-C 106.355 -1.72 . . . . 1.0 106.355 171.171 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 50' ' ' ILE . . . . . 0.402 ' HB ' ' HB3' ' A' ' 63' ' ' ALA . 4.1 mm -122.77 115.89 47.21 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.473 0 CA-C-N 119.598 1.09 . . . . 1.0 110.233 -175.953 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 2.1 mt -129.4 126.22 63.19 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.501 0 O-C-N 120.536 -1.352 . . . . 1.0 110.61 176.868 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 52' ' ' ASN . . . . . 0.419 ' H ' ' HD1' ' A' ' 61' ' ' TRP . 15.1 p30 -151.2 165.47 33.82 Favored 'General case' 0 N--CA 1.429 -1.509 0 CA-C-O 122.971 1.367 . . . . 1.0 108.592 176.923 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 40.1 ptt85 -148.78 152.44 36.55 Favored 'General case' 0 N--CA 1.431 -1.41 0 CA-C-N 114.474 -1.239 . . . . 1.0 108.877 -172.67 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 68.8 mm-40 -116.4 107.99 15.48 Favored 'General case' 0 N--CA 1.429 -1.478 0 N-CA-C 107.026 -1.472 . . . . 1.0 107.026 171.46 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 15.5 tt0 -58.95 -41.61 89.45 Favored Pre-proline 0 N--CA 1.43 -1.435 0 N-CA-C 116.112 1.893 . . . . 1.0 116.112 -172.504 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 83.7 Cg_exo -69.25 -18.49 39.39 Favored 'Trans proline' 0 N--CA 1.433 -2.052 0 CA-C-N 126.173 3.24 . . . . 1.0 117.79 178.185 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . 0.381 3.9 pp -96.72 -14.41 22.05 Favored 'General case' 0 N--CA 1.431 -1.414 0 N-CA-C 116.744 2.127 . . . . 1.0 116.744 -170.766 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 5.9 m170 73.23 52.96 0.13 Allowed 'General case' 0 N--CA 1.43 -1.436 0 C-N-CA 125.003 1.321 . . . . 1.0 114.536 174.095 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 34.0 tt0 -162.05 158.26 24.66 Favored 'General case' 0 N--CA 1.43 -1.438 0 C-N-CA 124.515 1.126 . . . . 1.0 108.079 172.45 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 55.0 t -119.38 152.76 21.87 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.48 0 C-N-CA 126.106 1.762 . . . . 1.0 110.408 178.997 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 61' ' ' TRP . . . . . 0.419 ' HD1' ' H ' ' A' ' 52' ' ' ASN . 0.0 OUTLIER -104.84 152.59 22.42 Favored 'General case' 0 N--CA 1.43 -1.448 0 C-N-CA 125.463 1.505 . . . . 1.0 109.471 176.026 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -145.12 97.02 2.94 Favored 'General case' 0 N--CA 1.431 -1.401 0 O-C-N 120.804 -1.185 . . . . 1.0 110.548 -176.874 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . 0.402 ' HB3' ' HB ' ' A' ' 50' ' ' ILE . . . -122.6 149.18 44.33 Favored 'General case' 0 N--CA 1.431 -1.416 0 O-C-N 119.708 -1.87 . . . . 1.0 115.993 179.508 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 64' ' ' THR . . . . . . . . . . . . . 5.9 m -151.24 -94.69 0.06 Allowed 'General case' 0 N--CA 1.429 -1.482 0 C-N-CA 125.504 1.522 . . . . 1.0 111.269 175.041 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 10.7 tmtt? -99.59 -44.26 6.2 Favored 'General case' 0 N--CA 1.43 -1.448 0 C-N-CA 125.217 1.407 . . . . 1.0 110.387 -172.555 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 33.3 mm-40 -70.33 -23.57 62.85 Favored 'General case' 0 N--CA 1.43 -1.469 0 N-CA-C 113.831 1.048 . . . . 1.0 113.831 -174.403 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 136.75 -39.62 1.62 Allowed Glycine 0 N--CA 1.43 -1.757 0 O-C-N 121.398 -0.814 . . . . 1.0 111.9 166.774 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 140.95 123.86 1.99 Allowed Glycine 0 N--CA 1.43 -1.718 0 CA-C-O 122.279 0.933 . . . . 1.0 113.434 -179.842 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 21.5 m-30 -115.55 170.09 8.68 Favored 'General case' 0 N--CA 1.431 -1.424 0 C-N-CA 126.383 1.873 . . . . 1.0 107.189 176.744 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -115.29 161.02 19.07 Favored 'General case' 0 N--CA 1.43 -1.451 0 O-C-N 120.366 -1.459 . . . . 1.0 110.032 168.2 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 71' ' ' PHE . . . . . . . . . . . . 0.279 28.7 t80 -140.1 126.16 19.75 Favored 'General case' 0 N--CA 1.431 -1.413 0 C-N-CA 123.836 0.854 . . . . 1.0 109.889 -151.437 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 35.0 m-20 -136.73 156.51 48.42 Favored 'General case' 0 N--CA 1.43 -1.453 0 CA-C-O 121.994 0.902 . . . . 1.0 111.48 179.401 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 67.9 tp -84.69 136.72 33.61 Favored 'General case' 0 N--CA 1.43 -1.454 0 O-C-N 120.411 -1.431 . . . . 1.0 111.757 173.007 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 72.4 mmtt -89.19 -86.17 0.19 Allowed 'General case' 0 N--CA 1.43 -1.455 0 C-N-CA 124.868 1.267 . . . . 1.0 110.282 161.907 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -138.09 -55.31 0.05 OUTLIER Glycine 0 N--CA 1.428 -1.856 0 O-C-N 120.723 -1.235 . . . . 1.0 112.732 175.451 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 78.7 m-20 -97.2 -20.15 18.12 Favored 'General case' 0 N--CA 1.43 -1.467 0 C-N-CA 124.663 1.185 . . . . 1.0 110.755 173.742 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 26.6 tt0 -133.98 121.33 21.47 Favored 'General case' 0 N--CA 1.43 -1.441 0 N-CA-C 107.168 -1.419 . . . . 1.0 107.168 -151.673 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 78' ' ' TRP . . . . . . . . . . . . . 48.7 m95 -83.72 107.14 15.96 Favored 'General case' 0 N--CA 1.431 -1.403 0 N-CA-C 106.626 -1.62 . . . . 1.0 106.626 167.251 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER -93.2 154.28 3.25 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.467 0 CA-C-O 123.425 1.583 . . . . 1.0 107.142 178.885 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 59.2 m -84.08 125.59 32.26 Favored 'General case' 0 N--CA 1.431 -1.422 0 O-C-N 120.65 -1.281 . . . . 1.0 108.153 173.191 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 38.5 t70 -69.57 -53.77 17.29 Favored 'General case' 0 N--CA 1.43 -1.46 0 C-N-CA 126.38 1.872 . . . . 1.0 110.621 -173.551 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -76.46 137.23 39.56 Favored 'General case' 0 N--CA 1.428 -1.535 0 C-N-CA 125.961 1.704 . . . . 1.0 108.515 177.655 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 48.9 m 73.11 -59.63 0.56 Allowed 'General case' 0 N--CA 1.429 -1.52 0 C-N-CA 125.966 1.707 . . . . 1.0 113.161 -170.846 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 112.09 92.28 2.05 Favored Glycine 0 N--CA 1.429 -1.767 0 N-CA-C 109.008 -1.637 . . . . 1.0 109.008 -177.522 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -153.22 -154.04 0.51 Allowed 'General case' 0 N--CA 1.429 -1.485 0 CA-C-N 118.67 1.235 . . . . 1.0 109.513 -170.409 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 51.7 m -150.38 131.57 14.48 Favored 'General case' 0 N--CA 1.429 -1.489 0 O-C-N 120.671 -1.268 . . . . 1.0 109.501 -157.451 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . 0.26 0.0 OUTLIER -36.53 -91.63 0.0 OUTLIER 'General case' 0 N--CA 1.43 -1.462 0 N-CA-C 121.45 3.87 . . . . 1.0 121.45 178.827 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 88' ' ' TRP . . . . . . . . . . . . . 91.6 m95 -63.68 -27.87 69.52 Favored 'General case' 0 N--CA 1.429 -1.509 0 O-C-N 120.009 -1.682 . . . . 1.0 113.146 -173.198 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 3.2 t70 -68.9 -44.25 73.59 Favored 'General case' 0 N--CA 1.431 -1.41 0 C-N-CA 126.125 1.77 . . . . 1.0 112.601 175.857 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 45.1 tp -66.05 -45.15 82.42 Favored 'General case' 0 N--CA 1.43 -1.469 0 O-C-N 120.44 -1.413 . . . . 1.0 111.037 177.57 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 26.3 tp -55.92 -43.14 77.07 Favored 'General case' 0 N--CA 1.43 -1.475 0 C-N-CA 124.528 1.131 . . . . 1.0 113.472 175.868 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 34.6 tt0 -60.53 -47.49 85.93 Favored 'General case' 0 N--CA 1.431 -1.412 0 C-N-CA 126.254 1.821 . . . . 1.0 112.889 173.036 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 24.0 tt0 -59.18 -54.32 48.23 Favored 'General case' 0 N--CA 1.429 -1.48 0 C-N-CA 126.652 1.981 . . . . 1.0 113.45 177.538 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -54.05 -41.89 68.61 Favored 'General case' 0 N--CA 1.429 -1.48 0 C-N-CA 127.972 2.509 . . . . 1.0 114.264 175.328 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -73.94 -51.72 15.17 Favored 'General case' 0 N--CA 1.43 -1.436 0 N-CA-C 114.781 1.4 . . . . 1.0 114.781 178.546 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 1.6 t -61.16 -26.35 67.64 Favored 'General case' 0 N--CA 1.43 -1.464 0 O-C-N 119.236 -2.165 . . . . 1.0 114.1 175.809 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 7.5 tp-100 -62.65 -70.0 0.23 Allowed 'General case' 0 N--CA 1.43 -1.453 0 C-N-CA 126.31 1.844 . . . . 1.0 112.431 168.139 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 18.4 mt-30 -76.98 -48.31 18.37 Favored 'General case' 0 N--CA 1.43 -1.434 0 N-CA-C 116.411 2.004 . . . . 1.0 116.411 -175.369 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -73.5 -36.5 65.77 Favored 'General case' 0 N--CA 1.431 -1.414 0 O-C-N 120.059 -1.651 . . . . 1.0 112.067 -177.464 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . 93.1 28.3 12.08 Favored Glycine 0 N--CA 1.43 -1.719 0 C-N-CA 123.927 0.775 . . . . 1.0 113.956 171.981 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 27.7 mt-10 -145.91 168.92 19.67 Favored 'General case' 0 N--CA 1.431 -1.421 0 O-C-N 121.821 -0.811 . . . . 1.0 111.401 -172.749 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 6.8 m -78.91 78.92 5.33 Favored 'General case' 0 N--CA 1.431 -1.399 0 CA-C-O 122.792 1.282 . . . . 1.0 110.61 173.554 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 47.4 t -93.05 93.36 4.13 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.436 0 C-N-CA 126.687 1.995 . . . . 1.0 106.73 174.571 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 7.9 t -140.47 166.37 24.89 Favored 'General case' 0 N--CA 1.429 -1.48 0 CA-C-N 115.324 -0.853 . . . . 1.0 110.609 -175.367 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -120.3 -12.79 8.97 Favored 'General case' 0 N--CA 1.43 -1.444 0 C-N-CA 125.061 1.345 . . . . 1.0 109.714 175.935 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 75.6 mtm180 . . . . . 0 C--O 1.26 1.617 0 O-C-N 120.519 -1.363 . . . . 1.0 111.839 -174.174 . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 90.6 mtp . . . . . 0 CA--C 1.489 -1.377 0 N-CA-C 113.189 0.811 . . . . 1.0 113.189 . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 7.3 m120 -59.18 -45.61 90.6 Favored 'General case' 0 N--CA 1.429 -1.481 0 C-N-CA 127.495 2.318 . . . . 1.0 114.117 -178.034 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 3.1 m-20 -59.33 -54.42 47.0 Favored 'General case' 0 N--CA 1.431 -1.391 0 C-N-CA 125.612 1.565 . . . . 1.0 111.656 176.581 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 23.1 t -57.7 -45.21 85.99 Favored 'General case' 0 N--CA 1.431 -1.411 0 C-N-CA 126.344 1.857 . . . . 1.0 113.558 177.01 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 88.0 tt0 -54.74 -60.51 3.26 Favored 'General case' 0 N--CA 1.431 -1.402 0 C-N-CA 126.08 1.752 . . . . 1.0 113.723 176.051 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 1.1 t80 -67.31 -25.21 65.91 Favored 'General case' 0 N--CA 1.43 -1.444 0 N-CA-C 115.4 1.63 . . . . 1.0 115.4 179.934 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 16.7 t60 -64.75 -46.01 84.03 Favored 'General case' 0 N--CA 1.43 -1.444 0 C-N-CA 125.935 1.694 . . . . 1.0 113.42 171.355 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 18.4 mmm180 -61.59 -48.89 78.88 Favored 'General case' 0 N--CA 1.431 -1.425 0 C-N-CA 124.958 1.303 . . . . 1.0 112.576 174.625 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 90.6 mt -57.07 -41.02 78.0 Favored 'General case' 0 N--CA 1.43 -1.431 0 C-N-CA 124.379 1.072 . . . . 1.0 113.133 174.449 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -58.88 -53.33 59.58 Favored 'General case' 0 N--CA 1.431 -1.413 0 C-N-CA 125.948 1.699 . . . . 1.0 113.349 176.304 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -56.04 -41.81 75.57 Favored 'General case' 0 N--CA 1.431 -1.399 0 N-CA-C 114.003 1.112 . . . . 1.0 114.003 176.432 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 97.1 mm-40 -63.0 -51.07 68.25 Favored 'General case' 0 N--CA 1.431 -1.415 0 N-CA-C 114.614 1.338 . . . . 1.0 114.614 174.961 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 3.6 pp -70.57 -39.72 73.74 Favored 'General case' 0 N--CA 1.429 -1.5 0 O-C-N 120.135 -1.603 . . . . 1.0 114.517 -179.925 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 0.2 OUTLIER -50.83 -49.89 57.78 Favored 'General case' 0 N--CA 1.43 -1.472 0 C-N-CA 125.789 1.636 . . . . 1.0 113.682 168.78 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 45.2 tp -62.51 -47.45 83.89 Favored 'General case' 0 N--CA 1.43 -1.461 0 O-C-N 121.402 -0.811 . . . . 1.0 112.673 177.167 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 20.2 m -64.75 -50.31 67.36 Favored 'General case' 0 N--CA 1.43 -1.43 0 C-N-CA 124.544 1.138 . . . . 1.0 114.069 -177.376 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 79.9 mt -54.62 -49.37 67.79 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.474 0 O-C-N 119.781 -1.825 . . . . 1.0 114.593 169.447 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 22.8 tt0 -59.35 -47.28 86.02 Favored 'General case' 0 N--CA 1.429 -1.495 0 O-C-N 120.555 -1.341 . . . . 1.0 112.175 177.006 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 3.5 tt0 -56.53 -40.63 75.4 Favored 'General case' 0 N--CA 1.43 -1.453 0 C-N-CA 125.053 1.341 . . . . 1.0 113.801 175.012 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 49.8 tpt85 -57.92 -51.05 71.23 Favored 'General case' 0 N--CA 1.429 -1.476 0 O-C-N 119.309 -2.119 . . . . 1.0 113.255 172.06 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 4.6 mm? -72.71 -47.15 49.5 Favored 'General case' 0 N--CA 1.431 -1.387 0 N-CA-C 114.329 1.233 . . . . 1.0 114.329 -176.924 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 19.0 t70 -74.4 -49.15 23.73 Favored 'General case' 0 N--CA 1.43 -1.448 0 C-N-CA 125.605 1.562 . . . . 1.0 114.092 -175.012 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 13.6 t70 -84.45 -39.75 18.56 Favored 'General case' 0 N--CA 1.43 -1.452 0 O-C-N 120.446 -1.408 . . . . 1.0 113.124 -170.944 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 24' ' ' TRP . . . . . . . . . . . . . 4.5 t90 -85.67 106.48 16.98 Favored 'General case' 0 N--CA 1.43 -1.44 0 O-C-N 119.803 -1.811 . . . . 1.0 108.982 172.38 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 1.4 t70 -80.95 -172.05 3.51 Favored 'General case' 0 N--CA 1.431 -1.418 0 CA-C-O 123.179 1.466 . . . . 1.0 113.645 -165.018 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -166.39 -171.05 32.09 Favored Glycine 0 N--CA 1.43 -1.745 0 O-C-N 119.815 -1.803 . . . . 1.0 111.637 -172.191 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 1.7 t70 -83.28 -39.12 21.24 Favored 'General case' 0 N--CA 1.43 -1.461 0 O-C-N 121.429 -1.042 . . . . 1.0 110.789 178.501 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 22.6 m -81.92 160.33 23.42 Favored 'General case' 0 N--CA 1.429 -1.482 0 CA-C-O 122.279 1.038 . . . . 1.0 111.709 174.36 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 1.8 t70 -76.59 175.85 8.89 Favored 'General case' 0 N--CA 1.43 -1.434 0 C-N-CA 125.205 1.402 . . . . 1.0 111.057 176.094 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 10.2 tp -159.74 115.22 0.16 Allowed 'Isoleucine or valine' 0 N--CA 1.43 -1.44 0 CA-C-O 123.54 1.638 . . . . 1.0 111.005 -167.254 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 36.9 m-20 -125.26 102.68 7.56 Favored 'General case' 0 N--CA 1.43 -1.459 0 O-C-N 120.648 -1.282 . . . . 1.0 109.696 169.129 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 36.7 m -94.14 125.14 38.59 Favored 'General case' 0 N--CA 1.429 -1.482 0 O-C-N 119.18 -2.2 . . . . 1.0 111.093 166.289 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -90.36 131.93 35.87 Favored 'General case' 0 N--CA 1.429 -1.493 0 C-N-CA 125.074 1.35 . . . . 1.0 110.906 -176.298 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 3.3 mm -105.56 105.77 19.29 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.489 0 C-N-CA 126.479 1.912 . . . . 1.0 106.238 -178.836 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -132.89 63.81 1.63 Allowed 'General case' 0 N--CA 1.429 -1.475 0 O-C-N 121.392 -0.818 . . . . 1.0 111.613 -176.129 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . 33.46 67.4 0.22 Allowed Glycine 0 N--CA 1.43 -1.748 0 C-N-CA 128.671 3.034 . . . . 1.0 119.559 169.467 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 114.89 -22.67 12.4 Favored Glycine 0 N--CA 1.431 -1.645 0 N-CA-C 111.031 -0.827 . . . . 1.0 111.031 -173.933 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 72.8 t -109.63 137.22 42.81 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.424 0 C-N-CA 124.676 1.19 . . . . 1.0 108.269 173.889 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 42.8 mt -119.57 129.75 54.8 Favored 'General case' 0 N--CA 1.43 -1.464 0 O-C-N 120.812 -1.18 . . . . 1.0 108.923 154.557 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -122.95 118.14 27.15 Favored 'General case' 0 N--CA 1.429 -1.48 0 CA-C-O 122.91 1.338 . . . . 1.0 108.237 177.103 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 81.7 mt -97.3 128.38 48.62 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.439 0 O-C-N 120.638 -1.289 . . . . 1.0 108.398 -172.763 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 69.5 p -129.62 122.19 28.58 Favored 'General case' 0 N--CA 1.429 -1.517 0 CA-C-O 122.018 0.913 . . . . 1.0 113.205 175.271 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 43' ' ' PHE . . . . . . . . . . . . . 5.2 p90 -120.49 167.73 12.07 Favored 'General case' 0 N--CA 1.431 -1.412 0 C-N-CA 125.003 1.321 . . . . 1.0 109.544 166.138 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 40.4 mt-10 -52.4 -36.1 53.37 Favored 'General case' 0 N--CA 1.431 -1.418 0 N-CA-C 118.63 2.826 . . . . 1.0 118.63 -171.308 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 74.1 m-20 -67.47 -4.22 10.75 Favored 'General case' 0 N--CA 1.429 -1.516 0 O-C-N 120.229 -1.545 . . . . 1.0 115.095 177.495 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 75.54 22.46 75.29 Favored Glycine 0 N--CA 1.432 -1.597 0 O-C-N 120.073 -1.642 . . . . 1.0 115.536 160.881 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 53.5 m -73.65 -47.06 42.77 Favored 'General case' 0 N--CA 1.43 -1.447 0 C-N-CA 124.622 1.169 . . . . 1.0 112.956 -175.175 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 86.0 mttt 75.54 107.55 0.08 Allowed 'General case' 0 N--CA 1.429 -1.479 0 C-N-CA 126.889 2.076 . . . . 1.0 114.768 170.697 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 2.7 mm -102.18 136.23 35.35 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.429 0 N-CA-C 107.367 -1.346 . . . . 1.0 107.367 -177.095 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 9.3 mm -126.18 105.25 14.18 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.437 0 C-N-CA 124.075 0.95 . . . . 1.0 109.359 -169.587 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 3.5 mt -126.88 128.25 70.63 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.416 0 O-C-N 120.249 -1.532 . . . . 1.0 109.936 -170.823 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 51.8 t-20 -161.87 170.84 18.74 Favored 'General case' 0 N--CA 1.43 -1.469 0 N-CA-C 105.197 -2.149 . . . . 1.0 105.197 -167.856 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -156.61 138.03 13.93 Favored 'General case' 0 N--CA 1.43 -1.465 0 O-C-N 121.185 -0.947 . . . . 1.0 113.194 -163.674 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 86.9 mm-40 -99.33 105.21 17.18 Favored 'General case' 0 N--CA 1.431 -1.416 0 C-N-CA 125.71 1.604 . . . . 1.0 109.096 166.574 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . 0.272 9.7 tt0 -65.64 -52.46 43.3 Favored Pre-proline 0 N--CA 1.431 -1.379 0 N-CA-C 116.891 2.182 . . . . 1.0 116.891 -164.419 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 51.7 Cg_exo -68.57 -21.0 40.33 Favored 'Trans proline' 0 C--N 1.299 -2.071 0 CA-C-N 126.3 3.286 . . . . 1.0 115.342 -177.591 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 32.3 mt -74.96 -25.52 58.92 Favored 'General case' 0 N--CA 1.429 -1.495 0 CA-C-N 119.507 1.048 . . . . 1.0 112.019 -174.955 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 25.5 m170 79.38 30.42 0.3 Allowed 'General case' 0 N--CA 1.431 -1.423 0 C-N-CA 128.056 2.543 . . . . 1.0 113.018 -178.767 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 65.1 mt-30 -120.02 132.63 55.53 Favored 'General case' 0 N--CA 1.43 -1.427 0 O-C-N 120.271 -1.518 . . . . 1.0 110.292 176.283 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 8.0 t -90.44 151.57 3.47 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.404 0 N-CA-C 106.515 -1.661 . . . . 1.0 106.515 163.178 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 61' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -111.38 145.65 38.52 Favored 'General case' 0 N--CA 1.43 -1.439 0 O-C-N 120.28 -1.512 . . . . 1.0 107.769 168.866 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 2.6 pt? -138.12 111.25 7.86 Favored 'General case' 0 N--CA 1.432 -1.361 0 O-C-N 120.966 -1.083 . . . . 1.0 108.299 173.471 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -101.6 144.08 30.78 Favored 'General case' 0 N--CA 1.429 -1.48 0 CA-C-O 123.626 1.679 . . . . 1.0 112.291 169.808 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 64' ' ' THR . . . . . . . . . . . . . 39.1 p -150.61 -165.82 2.37 Favored 'General case' 0 N--CA 1.43 -1.431 0 CA-C-N 113.034 -1.894 . . . . 1.0 107.991 -145.973 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 11.7 mmtt -65.13 -43.37 92.17 Favored 'General case' 0 N--CA 1.43 -1.47 0 N-CA-C 115.025 1.491 . . . . 1.0 115.025 168.583 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 29.6 mp0 -79.12 -25.56 42.94 Favored 'General case' 0 N--CA 1.43 -1.462 0 O-C-N 120.208 -1.558 . . . . 1.0 115.075 -170.208 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 159.69 -48.5 0.4 Allowed Glycine 0 N--CA 1.43 -1.735 0 O-C-N 120.37 -1.456 . . . . 1.0 114.557 176.001 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 120.39 121.36 2.87 Favored Glycine 0 N--CA 1.43 -1.725 0 CA-C-O 122.569 1.094 . . . . 1.0 114.901 -179.575 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 23.0 m-30 -122.37 171.09 9.31 Favored 'General case' 0 N--CA 1.429 -1.493 0 C-N-CA 125.499 1.52 . . . . 1.0 108.879 -177.253 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 70' ' ' HIS . . . . . 0.426 ' CE1' ' OD2' ' A' ' 81' ' ' ASP . 4.5 p80 -122.57 161.73 23.15 Favored 'General case' 0 N--CA 1.43 -1.434 0 O-C-N 120.293 -1.505 . . . . 1.0 109.384 169.102 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 71' ' ' PHE . . . . . . . . . . . . 0.286 37.3 t80 -139.43 122.29 16.59 Favored 'General case' 0 N--CA 1.431 -1.398 0 C-N-CA 124.116 0.967 . . . . 1.0 111.57 -145.953 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 11.9 m-20 -129.16 148.86 51.13 Favored 'General case' 0 N--CA 1.43 -1.426 0 C-N-CA 125.329 1.452 . . . . 1.0 113.044 -177.312 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 3.0 tm? -84.42 114.64 22.05 Favored 'General case' 0 N--CA 1.43 -1.457 0 C-N-CA 127.041 2.136 . . . . 1.0 111.699 -179.592 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 76.7 tttt -89.48 -52.6 4.94 Favored 'General case' 0 N--CA 1.43 -1.47 0 O-C-N 120.959 -1.088 . . . . 1.0 110.931 174.463 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -164.65 -78.79 0.04 OUTLIER Glycine 0 N--CA 1.43 -1.76 0 O-C-N 120.688 -1.258 . . . . 1.0 114.069 177.052 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 50.9 m-20 -96.03 -5.25 41.5 Favored 'General case' 0 N--CA 1.43 -1.45 0 O-C-N 120.366 -1.667 . . . . 1.0 111.357 -176.634 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 5.0 mt-10 -159.05 161.27 36.49 Favored 'General case' 0 CA--C 1.488 -1.404 0 N-CA-C 101.428 -3.545 . . . . 1.0 101.428 -176.286 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 78' ' ' TRP . . . . . . . . . . . . . 23.6 m95 -94.44 142.15 27.76 Favored 'General case' 0 N--CA 1.43 -1.439 0 N-CA-C 104.409 -2.441 . . . . 1.0 104.409 175.066 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 0.6 OUTLIER -93.71 149.93 4.14 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.399 0 N-CA-C 105.374 -2.084 . . . . 1.0 105.374 169.844 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 80' ' ' CYS . . . . . 0.41 ' HB2' ' HB2' ' A' ' 85' ' ' GLU . 90.0 m -88.61 114.39 25.18 Favored 'General case' 0 N--CA 1.43 -1.474 0 N-CA-C 106.383 -1.71 . . . . 1.0 106.383 169.972 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 81' ' ' ASP . . . . . 0.426 ' OD2' ' CE1' ' A' ' 70' ' ' HIS . 21.1 t70 -61.54 -55.2 33.58 Favored 'General case' 0 N--CA 1.431 -1.414 0 C-N-CA 127.6 2.36 . . . . 1.0 113.949 -162.536 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -51.07 -61.34 2.29 Favored 'General case' 0 N--CA 1.43 -1.451 0 C-N-CA 126.675 1.99 . . . . 1.0 115.603 -165.878 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 68.4 m -85.01 -31.96 23.19 Favored 'General case' 0 N--CA 1.431 -1.396 0 O-C-N 120.558 -1.339 . . . . 1.0 111.95 174.934 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 97.51 79.93 1.5 Allowed Glycine 0 N--CA 1.43 -1.7 0 N-CA-C 109.699 -1.36 . . . . 1.0 109.699 -169.215 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 85' ' ' GLU . . . . . 0.41 ' HB2' ' HB2' ' A' ' 80' ' ' CYS . 36.8 mm-40 -142.32 -161.14 1.19 Allowed 'General case' 0 N--CA 1.428 -1.554 0 N-CA-C 106.967 -1.494 . . . . 1.0 106.967 -174.439 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 89.5 m -137.96 142.8 40.51 Favored 'General case' 0 N--CA 1.429 -1.495 0 O-C-N 119.727 -1.858 . . . . 1.0 109.863 -161.233 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 1.1 t80 -38.63 -94.37 0.0 OUTLIER 'General case' 0 N--CA 1.43 -1.461 0 C-N-CA 128.005 2.522 . . . . 1.0 117.807 177.055 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 88' ' ' TRP . . . . . 0.454 ' HB2' ' HG2' ' A' ' 106' ' ' ARG . 19.1 m95 -76.12 -26.53 56.45 Favored 'General case' 0 N--CA 1.43 -1.462 0 O-C-N 120.308 -1.495 . . . . 1.0 111.331 -166.968 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -59.85 -50.66 72.91 Favored 'General case' 0 N--CA 1.43 -1.461 0 C-N-CA 125.857 1.663 . . . . 1.0 113.554 172.258 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 46.3 tp -68.5 -43.67 76.36 Favored 'General case' 0 N--CA 1.43 -1.462 0 O-C-N 119.652 -1.905 . . . . 1.0 111.077 179.0 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 10.3 tt -50.53 -49.85 54.74 Favored 'General case' 0 N--CA 1.43 -1.427 0 C-N-CA 125.636 1.574 . . . . 1.0 113.449 172.749 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 16.8 tt0 -55.57 -49.08 73.67 Favored 'General case' 0 N--CA 1.43 -1.465 0 C-N-CA 127.018 2.127 . . . . 1.0 113.281 173.943 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 51.0 mt-30 -60.36 -48.3 82.34 Favored 'General case' 0 N--CA 1.431 -1.393 0 O-C-N 120.766 -1.209 . . . . 1.0 113.743 175.944 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -58.78 -49.33 78.06 Favored 'General case' 0 N--CA 1.43 -1.438 0 C-N-CA 125.378 1.471 . . . . 1.0 113.171 174.277 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -59.94 -45.91 91.1 Favored 'General case' 0 N--CA 1.429 -1.509 0 C-N-CA 126.143 1.777 . . . . 1.0 114.115 177.576 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 96.4 m -60.93 -36.47 79.41 Favored 'General case' 0 N--CA 1.431 -1.399 0 C-N-CA 125.713 1.605 . . . . 1.0 112.526 178.25 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -69.05 -59.62 2.92 Favored 'General case' 0 N--CA 1.428 -1.528 0 C-N-CA 124.388 1.075 . . . . 1.0 113.317 170.243 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 5.4 pt20 -76.54 -19.64 57.71 Favored 'General case' 0 N--CA 1.431 -1.406 0 N-CA-C 116.016 1.858 . . . . 1.0 116.016 -166.134 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -97.92 -35.98 10.31 Favored 'General case' 0 N--CA 1.431 -1.408 0 C-N-CA 124.793 1.237 . . . . 1.0 112.224 169.579 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . 106.95 10.76 27.63 Favored Glycine 0 N--CA 1.429 -1.77 0 N-CA-C 116.222 1.249 . . . . 1.0 116.222 170.048 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 6.7 pt-20 -149.34 160.98 42.95 Favored 'General case' 0 N--CA 1.43 -1.425 0 N-CA-C 105.655 -1.979 . . . . 1.0 105.655 -177.416 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 18.4 m -65.8 111.43 3.25 Favored 'General case' 0 N--CA 1.429 -1.482 0 CA-C-N 120.804 1.638 . . . . 1.0 112.177 -178.595 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 60.7 t -94.86 107.68 19.78 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.415 0 CA-C-O 122.993 1.378 . . . . 1.0 109.394 -178.005 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 70.0 m -80.2 106.15 12.0 Favored 'General case' 0 N--CA 1.43 -1.456 0 C-N-CA 124.622 1.169 . . . . 1.0 111.336 -176.516 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -140.58 -12.02 1.02 Allowed 'General case' 0 N--CA 1.43 -1.458 0 C-N-CA 123.133 0.573 . . . . 1.0 109.875 168.625 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 106' ' ' ARG . . . . . 0.454 ' HG2' ' HB2' ' A' ' 88' ' ' TRP . 0.0 OUTLIER . . . . . 0 C--O 1.261 1.69 0 C-N-CA 126.592 1.957 . . . . 1.0 110.882 179.212 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 66.6 mtt . . . . . 0 CA--C 1.49 -1.347 0 CA-C-O 121.44 0.638 . . . . 1.0 111.829 . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 17.9 t-20 -114.7 56.35 0.73 Allowed 'General case' 0 N--CA 1.43 -1.434 0 O-C-N 120.532 -1.355 . . . . 1.0 110.238 -178.314 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -64.0 -30.79 71.84 Favored 'General case' 0 CA--C 1.489 -1.402 0 C-N-CA 126.095 1.758 . . . . 1.0 114.614 -176.136 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 48.0 p -65.45 -46.87 78.17 Favored 'General case' 0 N--CA 1.43 -1.441 0 O-C-N 120.483 -1.386 . . . . 1.0 113.882 174.971 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 40.2 tt0 -68.03 -44.69 75.9 Favored 'General case' 0 N--CA 1.431 -1.422 0 O-C-N 120.606 -1.308 . . . . 1.0 112.723 176.668 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 28.3 t80 -50.4 -49.38 54.76 Favored 'General case' 0 N--CA 1.43 -1.439 0 N-CA-C 114.123 1.157 . . . . 1.0 114.123 168.856 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 1.2 t60 -61.03 -38.6 86.69 Favored 'General case' 0 N--CA 1.429 -1.498 0 O-C-N 120.649 -1.282 . . . . 1.0 114.382 175.048 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 1.2 mpt_? -56.26 -56.94 14.81 Favored 'General case' 0 N--CA 1.43 -1.426 0 CA-C-N 120.629 1.558 . . . . 1.0 112.185 172.816 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 80.4 mt -63.96 -41.57 97.54 Favored 'General case' 0 N--CA 1.429 -1.492 0 N-CA-C 114.135 1.161 . . . . 1.0 114.135 -179.161 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -67.18 -41.31 86.11 Favored 'General case' 0 N--CA 1.43 -1.474 0 C-N-CA 125.446 1.498 . . . . 1.0 114.774 -179.472 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -66.41 -38.76 88.19 Favored 'General case' 0 N--CA 1.431 -1.409 0 O-C-N 120.305 -1.497 . . . . 1.0 112.025 172.346 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 3.6 mt-30 -56.38 -54.09 49.63 Favored 'General case' 0 N--CA 1.43 -1.442 0 N-CA-C 115.829 1.788 . . . . 1.0 115.829 170.142 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 4.3 pp -63.91 -39.31 93.88 Favored 'General case' 0 N--CA 1.429 -1.479 0 N-CA-C 114.469 1.285 . . . . 1.0 114.469 179.387 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 7.3 m0 -49.71 -49.5 47.55 Favored 'General case' 0 N--CA 1.429 -1.481 0 N-CA-C 114.552 1.315 . . . . 1.0 114.552 168.759 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 41.9 tp -61.54 -51.52 68.23 Favored 'General case' 0 N--CA 1.429 -1.507 0 C-N-CA 124.21 1.004 . . . . 1.0 113.618 176.251 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 17.0 m -57.07 -43.08 81.75 Favored 'General case' 0 N--CA 1.43 -1.464 0 C-N-CA 125.613 1.565 . . . . 1.0 113.978 177.384 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 87.9 mt -59.12 -49.9 81.67 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.504 0 O-C-N 120.573 -1.33 . . . . 1.0 113.162 173.144 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 72.5 tt0 -63.02 -48.58 78.14 Favored 'General case' 0 N--CA 1.43 -1.473 0 O-C-N 120.594 -1.316 . . . . 1.0 112.715 -179.86 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 27.0 mm-40 -48.44 -59.72 3.25 Favored 'General case' 0 N--CA 1.428 -1.537 0 C-N-CA 126.569 1.948 . . . . 1.0 114.316 172.527 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 3.1 tpm_? -62.79 -37.82 88.19 Favored 'General case' 0 N--CA 1.43 -1.451 0 N-CA-C 113.8 1.037 . . . . 1.0 113.8 -176.627 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 4.3 mm? -70.65 -44.63 66.71 Favored 'General case' 0 N--CA 1.43 -1.456 0 O-C-N 120.482 -1.386 . . . . 1.0 113.7 177.084 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 25.5 t70 -68.24 -39.3 82.32 Favored 'General case' 0 N--CA 1.429 -1.475 0 O-C-N 120.775 -1.203 . . . . 1.0 113.542 -178.54 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 35.8 t70 -64.84 -26.59 68.4 Favored 'General case' 0 N--CA 1.43 -1.475 0 C-N-CA 125.841 1.656 . . . . 1.0 113.624 178.681 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 24' ' ' TRP . . . . . . . . . . . . . 0.1 OUTLIER -99.46 -145.84 0.33 Allowed 'General case' 0 N--CA 1.429 -1.48 0 N-CA-C 115.074 1.509 . . . . 1.0 115.074 -167.939 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . 0.306 0.9 OUTLIER 55.35 -157.44 0.23 Allowed 'General case' 0 N--CA 1.43 -1.449 0 C-N-CA 128.819 2.848 . . . . 1.0 116.221 -175.282 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 155.67 -44.85 0.54 Allowed Glycine 0 N--CA 1.432 -1.613 0 O-C-N 120.464 -1.397 . . . . 1.0 112.247 -179.019 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -77.68 -30.87 52.2 Favored 'General case' 0 N--CA 1.432 -1.368 0 CA-C-O 122.165 0.983 . . . . 1.0 111.595 -178.51 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 63.4 m -112.64 166.26 11.51 Favored 'General case' 0 N--CA 1.43 -1.435 0 C-N-CA 124.652 1.181 . . . . 1.0 110.136 174.742 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 29.8 t70 -93.5 141.22 28.71 Favored 'General case' 0 N--CA 1.43 -1.446 0 N-CA-C 106.904 -1.517 . . . . 1.0 106.904 167.421 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 5.8 tp -141.99 124.06 13.56 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.463 0 C-N-CA 126.376 1.871 . . . . 1.0 106.01 -169.558 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 13.7 t70 -140.48 128.55 22.16 Favored 'General case' 0 N--CA 1.43 -1.467 0 O-C-N 120.611 -1.306 . . . . 1.0 110.058 169.044 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 43.3 t -95.1 131.81 40.69 Favored 'General case' 0 N--CA 1.43 -1.43 0 O-C-N 120.018 -1.676 . . . . 1.0 108.074 173.509 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 23.3 mt-10 -107.62 140.27 40.9 Favored 'General case' 0 N--CA 1.429 -1.506 0 O-C-N 120.99 -1.069 . . . . 1.0 108.762 -170.242 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 3.1 tp -114.58 109.38 28.27 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.44 0 N-CA-C 105.617 -1.994 . . . . 1.0 105.617 167.011 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 77.5 m-20 -125.73 126.1 44.06 Favored 'General case' 0 N--CA 1.43 -1.427 0 N-CA-C 106.889 -1.523 . . . . 1.0 106.889 168.522 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . 67.42 -103.68 0.99 Allowed Glycine 0 N--CA 1.43 -1.728 0 C-N-CA 125.039 1.304 . . . . 1.0 112.607 -174.963 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -139.73 25.44 2.7 Favored Glycine 0 N--CA 1.43 -1.738 0 C-N-CA 124.186 0.898 . . . . 1.0 111.408 171.839 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 46.9 t -112.23 130.53 65.75 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.516 0 N-CA-C 106.97 -1.493 . . . . 1.0 106.97 179.063 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 23.9 mt -99.73 120.34 39.57 Favored 'General case' 0 N--CA 1.429 -1.499 0 CA-C-O 123.208 1.48 . . . . 1.0 107.883 172.141 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 1.6 p -113.76 122.33 46.77 Favored 'General case' 0 N--CA 1.43 -1.454 0 N-CA-C 106.995 -1.483 . . . . 1.0 106.995 179.63 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 61.7 mt -93.89 112.62 27.09 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.431 0 N-CA-C 105.787 -1.931 . . . . 1.0 105.787 -177.794 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 27.2 p -121.77 126.41 48.8 Favored 'General case' 0 N--CA 1.43 -1.448 0 CA-C-O 122.441 1.115 . . . . 1.0 113.221 -167.919 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 43' ' ' PHE . . . . . . . . . . . . . 3.0 p90 -120.77 167.76 12.14 Favored 'General case' 0 N--CA 1.43 -1.443 0 CA-C-O 122.749 1.261 . . . . 1.0 111.59 178.675 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -56.61 -33.01 65.85 Favored 'General case' 0 N--CA 1.43 -1.435 0 C-N-CA 127.953 2.501 . . . . 1.0 117.037 -170.077 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 70.9 m-80 -67.09 -15.8 63.94 Favored 'General case' 0 N--CA 1.431 -1.425 0 N-CA-C 115.037 1.495 . . . . 1.0 115.037 175.427 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 88.2 13.13 64.43 Favored Glycine 0 N--CA 1.431 -1.64 0 O-C-N 119.676 -1.89 . . . . 1.0 115.475 167.447 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 56.8 m -98.65 149.89 22.33 Favored 'General case' 0 N--CA 1.429 -1.504 0 N-CA-C 107.336 -1.357 . . . . 1.0 107.336 167.693 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -128.49 150.88 49.97 Favored 'General case' 0 N--CA 1.429 -1.5 0 O-C-N 121.378 -0.826 . . . . 1.0 110.063 -168.236 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 3.1 mm -105.17 133.31 49.77 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.508 0 N-CA-C 105.527 -2.027 . . . . 1.0 105.527 166.546 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 50' ' ' ILE . . . . . 0.441 ' HB ' ' HB1' ' A' ' 63' ' ' ALA . 5.7 mm -116.64 117.74 56.47 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.484 0 CA-C-N 119.733 1.151 . . . . 1.0 109.617 -173.158 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 3.2 mt -126.93 116.27 44.13 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.432 0 CA-C-O 124.047 1.88 . . . . 1.0 112.179 -175.469 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 52' ' ' ASN . . . . . 0.535 ' H ' ' HD1' ' A' ' 61' ' ' TRP . 56.2 t30 -141.82 170.63 15.35 Favored 'General case' 0 N--CA 1.43 -1.449 0 C-N-CA 128.354 2.662 . . . . 1.0 106.27 -179.274 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -154.29 130.89 10.66 Favored 'General case' 0 N--CA 1.431 -1.408 0 CA-C-O 122.834 1.302 . . . . 1.0 109.289 -170.365 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 28.9 mm-40 -89.73 129.87 36.08 Favored 'General case' 0 N--CA 1.429 -1.477 0 N-CA-C 106.531 -1.655 . . . . 1.0 106.531 175.921 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 67.6 mt-10 -63.75 -47.99 80.56 Favored Pre-proline 0 N--CA 1.431 -1.42 0 N-CA-C 116.687 2.106 . . . . 1.0 116.687 -179.606 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 97.3 Cg_endo -74.52 153.39 44.26 Favored 'Trans proline' 0 C--N 1.299 -2.036 0 CA-C-N 126.531 3.368 . . . . 1.0 111.388 163.403 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . 0.388 5.4 mp 72.57 143.05 0.06 Allowed 'General case' 0 N--CA 1.43 -1.457 0 CA-C-O 124.754 2.216 . . . . 1.0 113.445 -168.203 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 21.2 m170 -88.93 44.32 1.2 Allowed 'General case' 0 N--CA 1.43 -1.446 0 C-N-CA 125.318 1.447 . . . . 1.0 112.904 -175.899 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 11.7 pt20 -140.0 145.44 37.81 Favored 'General case' 0 N--CA 1.43 -1.456 0 O-C-N 120.045 -1.66 . . . . 1.0 110.53 -172.077 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 86.7 t -111.88 156.08 13.05 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.457 0 N-CA-C 107.023 -1.473 . . . . 1.0 107.023 -178.679 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 61' ' ' TRP . . . . . 0.535 ' HD1' ' H ' ' A' ' 52' ' ' ASN . 0.0 OUTLIER -102.06 152.35 21.08 Favored 'General case' 0 N--CA 1.43 -1.455 0 O-C-N 120.054 -1.653 . . . . 1.0 113.011 174.784 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 75.6 mt -127.91 107.54 9.94 Favored 'General case' 0 CA--C 1.488 -1.409 0 N-CA-C 106.994 -1.484 . . . . 1.0 106.994 166.175 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . 0.441 ' HB1' ' HB ' ' A' ' 50' ' ' ILE . . . -95.19 145.14 25.25 Favored 'General case' 0 N--CA 1.429 -1.476 0 CA-C-O 122.801 1.286 . . . . 1.0 111.16 163.288 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 64' ' ' THR . . . . . . . . . . . . . 69.2 p -150.3 -168.1 3.01 Favored 'General case' 0 N--CA 1.43 -1.462 0 C-N-CA 126.182 1.793 . . . . 1.0 108.617 -150.583 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 7.1 tmtm? -62.12 -46.82 87.33 Favored 'General case' 0 N--CA 1.431 -1.411 0 C-N-CA 125.889 1.676 . . . . 1.0 112.435 174.693 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 48.9 tt0 -78.04 -24.51 47.75 Favored 'General case' 0 N--CA 1.429 -1.519 0 N-CA-C 114.516 1.302 . . . . 1.0 114.516 -170.718 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 151.06 -53.14 0.49 Allowed Glycine 0 N--CA 1.43 -1.725 0 O-C-N 120.893 -1.129 . . . . 1.0 110.89 176.963 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 134.83 162.06 9.67 Favored Glycine 0 N--CA 1.43 -1.736 0 CA-C-O 122.818 1.232 . . . . 1.0 115.839 174.448 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 4.7 m-85 -135.32 161.99 33.85 Favored 'General case' 0 N--CA 1.43 -1.442 0 C-N-CA 126.415 1.886 . . . . 1.0 107.148 -173.318 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 25.0 p80 -114.98 159.72 20.43 Favored 'General case' 0 N--CA 1.43 -1.433 0 O-C-N 119.797 -1.815 . . . . 1.0 108.586 156.025 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 37.3 p90 -136.96 141.47 42.61 Favored 'General case' 0 N--CA 1.43 -1.471 0 N-CA-C 114.694 1.368 . . . . 1.0 114.694 -168.755 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 8.9 m-20 -121.63 175.81 6.03 Favored 'General case' 0 N--CA 1.429 -1.491 0 C-N-CA 126.448 1.899 . . . . 1.0 110.391 -170.495 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 27.1 tp -113.82 110.25 19.84 Favored 'General case' 0 N--CA 1.429 -1.521 0 O-C-N 119.718 -1.864 . . . . 1.0 113.072 -174.616 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 12.2 mmmt -68.41 -42.46 78.96 Favored 'General case' 0 N--CA 1.431 -1.379 0 O-C-N 120.497 -1.377 . . . . 1.0 112.641 168.45 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . 165.08 -86.9 0.1 Allowed Glycine 0 N--CA 1.43 -1.764 0 N-CA-C 110.074 -1.211 . . . . 1.0 110.074 176.997 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 11.6 t0 -91.82 29.65 1.52 Allowed 'General case' 0 N--CA 1.43 -1.46 0 O-C-N 120.988 -1.301 . . . . 1.0 111.96 176.659 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 2.1 pt-20 -169.07 124.61 0.89 Allowed 'General case' 0 N--CA 1.429 -1.484 0 C-N-CA 126.33 1.852 . . . . 1.0 106.523 -173.772 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 78' ' ' TRP . . . . . . . . . . . . . 89.9 m95 -80.46 130.67 35.3 Favored 'General case' 0 N--CA 1.43 -1.462 0 N-CA-C 106.339 -1.726 . . . . 1.0 106.339 162.627 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -124.55 141.12 45.73 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.436 0 O-C-N 119.313 -2.117 . . . . 1.0 109.866 -173.777 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 21.2 m -81.64 121.17 26.01 Favored 'General case' 0 N--CA 1.429 -1.492 0 O-C-N 120.243 -1.535 . . . . 1.0 113.21 -172.572 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 30.0 t70 -83.11 58.33 4.38 Favored 'General case' 0 N--CA 1.43 -1.465 0 O-C-N 119.769 -1.832 . . . . 1.0 112.467 -173.172 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 15.6 tpt85 -170.45 101.29 0.26 Allowed 'General case' 0 N--CA 1.43 -1.437 0 O-C-N 120.433 -1.417 . . . . 1.0 110.053 178.039 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 4.3 t 79.48 -50.28 0.4 Allowed 'General case' 0 N--CA 1.43 -1.463 0 C-N-CA 126.695 1.998 . . . . 1.0 116.121 169.039 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -153.79 96.15 0.16 Allowed Glycine 0 N--CA 1.43 -1.732 0 O-C-N 120.214 -1.554 . . . . 1.0 110.015 -172.593 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 5.5 pt-20 -82.43 102.71 11.48 Favored 'General case' 0 N--CA 1.428 -1.539 0 N-CA-C 117.99 2.589 . . . . 1.0 117.99 -162.834 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 10.4 m -165.66 126.71 1.89 Allowed 'General case' 0 N--CA 1.43 -1.458 0 O-C-N 119.543 -1.973 . . . . 1.0 113.339 172.333 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 3.0 t80 -57.09 -84.34 0.01 OUTLIER 'General case' 0 N--CA 1.43 -1.438 0 N-CA-C 118.018 2.599 . . . . 1.0 118.018 177.192 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 88' ' ' TRP . . . . . . . . . . . . . 46.7 m95 -61.38 -27.81 68.79 Favored 'General case' 0 N--CA 1.431 -1.424 0 C-N-CA 125.876 1.67 . . . . 1.0 113.324 -167.295 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -77.27 -45.03 27.69 Favored 'General case' 0 N--CA 1.429 -1.492 0 C-N-CA 126.685 1.994 . . . . 1.0 112.896 179.558 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 25.6 tp -71.36 -38.89 71.56 Favored 'General case' 0 N--CA 1.429 -1.489 0 O-C-N 118.875 -2.391 . . . . 1.0 112.734 176.951 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 17.7 tp -51.58 -44.98 62.96 Favored 'General case' 0 N--CA 1.431 -1.391 0 C-N-CA 126.608 1.963 . . . . 1.0 114.483 168.027 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 38.5 tt0 -56.66 -47.18 80.37 Favored 'General case' 0 N--CA 1.431 -1.407 0 C-N-CA 126.318 1.847 . . . . 1.0 113.93 170.168 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 38.1 tt0 -57.05 -50.77 71.73 Favored 'General case' 0 N--CA 1.43 -1.448 0 C-N-CA 125.63 1.572 . . . . 1.0 114.427 176.938 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -56.56 -48.49 77.21 Favored 'General case' 0 N--CA 1.429 -1.478 0 C-N-CA 126.148 1.779 . . . . 1.0 114.121 173.969 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -65.69 -48.77 70.91 Favored 'General case' 0 N--CA 1.431 -1.415 0 O-C-N 120.339 -1.476 . . . . 1.0 113.682 179.45 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 94.0 m -47.13 -51.45 18.05 Favored 'General case' 0 N--CA 1.43 -1.465 0 C-N-CA 127.38 2.272 . . . . 1.0 113.97 173.986 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 8.4 pt20 -72.98 -37.02 67.19 Favored 'General case' 0 N--CA 1.431 -1.421 0 N-CA-C 114.692 1.368 . . . . 1.0 114.692 -179.173 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 41.7 mt-30 -71.22 -42.08 69.37 Favored 'General case' 0 N--CA 1.431 -1.411 0 N-CA-C 115.655 1.724 . . . . 1.0 115.655 178.741 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -82.82 -41.21 19.36 Favored 'General case' 0 N--CA 1.431 -1.421 0 N-CA-C 113.622 0.971 . . . . 1.0 113.622 -179.604 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . 89.59 42.69 5.39 Favored Glycine 0 N--CA 1.431 -1.669 0 O-C-N 120.667 -1.271 . . . . 1.0 112.984 -177.991 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 4.3 tp10 -158.92 164.85 35.27 Favored 'General case' 0 N--CA 1.43 -1.468 0 N-CA-C 103.252 -2.869 . . . . 1.0 103.252 -177.291 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 90.4 m -76.88 87.21 3.45 Favored 'General case' 0 N--CA 1.431 -1.383 0 CA-C-N 120.533 1.515 . . . . 1.0 109.339 169.666 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 18.0 t -95.45 84.01 1.53 Allowed 'Isoleucine or valine' 0 N--CA 1.43 -1.426 0 CA-C-O 124.297 1.999 . . . . 1.0 108.73 -179.265 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 71.5 p -96.72 168.07 10.73 Favored 'General case' 0 N--CA 1.431 -1.403 0 C-N-CA 126.783 2.033 . . . . 1.0 111.114 -177.6 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 20.2 m-85 -104.57 -27.05 12.1 Favored 'General case' 0 N--CA 1.429 -1.479 0 O-C-N 120.768 -1.207 . . . . 1.0 109.278 162.134 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 16.5 mmm-85 . . . . . 0 C--O 1.259 1.602 0 C-N-CA 124.354 1.061 . . . . 1.0 111.409 -170.957 . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 20.9 mmt . . . . . 0 CA--C 1.49 -1.344 0 CA-C-O 121.937 0.875 . . . . 1.0 110.646 . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 29.2 m-80 -114.01 44.18 1.7 Allowed 'General case' 0 N--CA 1.43 -1.468 0 O-C-N 119.996 -1.69 . . . . 1.0 109.782 -179.477 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 28.3 p-10 -69.71 -56.23 7.77 Favored 'General case' 0 CA--C 1.488 -1.408 0 C-N-CA 125.586 1.554 . . . . 1.0 113.777 -176.357 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 33.4 m -59.46 -45.07 92.67 Favored 'General case' 0 N--CA 1.431 -1.403 0 C-N-CA 124.698 1.199 . . . . 1.0 112.417 174.146 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 8.4 mm-40 -52.5 -63.29 1.19 Allowed 'General case' 0 N--CA 1.429 -1.482 0 C-N-CA 126.491 1.916 . . . . 1.0 113.137 178.297 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 7.6 m-85 -62.12 -27.59 69.04 Favored 'General case' 0 N--CA 1.43 -1.462 0 N-CA-C 115.838 1.792 . . . . 1.0 115.838 177.089 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 1.9 t-80 -61.52 -52.6 63.8 Favored 'General case' 0 N--CA 1.429 -1.475 0 N-CA-C 114.441 1.274 . . . . 1.0 114.441 171.792 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 35.4 mtm180 -69.63 -39.14 77.33 Favored 'General case' 0 N--CA 1.431 -1.375 0 O-C-N 120.474 -1.391 . . . . 1.0 113.973 -179.793 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 66.7 mt -58.55 -41.7 86.19 Favored 'General case' 0 N--CA 1.431 -1.42 0 C-N-CA 125.05 1.34 . . . . 1.0 113.223 173.648 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -62.99 -45.91 90.17 Favored 'General case' 0 N--CA 1.429 -1.483 0 C-N-CA 125.312 1.445 . . . . 1.0 112.668 176.293 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 8.2 t70 -53.69 -57.53 10.48 Favored 'General case' 0 N--CA 1.43 -1.463 0 C-N-CA 124.42 1.088 . . . . 1.0 113.242 174.846 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 16.7 pt20 -64.1 -37.49 87.64 Favored 'General case' 0 N--CA 1.429 -1.478 0 N-CA-C 116.267 1.951 . . . . 1.0 116.267 -177.907 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 3.3 pp -65.06 -43.54 91.89 Favored 'General case' 0 N--CA 1.43 -1.44 0 O-C-N 120.174 -1.578 . . . . 1.0 113.376 174.928 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 23.1 m0 -52.62 -50.67 62.65 Favored 'General case' 0 N--CA 1.431 -1.413 0 N-CA-C 115.329 1.603 . . . . 1.0 115.329 173.222 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 25.3 mt -59.06 -48.4 81.75 Favored 'General case' 0 N--CA 1.429 -1.483 0 CA-C-O 121.944 0.878 . . . . 1.0 112.854 176.456 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 47.7 m -66.6 -45.82 77.94 Favored 'General case' 0 N--CA 1.43 -1.436 0 N-CA-C 114.456 1.28 . . . . 1.0 114.456 -175.748 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 96.7 mt -58.03 -45.9 88.07 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.462 0 O-C-N 119.988 -1.695 . . . . 1.0 112.143 172.677 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 8.0 tt0 -58.91 -48.3 81.94 Favored 'General case' 0 N--CA 1.43 -1.442 0 O-C-N 121.626 -0.671 . . . . 1.0 112.59 176.705 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 33.7 tt0 -58.47 -44.87 89.48 Favored 'General case' 0 N--CA 1.431 -1.41 0 C-N-CA 125.161 1.384 . . . . 1.0 114.107 177.92 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -53.52 -52.52 59.37 Favored 'General case' 0 N--CA 1.43 -1.453 0 C-N-CA 124.184 0.994 . . . . 1.0 112.344 174.656 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 35.4 mt -69.99 -51.04 35.71 Favored 'General case' 0 N--CA 1.431 -1.412 0 N-CA-C 113.658 0.985 . . . . 1.0 113.658 -176.429 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 23.0 t70 -62.9 -41.92 99.61 Favored 'General case' 0 N--CA 1.429 -1.495 0 N-CA-C 115.146 1.536 . . . . 1.0 115.146 -178.174 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 23.6 t70 -74.01 -26.1 60.26 Favored 'General case' 0 N--CA 1.43 -1.438 0 O-C-N 120.182 -1.574 . . . . 1.0 113.066 -179.04 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 24' ' ' TRP . . . . . . . . . . . . . 67.7 t-105 -72.26 136.64 46.37 Favored 'General case' 0 N--CA 1.43 -1.471 0 O-C-N 119.742 -1.849 . . . . 1.0 112.63 177.569 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 34.3 t70 -138.95 150.26 45.69 Favored 'General case' 0 N--CA 1.43 -1.445 0 N-CA-C 106.926 -1.509 . . . . 1.0 106.926 179.273 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -163.91 -121.88 0.58 Allowed Glycine 0 N--CA 1.43 -1.757 0 O-C-N 121.29 -0.881 . . . . 1.0 111.599 -174.822 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 4.2 t0 -92.0 -32.25 15.29 Favored 'General case' 0 N--CA 1.43 -1.471 0 C-N-CA 125.357 1.463 . . . . 1.0 108.614 172.293 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 18.3 p -95.14 166.94 11.67 Favored 'General case' 0 N--CA 1.429 -1.482 0 C-N-CA 126.499 1.92 . . . . 1.0 111.591 179.335 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 2.6 t70 -132.03 178.91 6.42 Favored 'General case' 0 N--CA 1.43 -1.453 0 C-N-CA 124.677 1.191 . . . . 1.0 109.272 177.018 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 9.3 tp -157.21 134.02 2.2 Favored 'Isoleucine or valine' 0 N--CA 1.428 -1.542 0 C-N-CA 125.43 1.492 . . . . 1.0 107.072 -154.632 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 2.1 t70 -143.81 106.67 4.48 Favored 'General case' 0 N--CA 1.429 -1.495 0 O-C-N 120.241 -1.537 . . . . 1.0 109.445 162.783 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 71.2 m -90.68 132.62 35.68 Favored 'General case' 0 N--CA 1.431 -1.42 0 O-C-N 120.513 -1.367 . . . . 1.0 111.171 175.571 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 35.2 tt0 -107.27 132.01 53.57 Favored 'General case' 0 N--CA 1.43 -1.474 0 C-N-CA 126.365 1.866 . . . . 1.0 109.769 -168.138 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 2.8 tp -117.2 109.03 26.37 Favored 'Isoleucine or valine' 0 N--CA 1.428 -1.535 0 CA-C-O 124.547 2.118 . . . . 1.0 108.236 -172.314 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 3.5 t-20 -108.29 79.35 1.25 Allowed 'General case' 0 N--CA 1.429 -1.483 0 C-N-CA 125.575 1.55 . . . . 1.0 108.288 173.98 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . 75.52 -80.17 1.04 Allowed Glycine 0 N--CA 1.429 -1.771 0 O-C-N 120.326 -1.484 . . . . 1.0 114.998 173.291 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -142.66 37.35 1.54 Allowed Glycine 0 N--CA 1.43 -1.766 0 N-CA-C 108.987 -1.645 . . . . 1.0 108.987 173.384 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 69.7 t -133.67 117.77 28.02 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.404 0 N-CA-C 104.519 -2.4 . . . . 1.0 104.519 176.383 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -110.08 137.32 48.0 Favored 'General case' 0 N--CA 1.431 -1.42 0 CA-C-O 123.728 1.728 . . . . 1.0 111.781 177.042 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -133.06 125.2 29.1 Favored 'General case' 0 N--CA 1.429 -1.479 0 N-CA-C 106.142 -1.799 . . . . 1.0 106.142 -170.174 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 86.1 mt -99.89 134.07 40.6 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.481 0 N-CA-C 107.534 -1.284 . . . . 1.0 107.534 -169.192 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -131.7 126.67 35.13 Favored 'General case' 0 N--CA 1.431 -1.414 0 N-CA-C 112.643 0.609 . . . . 1.0 112.643 174.944 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 43' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -108.15 167.51 9.95 Favored 'General case' 0 N--CA 1.431 -1.405 0 C-N-CA 125.482 1.513 . . . . 1.0 109.437 174.278 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 70.3 mt-10 -55.86 -26.19 45.79 Favored 'General case' 0 N--CA 1.429 -1.484 0 N-CA-C 117.059 2.244 . . . . 1.0 117.059 179.644 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 27.7 t-20 -63.87 -18.15 63.88 Favored 'General case' 0 N--CA 1.43 -1.442 0 C-N-CA 126.374 1.869 . . . . 1.0 112.828 176.363 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 96.32 -6.32 65.82 Favored Glycine 0 N--CA 1.431 -1.652 0 O-C-N 120.311 -1.493 . . . . 1.0 111.313 176.345 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -79.18 166.36 22.29 Favored 'General case' 0 N--CA 1.431 -1.424 0 C-N-CA 128.033 2.533 . . . . 1.0 111.265 -177.914 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 10.5 ptpt -157.17 148.14 21.67 Favored 'General case' 0 N--CA 1.431 -1.417 0 O-C-N 120.672 -1.267 . . . . 1.0 113.599 -162.434 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 9.2 mm -123.6 142.83 38.89 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.445 0 N-CA-C 105.703 -1.962 . . . . 1.0 105.703 175.672 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 50' ' ' ILE . . . . . 0.436 HG23 ' HB1' ' A' ' 63' ' ' ALA . 4.1 tp -126.5 129.06 71.77 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.509 0 CA-C-N 120.753 1.615 . . . . 1.0 110.076 175.606 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 3.3 mt -124.99 124.84 68.52 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.464 0 C-N-CA 127.689 2.396 . . . . 1.0 111.139 -177.263 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 52' ' ' ASN . . . . . 0.455 ' H ' ' HD1' ' A' ' 61' ' ' TRP . 40.9 t30 -160.04 173.14 16.29 Favored 'General case' 0 N--CA 1.43 -1.456 0 C-N-CA 128.802 2.841 . . . . 1.0 104.564 -173.901 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -153.35 147.99 26.23 Favored 'General case' 0 N--CA 1.429 -1.48 0 O-C-N 119.629 -1.92 . . . . 1.0 113.333 -154.455 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 34.1 mm-40 -121.13 97.63 5.61 Favored 'General case' 0 N--CA 1.43 -1.453 0 C-N-CA 125.361 1.465 . . . . 1.0 112.002 -172.51 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 18.9 tt0 -69.6 -39.89 12.83 Favored Pre-proline 0 N--CA 1.431 -1.416 0 N-CA-C 116.574 2.064 . . . . 1.0 116.574 -174.988 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 52.7 Cg_exo -71.16 -22.62 25.59 Favored 'Trans proline' 0 N--CA 1.433 -2.072 0 CA-C-N 126.228 3.26 . . . . 1.0 114.844 174.794 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 33.2 mt -94.04 -30.92 14.44 Favored 'General case' 0 N--CA 1.431 -1.412 0 C-N-CA 122.895 0.478 . . . . 1.0 111.312 -168.581 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 3.4 m170 85.67 56.5 0.01 OUTLIER 'General case' 0 N--CA 1.43 -1.425 0 C-N-CA 127.581 2.352 . . . . 1.0 110.102 176.826 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 6.5 pt20 -156.23 157.66 36.22 Favored 'General case' 0 N--CA 1.43 -1.449 0 O-C-N 120.409 -1.432 . . . . 1.0 109.71 -178.468 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 79.2 t -121.06 151.43 24.12 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.511 0 N-CA-C 105.63 -1.989 . . . . 1.0 105.63 173.045 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 61' ' ' TRP . . . . . 0.455 ' HD1' ' H ' ' A' ' 52' ' ' ASN . 0.0 OUTLIER -102.21 151.76 21.83 Favored 'General case' 0 N--CA 1.43 -1.467 0 CA-C-N 121.122 1.783 . . . . 1.0 114.275 177.291 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 61.5 mt -123.28 101.72 7.53 Favored 'General case' 0 N--CA 1.43 -1.428 0 N-CA-C 107.03 -1.47 . . . . 1.0 107.03 166.503 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . 0.436 ' HB1' HG23 ' A' ' 50' ' ' ILE . . . -102.05 112.91 25.73 Favored 'General case' 0 N--CA 1.43 -1.435 0 O-C-N 121.05 -1.032 . . . . 1.0 110.517 170.889 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 64' ' ' THR . . . . . . . . . . . . . 77.1 p -119.62 -122.44 0.29 Allowed 'General case' 0 N--CA 1.43 -1.472 0 C-N-CA 126.749 2.02 . . . . 1.0 113.652 -156.782 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 13.7 tmtt? -96.69 -66.33 0.91 Allowed 'General case' 0 N--CA 1.43 -1.426 0 C-N-CA 126.047 1.739 . . . . 1.0 110.726 -170.678 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 20.0 tt0 -77.62 -24.0 49.69 Favored 'General case' 0 N--CA 1.429 -1.487 0 O-C-N 121.26 -0.9 . . . . 1.0 112.694 -176.773 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 172.08 -60.39 0.16 Allowed Glycine 0 N--CA 1.431 -1.68 0 O-C-N 120.398 -1.439 . . . . 1.0 110.18 178.855 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 88.1 170.18 45.74 Favored Glycine 0 N--CA 1.431 -1.678 0 C-N-CA 123.766 0.698 . . . . 1.0 112.521 -177.893 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -166.23 171.79 11.85 Favored 'General case' 0 N--CA 1.429 -1.475 0 C-N-CA 125.986 1.715 . . . . 1.0 110.065 179.398 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 70' ' ' HIS . . . . . 0.437 ' HA ' ' HA ' ' A' ' 61' ' ' TRP . 10.7 p80 -75.68 159.33 31.26 Favored 'General case' 0 N--CA 1.431 -1.393 0 N-CA-C 115.736 1.754 . . . . 1.0 115.736 -178.161 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 47.2 p90 -121.01 137.02 54.85 Favored 'General case' 0 N--CA 1.429 -1.48 0 N-CA-C 114.427 1.269 . . . . 1.0 114.427 -179.912 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 3.3 m-20 -127.56 172.58 10.6 Favored 'General case' 0 N--CA 1.43 -1.462 0 C-N-CA 126.642 1.977 . . . . 1.0 108.364 -174.246 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 19.2 mt -101.01 116.24 32.37 Favored 'General case' 0 N--CA 1.43 -1.442 0 O-C-N 119.837 -1.789 . . . . 1.0 111.893 178.228 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 39.7 mmtm -67.74 -47.71 68.51 Favored 'General case' 0 N--CA 1.429 -1.495 0 O-C-N 120.743 -1.223 . . . . 1.0 111.491 151.889 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . 179.69 -81.81 0.06 OUTLIER Glycine 0 N--CA 1.431 -1.696 0 O-C-N 120.176 -1.578 . . . . 1.0 114.159 176.502 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -89.7 -8.3 52.66 Favored 'General case' 0 N--CA 1.43 -1.474 0 C-N-CA 125.386 1.474 . . . . 1.0 109.173 170.383 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 16.0 mt-10 -124.39 123.01 39.24 Favored 'General case' 0 N--CA 1.429 -1.485 0 N-CA-C 103.797 -2.668 . . . . 1.0 103.797 -172.227 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 78' ' ' TRP . . . . . . . . . . . . . 81.4 m95 -86.31 135.35 33.57 Favored 'General case' 0 N--CA 1.43 -1.464 0 N-CA-C 105.508 -2.034 . . . . 1.0 105.508 164.317 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -129.7 153.17 38.42 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.472 0 O-C-N 119.98 -1.7 . . . . 1.0 107.936 -171.551 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 80' ' ' CYS . . . . . 0.554 ' HG ' HD21 ' A' ' 90' ' ' LEU . 64.3 m -85.91 147.24 26.35 Favored 'General case' 0 N--CA 1.43 -1.43 0 O-C-N 120.46 -1.4 . . . . 1.0 112.591 -177.48 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 28.3 t70 -63.77 -39.94 95.49 Favored 'General case' 0 N--CA 1.431 -1.404 0 O-C-N 119.7 -1.875 . . . . 1.0 115.679 -174.242 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 12.3 ptm180 -130.5 177.22 7.52 Favored 'General case' 0 N--CA 1.43 -1.436 0 O-C-N 120.699 -1.251 . . . . 1.0 112.016 174.839 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 83' ' ' SER . . . . . . . . . . . . 0.408 9.5 p 72.3 -55.96 0.66 Allowed 'General case' 0 N--CA 1.43 -1.444 0 C-N-CA 128.554 2.742 . . . . 1.0 117.418 171.145 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -168.48 93.95 0.11 Allowed Glycine 0 N--CA 1.431 -1.684 0 N-CA-C 109.712 -1.355 . . . . 1.0 109.712 178.73 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 85' ' ' GLU . . . . . 0.423 ' C ' ' HG1' ' A' ' 86' ' ' THR . 10.5 pt-20 -72.33 96.69 1.9 Allowed 'General case' 0 N--CA 1.431 -1.407 0 N-CA-C 118.064 2.616 . . . . 1.0 118.064 -166.053 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 86' ' ' THR . . . . . 0.423 ' HG1' ' C ' ' A' ' 85' ' ' GLU . 57.4 m -167.33 125.92 1.32 Allowed 'General case' 0 N--CA 1.429 -1.49 0 O-C-N 119.347 -2.096 . . . . 1.0 110.836 171.6 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . 0.294 0.1 OUTLIER -51.03 -86.14 0.0 OUTLIER 'General case' 0 N--CA 1.429 -1.475 0 N-CA-C 117.195 2.294 . . . . 1.0 117.195 173.539 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 88' ' ' TRP . . . . . . . . . . . . . 22.3 m95 -58.96 -39.95 83.23 Favored 'General case' 0 N--CA 1.431 -1.422 0 CA-C-N 121.2 1.818 . . . . 1.0 113.584 -173.27 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 9.3 t70 -67.69 -39.96 84.41 Favored 'General case' 0 N--CA 1.43 -1.455 0 N-CA-C 114.388 1.255 . . . . 1.0 114.388 -176.82 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . 0.554 HD21 ' HG ' ' A' ' 80' ' ' CYS . 30.3 tp -76.03 -41.61 50.38 Favored 'General case' 0 N--CA 1.43 -1.438 0 O-C-N 119.098 -2.251 . . . . 1.0 112.483 177.363 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -48.01 -47.38 33.35 Favored 'General case' 0 CA--C 1.489 -1.394 0 C-N-CA 127.495 2.318 . . . . 1.0 113.376 166.835 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 1.3 tp10 -56.52 -51.9 66.77 Favored 'General case' 0 N--CA 1.43 -1.426 0 C-N-CA 127.105 2.162 . . . . 1.0 113.29 170.387 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 7.2 tt0 -52.47 -51.06 61.27 Favored 'General case' 0 N--CA 1.43 -1.464 0 O-C-N 120.668 -1.27 . . . . 1.0 112.866 174.539 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -53.19 -48.73 67.83 Favored 'General case' 0 N--CA 1.43 -1.432 0 N-CA-C 115.034 1.494 . . . . 1.0 115.034 172.706 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -64.45 -53.5 47.3 Favored 'General case' 0 N--CA 1.429 -1.495 0 O-C-N 120.135 -1.603 . . . . 1.0 113.255 178.989 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 96' ' ' THR . . . . . 0.454 HG22 ' H ' ' A' ' 103' ' ' VAL . 47.5 p -59.4 -38.04 79.56 Favored 'General case' 0 CA--C 1.488 -1.431 0 C-N-CA 126.543 1.937 . . . . 1.0 114.051 179.439 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 5.8 pt20 -78.65 -27.19 45.23 Favored 'General case' 0 N--CA 1.429 -1.476 0 N-CA-C 114.871 1.434 . . . . 1.0 114.871 177.944 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 12.4 mm100 -74.67 -38.74 62.35 Favored 'General case' 0 N--CA 1.431 -1.421 0 O-C-N 120.22 -1.55 . . . . 1.0 112.129 170.718 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -79.86 -46.31 17.08 Favored 'General case' 0 N--CA 1.43 -1.45 0 N-CA-C 114.928 1.455 . . . . 1.0 114.928 179.669 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . 122.5 0.1 10.25 Favored Glycine 0 N--CA 1.431 -1.659 0 N-CA-C 116.475 1.35 . . . . 1.0 116.475 174.433 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 11.2 pt-20 -153.56 174.33 14.58 Favored 'General case' 0 N--CA 1.429 -1.499 0 CA-C-N 119.355 1.577 . . . . 1.0 110.223 -178.813 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 16.9 m -74.2 121.62 21.52 Favored 'General case' 0 N--CA 1.43 -1.452 0 O-C-N 120.736 -1.228 . . . . 1.0 112.738 177.928 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 103' ' ' VAL . . . . . 0.454 ' H ' HG22 ' A' ' 96' ' ' THR . 40.5 t -120.87 134.92 62.71 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.458 0 N-CA-C 102.284 -3.228 . . . . 1.0 102.284 -175.195 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 43.7 p -106.73 129.02 54.68 Favored 'General case' 0 N--CA 1.43 -1.457 0 N-CA-C 115.218 1.562 . . . . 1.0 115.218 -166.336 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -139.69 -35.8 0.52 Allowed 'General case' 0 N--CA 1.43 -1.434 0 C-N-CA 127.155 2.182 . . . . 1.0 108.938 167.959 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 2.9 tmm_? . . . . . 0 C--O 1.26 1.609 0 C-N-CA 125.737 1.615 . . . . 1.0 112.859 -167.59 . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 13.4 tpt . . . . . 0 CA--C 1.491 -1.304 0 CA-C-O 120.752 0.311 . . . . 1.0 110.441 . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 43.1 m-80 -68.19 -49.06 63.31 Favored 'General case' 0 N--CA 1.43 -1.453 0 C-N-CA 124.61 1.164 . . . . 1.0 112.34 -176.34 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -57.04 -48.97 77.25 Favored 'General case' 0 N--CA 1.43 -1.432 0 C-N-CA 126.806 2.042 . . . . 1.0 113.857 172.93 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 27.8 t -50.88 -52.9 37.23 Favored 'General case' 0 N--CA 1.431 -1.401 0 C-N-CA 125.722 1.609 . . . . 1.0 114.099 172.579 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 49.7 tt0 -62.86 -52.42 63.17 Favored 'General case' 0 N--CA 1.431 -1.395 0 C-N-CA 124.765 1.226 . . . . 1.0 113.976 -178.452 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -63.46 -35.31 80.03 Favored 'General case' 0 N--CA 1.43 -1.441 0 O-C-N 120.673 -1.267 . . . . 1.0 114.362 178.626 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 9.0 t-160 -66.49 -37.79 85.86 Favored 'General case' 0 N--CA 1.43 -1.432 0 O-C-N 120.198 -1.564 . . . . 1.0 113.791 172.755 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 1.5 mmm180 -68.56 -43.93 75.56 Favored 'General case' 0 N--CA 1.43 -1.432 0 O-C-N 120.055 -1.653 . . . . 1.0 113.687 175.73 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 67.1 mt -56.52 -46.26 80.67 Favored 'General case' 0 N--CA 1.43 -1.45 0 C-N-CA 124.666 1.186 . . . . 1.0 112.558 172.251 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -54.51 -55.69 26.47 Favored 'General case' 0 N--CA 1.43 -1.442 0 C-N-CA 124.477 1.111 . . . . 1.0 113.498 171.6 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 18.7 t70 -46.16 -48.15 17.51 Favored 'General case' 0 N--CA 1.43 -1.45 0 C-N-CA 126.491 1.917 . . . . 1.0 114.093 178.284 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 12.5 mm100 -55.72 -60.6 3.21 Favored 'General case' 0 N--CA 1.43 -1.456 0 N-CA-C 114.522 1.305 . . . . 1.0 114.522 172.944 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 2.5 pp -74.49 -37.68 63.09 Favored 'General case' 0 N--CA 1.43 -1.459 0 N-CA-C 116.585 2.068 . . . . 1.0 116.585 -175.497 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 11.9 m0 -55.6 -47.06 77.11 Favored 'General case' 0 N--CA 1.431 -1.411 0 C-N-CA 127.753 2.421 . . . . 1.0 112.109 171.663 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 47.8 tp -59.73 -45.25 92.75 Favored 'General case' 0 N--CA 1.43 -1.451 0 O-C-N 121.057 -1.027 . . . . 1.0 113.468 172.142 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 25.5 m -56.28 -46.34 79.78 Favored 'General case' 0 N--CA 1.431 -1.383 0 N-CA-C 114.853 1.427 . . . . 1.0 114.853 175.387 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 67.6 mt -64.75 -46.21 92.82 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.437 0 O-C-N 120.431 -1.418 . . . . 1.0 112.206 178.263 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 58.1 tt0 -53.41 -58.41 7.22 Favored 'General case' 0 N--CA 1.43 -1.443 0 C-N-CA 125.047 1.339 . . . . 1.0 111.939 174.765 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 23.7 mt-10 -55.68 -55.43 32.26 Favored 'General case' 0 N--CA 1.43 -1.446 0 C-N-CA 125.789 1.635 . . . . 1.0 115.138 176.748 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 7.2 tpm_? -52.31 -49.18 64.74 Favored 'General case' 0 N--CA 1.43 -1.445 0 C-N-CA 124.578 1.151 . . . . 1.0 113.056 -177.456 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 12.8 tp -81.51 -36.51 29.15 Favored 'General case' 0 N--CA 1.43 -1.432 0 N-CA-C 113.991 1.108 . . . . 1.0 113.991 -176.335 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 27.4 t70 -64.17 -34.36 77.9 Favored 'General case' 0 N--CA 1.431 -1.42 0 O-C-N 119.994 -1.691 . . . . 1.0 114.51 176.567 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 10.1 t70 -67.87 -26.81 66.21 Favored 'General case' 0 N--CA 1.43 -1.431 0 O-C-N 120.185 -1.572 . . . . 1.0 113.388 172.752 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 24' ' ' TRP . . . . . . . . . . . . . 0.2 OUTLIER -75.92 148.84 37.93 Favored 'General case' 0 N--CA 1.43 -1.426 0 O-C-N 120.154 -1.591 . . . . 1.0 114.003 -167.512 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 2.3 t70 -129.1 133.78 47.8 Favored 'General case' 0 N--CA 1.429 -1.491 0 O-C-N 120.528 -1.358 . . . . 1.0 108.972 -175.099 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -166.64 -149.16 5.85 Favored Glycine 0 N--CA 1.431 -1.652 0 O-C-N 120.536 -1.352 . . . . 1.0 112.521 -171.439 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 10.9 t70 -77.03 -41.65 41.72 Favored 'General case' 0 N--CA 1.431 -1.421 0 N-CA-C 107.88 -1.156 . . . . 1.0 107.88 168.439 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 47.1 m -65.2 141.62 58.6 Favored 'General case' 0 N--CA 1.43 -1.471 0 C-N-CA 125.275 1.43 . . . . 1.0 114.236 174.083 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 20.0 t70 -110.97 147.3 35.0 Favored 'General case' 0 N--CA 1.429 -1.517 0 N-CA-C 105.993 -1.854 . . . . 1.0 105.993 171.5 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 48.6 mm -135.02 115.7 19.07 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.457 0 C-N-CA 125.555 1.542 . . . . 1.0 108.528 -160.895 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -121.83 110.22 15.63 Favored 'General case' 0 N--CA 1.43 -1.472 0 C-N-CA 124.461 1.104 . . . . 1.0 109.188 158.718 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 10.3 t -77.13 143.73 38.94 Favored 'General case' 0 N--CA 1.429 -1.507 0 O-C-N 118.625 -2.547 . . . . 1.0 110.204 164.952 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 52.2 mt-10 -101.74 140.07 36.53 Favored 'General case' 0 N--CA 1.431 -1.415 0 C-N-CA 124.37 1.068 . . . . 1.0 109.302 172.211 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 2.5 tp -122.1 107.33 19.56 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.488 0 CA-C-O 124.327 2.013 . . . . 1.0 108.372 177.293 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 35.1 m120 -117.79 68.57 0.76 Allowed 'General case' 0 N--CA 1.43 -1.434 0 CA-C-N 114.425 -1.261 . . . . 1.0 109.651 176.499 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . 73.17 -86.55 0.58 Allowed Glycine 0 N--CA 1.43 -1.713 0 C-N-CA 125.363 1.459 . . . . 1.0 114.334 173.088 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -120.34 27.31 6.7 Favored Glycine 0 N--CA 1.429 -1.79 0 C-N-CA 125.332 1.444 . . . . 1.0 111.866 175.019 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 66.4 t -128.34 129.11 69.03 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.449 0 N-CA-C 107.661 -1.237 . . . . 1.0 107.661 169.628 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 46.3 mt -113.02 123.97 51.56 Favored 'General case' 0 N--CA 1.429 -1.481 0 CA-C-O 122.846 1.307 . . . . 1.0 108.655 166.754 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -121.84 116.33 24.24 Favored 'General case' 0 N--CA 1.43 -1.455 0 N-CA-C 106.348 -1.723 . . . . 1.0 106.348 179.385 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 49.3 mt -94.04 116.1 34.45 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.411 0 O-C-N 119.625 -1.922 . . . . 1.0 108.644 -172.985 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 47.0 p -109.76 120.06 41.29 Favored 'General case' 0 N--CA 1.43 -1.438 0 N-CA-C 113.237 0.828 . . . . 1.0 113.237 -173.656 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 43' ' ' PHE . . . . . . . . . . . . 0.25 1.2 p90 -118.23 166.34 12.72 Favored 'General case' 0 N--CA 1.429 -1.492 0 CA-C-O 123.322 1.534 . . . . 1.0 114.093 179.487 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 1.1 pp20? -63.13 -31.4 72.54 Favored 'General case' 0 N--CA 1.43 -1.45 0 N-CA-C 117.517 2.414 . . . . 1.0 117.517 -159.179 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 59.5 m-80 -74.81 -0.36 18.08 Favored 'General case' 0 N--CA 1.431 -1.411 0 N-CA-C 114.905 1.446 . . . . 1.0 114.905 176.67 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 99.41 -1.3 57.19 Favored Glycine 0 N--CA 1.432 -1.613 0 O-C-N 120.673 -1.267 . . . . 1.0 113.255 166.849 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 3.4 p -96.52 164.47 12.6 Favored 'General case' 0 N--CA 1.428 -1.548 0 C-N-CA 127.028 2.131 . . . . 1.0 110.255 178.439 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 54.3 pttt -162.35 158.93 24.74 Favored 'General case' 0 N--CA 1.429 -1.479 0 CA-C-O 122.468 1.128 . . . . 1.0 113.655 -171.108 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 17.9 mm -103.7 140.14 22.71 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.412 0 C-N-CA 125.258 1.423 . . . . 1.0 107.232 179.073 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 50' ' ' ILE . . . . . 0.416 ' HB ' ' HB3' ' A' ' 63' ' ' ALA . 1.2 mm -122.39 108.04 20.89 Favored 'Isoleucine or valine' 0 N--CA 1.428 -1.53 0 CA-C-N 119.649 1.113 . . . . 1.0 110.299 -175.34 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 2.7 mt -122.82 98.6 5.82 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.463 0 CA-C-O 123.357 1.551 . . . . 1.0 111.828 179.117 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 2.3 m120 -108.81 148.0 31.23 Favored 'General case' 0 N--CA 1.429 -1.51 0 C-N-CA 127.896 2.478 . . . . 1.0 108.727 174.796 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 39.1 ttp180 -154.29 134.29 13.1 Favored 'General case' 0 N--CA 1.429 -1.496 0 CA-C-N 113.729 -1.578 . . . . 1.0 108.305 -167.055 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -89.55 129.47 36.01 Favored 'General case' 0 N--CA 1.431 -1.391 0 N-CA-C 106.687 -1.598 . . . . 1.0 106.687 163.617 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 37.8 tt0 -63.7 -51.25 67.05 Favored Pre-proline 0 N--CA 1.431 -1.393 0 CA-C-O 116.573 -1.68 . . . . 1.0 113.431 172.581 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 52.6 Cg_exo -67.29 -175.69 0.71 Allowed 'Trans proline' 0 N--CA 1.433 -2.055 0 CA-C-N 125.307 2.931 . . . . 1.0 114.707 162.707 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 15.0 mt 82.38 -30.07 0.1 Allowed 'General case' 0 N--CA 1.43 -1.452 0 C-N-CA 127.657 2.383 . . . . 1.0 114.934 169.439 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER 76.87 47.38 0.07 Allowed 'General case' 0 N--CA 1.432 -1.364 0 C-N-CA 126.247 1.819 . . . . 1.0 114.204 170.433 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 38.2 tt0 -160.36 152.12 19.92 Favored 'General case' 0 N--CA 1.429 -1.48 0 O-C-N 120.693 -1.254 . . . . 1.0 108.27 179.031 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 15.6 t -120.73 156.91 23.91 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.486 0 C-N-CA 124.819 1.248 . . . . 1.0 109.83 179.634 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 61' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -99.35 153.49 18.93 Favored 'General case' 0 N--CA 1.43 -1.427 0 O-C-N 120.567 -1.333 . . . . 1.0 111.419 170.198 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -137.45 90.9 2.55 Favored 'General case' 0 N--CA 1.43 -1.457 0 O-C-N 120.103 -1.623 . . . . 1.0 109.862 179.116 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . 0.416 ' HB3' ' HB ' ' A' ' 50' ' ' ILE . . . -104.37 139.92 38.65 Favored 'General case' 0 N--CA 1.429 -1.492 0 O-C-N 119.943 -1.723 . . . . 1.0 111.858 175.647 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 64' ' ' THR . . . . . . . . . . . . . 80.8 p -150.44 -130.28 0.05 OUTLIER 'General case' 0 N--CA 1.43 -1.468 0 C-N-CA 126.633 1.973 . . . . 1.0 105.783 -163.082 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 4.7 tmtt? -84.82 -39.64 18.11 Favored 'General case' 0 N--CA 1.43 -1.434 0 O-C-N 120.254 -1.529 . . . . 1.0 110.913 166.076 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 1.7 tp-100 -78.62 -25.14 45.05 Favored 'General case' 0 N--CA 1.43 -1.453 0 N-CA-C 114.937 1.458 . . . . 1.0 114.937 -150.785 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 169.76 -52.04 0.2 Allowed Glycine 0 N--CA 1.43 -1.729 0 O-C-N 121.076 -1.015 . . . . 1.0 113.16 174.632 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 116.48 93.53 1.79 Allowed Glycine 0 N--CA 1.43 -1.7 0 C-N-CA 125.255 1.407 . . . . 1.0 110.843 -173.691 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 69' ' ' TYR . . . . . 0.486 ' CD1' ' HG2' ' A' ' 82' ' ' ARG . 13.5 m-85 -122.07 143.26 49.63 Favored 'General case' 0 N--CA 1.43 -1.464 0 N-CA-C 107.962 -1.125 . . . . 1.0 107.962 -166.406 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 70' ' ' HIS . . . . . . . . . . . . 0.275 1.3 p80 -89.47 160.92 16.52 Favored 'General case' 0 N--CA 1.429 -1.482 0 O-C-N 119.376 -2.078 . . . . 1.0 113.746 178.636 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 71' ' ' PHE . . . . . . . . . . . . 0.27 11.9 t80 -139.34 125.0 19.45 Favored 'General case' 0 N--CA 1.429 -1.48 0 CA-C-N 115.333 -0.849 . . . . 1.0 111.076 -149.589 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -126.25 161.4 27.83 Favored 'General case' 0 N--CA 1.431 -1.402 0 C-N-CA 123.746 0.818 . . . . 1.0 109.974 178.089 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 57.3 tp -96.11 121.83 38.29 Favored 'General case' 0 N--CA 1.43 -1.434 0 O-C-N 119.599 -1.938 . . . . 1.0 110.403 176.391 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 20.0 mmmt -84.89 -48.56 9.2 Favored 'General case' 0 N--CA 1.43 -1.461 0 O-C-N 120.989 -1.069 . . . . 1.0 112.815 175.74 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -171.85 -69.77 0.04 OUTLIER Glycine 0 N--CA 1.429 -1.77 0 N-CA-C 110.843 -0.903 . . . . 1.0 110.843 179.007 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 20.2 p-10 -90.06 -26.92 20.03 Favored 'General case' 0 N--CA 1.43 -1.469 0 O-C-N 121.07 -1.253 . . . . 1.0 111.09 179.089 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 5.8 mt-10 -152.58 155.75 37.97 Favored 'General case' 0 N--CA 1.429 -1.492 0 N-CA-C 104.161 -2.533 . . . . 1.0 104.161 -164.417 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 78' ' ' TRP . . . . . . . . . . . . . 31.0 m95 -86.69 123.59 32.03 Favored 'General case' 0 N--CA 1.43 -1.456 0 N-CA-C 107.084 -1.45 . . . . 1.0 107.084 -178.311 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 3.3 mt -101.47 137.12 30.26 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.484 0 CA-C-O 123.893 1.806 . . . . 1.0 106.332 176.804 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 74.8 m -77.17 145.95 37.37 Favored 'General case' 0 N--CA 1.428 -1.527 0 CA-C-N 114.411 -1.268 . . . . 1.0 109.977 -175.593 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 37.6 t0 -73.44 -43.51 60.2 Favored 'General case' 0 N--CA 1.431 -1.416 0 O-C-N 120.469 -1.394 . . . . 1.0 111.953 -174.007 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 82' ' ' ARG . . . . . 0.486 ' HG2' ' CD1' ' A' ' 69' ' ' TYR . 0.1 OUTLIER -79.11 134.55 36.72 Favored 'General case' 0 N--CA 1.43 -1.463 0 O-C-N 119.977 -1.702 . . . . 1.0 110.378 176.911 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 8.0 t 65.58 -66.24 0.15 Allowed 'General case' 0 N--CA 1.43 -1.437 0 N-CA-C 116.215 1.932 . . . . 1.0 116.215 -179.951 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 130.48 89.49 0.52 Allowed Glycine 0 N--CA 1.43 -1.711 0 N-CA-C 107.474 -2.25 . . . . 1.0 107.474 -167.417 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 52.3 mt-10 -137.97 -168.33 2.33 Favored 'General case' 0 N--CA 1.431 -1.413 0 N-CA-C 105.162 -2.162 . . . . 1.0 105.162 -178.755 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 32.0 m -154.99 130.71 9.96 Favored 'General case' 0 N--CA 1.43 -1.471 0 O-C-N 119.346 -2.096 . . . . 1.0 111.102 -150.661 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 1.1 t80 -25.79 -92.56 0.0 OUTLIER 'General case' 0 N--CA 1.429 -1.492 0 N-CA-C 119.674 3.213 . . . . 1.0 119.674 174.7 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 88' ' ' TRP . . . . . . . . . . . . . 78.8 m95 -72.12 -26.8 62.26 Favored 'General case' 0 N--CA 1.429 -1.483 0 O-C-N 120.392 -1.442 . . . . 1.0 110.379 -169.819 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -68.42 -49.97 56.14 Favored 'General case' 0 N--CA 1.43 -1.454 0 C-N-CA 125.409 1.483 . . . . 1.0 113.139 178.413 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -70.14 -42.74 72.16 Favored 'General case' 0 N--CA 1.429 -1.48 0 CA-C-O 122.969 1.366 . . . . 1.0 111.73 -177.565 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 24.6 tp -53.76 -49.86 67.29 Favored 'General case' 0 N--CA 1.43 -1.459 0 C-N-CA 126.371 1.868 . . . . 1.0 112.946 173.996 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 1.9 tm-20 -58.21 -55.76 30.81 Favored 'General case' 0 N--CA 1.43 -1.443 0 C-N-CA 126.742 2.017 . . . . 1.0 114.816 173.71 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 3.6 pt20 -63.96 -43.42 95.83 Favored 'General case' 0 N--CA 1.43 -1.437 0 O-C-N 120.577 -1.327 . . . . 1.0 114.068 -177.452 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -62.79 -47.97 81.15 Favored 'General case' 0 N--CA 1.43 -1.442 0 O-C-N 120.635 -1.29 . . . . 1.0 113.057 175.098 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -63.43 -35.99 82.24 Favored 'General case' 0 N--CA 1.428 -1.536 0 O-C-N 120.312 -1.493 . . . . 1.0 113.399 176.98 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 91.5 m -57.75 -51.96 67.41 Favored 'General case' 0 N--CA 1.43 -1.456 0 C-N-CA 125.526 1.53 . . . . 1.0 112.474 173.149 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 5.0 pt20 -70.18 -31.34 68.77 Favored 'General case' 0 N--CA 1.43 -1.45 0 N-CA-C 114.75 1.389 . . . . 1.0 114.75 -179.847 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 51.0 mt-30 -66.26 -46.71 76.12 Favored 'General case' 0 N--CA 1.43 -1.468 0 O-C-N 119.741 -1.849 . . . . 1.0 114.806 169.876 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -77.98 -46.88 19.85 Favored 'General case' 0 N--CA 1.428 -1.534 0 N-CA-C 113.912 1.078 . . . . 1.0 113.912 -176.335 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . 99.58 24.7 9.84 Favored Glycine 0 N--CA 1.431 -1.691 0 C-N-CA 124.502 1.048 . . . . 1.0 113.422 -175.499 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 13.7 pt-20 -161.63 160.69 29.08 Favored 'General case' 0 N--CA 1.429 -1.482 0 N-CA-C 106.495 -1.669 . . . . 1.0 106.495 174.672 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 70.2 m -66.63 112.18 4.03 Favored 'General case' 0 N--CA 1.429 -1.5 0 CA-C-N 120.087 1.312 . . . . 1.0 112.43 -178.522 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 39.9 t -100.49 108.43 23.03 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.453 0 N-CA-C 107.302 -1.37 . . . . 1.0 107.302 173.867 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 44.0 p -141.31 127.72 19.95 Favored 'General case' 0 N--CA 1.43 -1.442 0 N-CA-C 113.792 1.034 . . . . 1.0 113.792 -169.483 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 5.2 t80 -93.85 -24.31 17.79 Favored 'General case' 0 N--CA 1.43 -1.458 0 C-N-CA 124.059 0.944 . . . . 1.0 109.759 167.366 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 18.3 mmm-85 . . . . . 0 C--O 1.261 1.661 0 O-C-N 120.971 -1.081 . . . . 1.0 110.385 -175.56 . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 72.7 mtp . . . . . 0 CA--C 1.49 -1.348 0 N-CA-C 113.519 0.933 . . . . 1.0 113.519 . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 23.6 t-20 -114.47 136.99 52.4 Favored 'General case' 0 N--CA 1.431 -1.397 0 O-C-N 120.996 -1.065 . . . . 1.0 112.892 -169.499 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 16.2 m-20 -61.69 -54.16 46.33 Favored 'General case' 0 N--CA 1.43 -1.447 0 C-N-CA 125.96 1.704 . . . . 1.0 113.924 176.451 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 53.9 m -65.56 -33.57 76.22 Favored 'General case' 0 N--CA 1.429 -1.496 0 O-C-N 120.462 -1.399 . . . . 1.0 113.247 -177.705 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 37.0 tt0 -60.33 -55.09 37.92 Favored 'General case' 0 N--CA 1.43 -1.448 0 C-N-CA 124.306 1.042 . . . . 1.0 112.488 170.471 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 19.8 t80 -50.56 -48.11 57.58 Favored 'General case' 0 N--CA 1.431 -1.425 0 N-CA-C 114.651 1.352 . . . . 1.0 114.651 170.829 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 7.5 t-80 -55.62 -55.72 28.75 Favored 'General case' 0 N--CA 1.43 -1.435 0 C-N-CA 125.979 1.712 . . . . 1.0 114.939 177.344 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 42.6 mtm105 -61.12 -54.37 45.38 Favored 'General case' 0 CA--C 1.49 -1.357 0 C-N-CA 124.86 1.264 . . . . 1.0 113.017 179.92 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 95.9 mt -59.9 -46.45 89.31 Favored 'General case' 0 N--CA 1.431 -1.393 0 O-C-N 121.249 -0.907 . . . . 1.0 113.299 -179.221 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -57.53 -43.46 84.36 Favored 'General case' 0 N--CA 1.43 -1.448 0 N-CA-C 113.779 1.029 . . . . 1.0 113.779 177.355 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 15.9 t0 -63.27 -46.96 84.4 Favored 'General case' 0 N--CA 1.43 -1.45 0 N-CA-C 113.297 0.851 . . . . 1.0 113.297 177.307 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 59.7 mt-30 -61.04 -48.61 80.97 Favored 'General case' 0 N--CA 1.432 -1.35 0 N-CA-C 116.357 1.984 . . . . 1.0 116.357 174.92 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 3.9 pp -67.39 -39.11 85.59 Favored 'General case' 0 N--CA 1.43 -1.474 0 O-C-N 119.917 -1.739 . . . . 1.0 113.996 179.626 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 5.6 m0 -48.69 -57.52 6.15 Favored 'General case' 0 N--CA 1.43 -1.459 0 C-N-CA 126.039 1.736 . . . . 1.0 114.195 166.983 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 51.6 tp -58.7 -41.82 87.17 Favored 'General case' 0 N--CA 1.431 -1.41 0 N-CA-C 113.819 1.044 . . . . 1.0 113.819 177.741 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 90.3 m -57.74 -55.44 34.83 Favored 'General case' 0 N--CA 1.43 -1.444 0 C-N-CA 125.819 1.647 . . . . 1.0 113.496 175.915 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 86.1 mt -59.76 -48.9 85.85 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.419 0 C-N-CA 125.557 1.543 . . . . 1.0 112.397 176.768 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 69.6 tt0 -54.92 -53.3 57.29 Favored 'General case' 0 N--CA 1.428 -1.525 0 C-N-CA 125.226 1.41 . . . . 1.0 113.776 178.666 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 34.8 tt0 -63.88 -43.78 95.02 Favored 'General case' 0 N--CA 1.429 -1.523 0 N-CA-C 114.484 1.29 . . . . 1.0 114.484 179.287 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 6.8 tpt180 -67.19 -35.31 79.38 Favored 'General case' 0 N--CA 1.43 -1.438 0 N-CA-C 114.562 1.319 . . . . 1.0 114.562 -179.559 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 94.6 mt -78.23 -35.87 47.76 Favored 'General case' 0 N--CA 1.43 -1.466 0 O-C-N 120.627 -1.295 . . . . 1.0 113.409 174.314 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 37.2 t70 -57.87 -33.12 68.35 Favored 'General case' 0 N--CA 1.43 -1.465 0 C-N-CA 125.155 1.382 . . . . 1.0 113.026 171.036 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 33.6 t70 -69.79 -18.66 63.49 Favored 'General case' 0 N--CA 1.431 -1.41 0 N-CA-C 114.382 1.253 . . . . 1.0 114.382 174.359 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 24' ' ' TRP . . . . . . . . . . . . . 28.8 t-105 -75.99 152.44 36.98 Favored 'General case' 0 N--CA 1.429 -1.488 0 O-C-N 119.225 -2.172 . . . . 1.0 114.184 -171.557 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 1.8 t0 -154.33 175.79 13.11 Favored 'General case' 0 N--CA 1.431 -1.419 0 N-CA-C 108.635 -0.876 . . . . 1.0 108.635 -174.059 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 160.03 -131.43 2.68 Favored Glycine 0 N--CA 1.43 -1.733 0 N-CA-C 110.911 -0.875 . . . . 1.0 110.911 -178.655 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -86.52 -34.47 19.97 Favored 'General case' 0 N--CA 1.429 -1.489 0 C-N-CA 125.523 1.529 . . . . 1.0 108.697 170.566 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 39.3 m -85.5 172.29 11.1 Favored 'General case' 0 N--CA 1.43 -1.434 0 C-N-CA 124.795 1.238 . . . . 1.0 112.918 -176.589 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 43.1 t0 -121.41 151.43 40.19 Favored 'General case' 0 N--CA 1.431 -1.408 0 C-N-CA 125.874 1.67 . . . . 1.0 106.92 176.116 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -159.84 117.72 0.2 Allowed 'Isoleucine or valine' 0 N--CA 1.43 -1.46 0 CA-C-O 122.355 1.074 . . . . 1.0 108.265 -167.863 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 23.8 t0 -136.21 134.82 38.55 Favored 'General case' 0 N--CA 1.428 -1.546 0 O-C-N 120.83 -1.169 . . . . 1.0 109.066 175.451 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 73.4 m -100.66 138.82 37.21 Favored 'General case' 0 N--CA 1.43 -1.47 0 O-C-N 119.531 -1.981 . . . . 1.0 111.423 179.793 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 52.6 mt-10 -109.81 134.44 52.03 Favored 'General case' 0 N--CA 1.43 -1.459 0 O-C-N 121.102 -0.999 . . . . 1.0 109.929 -172.09 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 2.3 tp -105.29 106.41 20.46 Favored 'Isoleucine or valine' 0 CA--C 1.488 -1.413 0 N-CA-C 105.25 -2.13 . . . . 1.0 105.25 169.304 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 55.2 t30 -135.55 107.5 7.11 Favored 'General case' 0 N--CA 1.43 -1.457 0 CA-C-N 114.777 -1.101 . . . . 1.0 109.899 -173.242 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . 67.11 31.44 77.7 Favored Glycine 0 N--CA 1.43 -1.756 0 O-C-N 120.413 -1.43 . . . . 1.0 114.944 174.179 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 81.64 4.54 90.34 Favored Glycine 0 N--CA 1.429 -1.794 0 O-C-N 121.231 -1.158 . . . . 1.0 114.775 -174.581 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 24.2 t -103.51 127.36 57.57 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.471 0 N-CA-C 107.963 -1.125 . . . . 1.0 107.963 175.353 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 12.3 mt -88.64 127.14 35.56 Favored 'General case' 0 N--CA 1.431 -1.385 0 CA-C-O 123.626 1.679 . . . . 1.0 107.084 161.601 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -130.09 115.04 16.51 Favored 'General case' 0 N--CA 1.429 -1.492 0 N-CA-C 105.759 -1.941 . . . . 1.0 105.759 -169.605 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 82.9 mt -94.14 110.78 24.1 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.485 0 N-CA-C 107.867 -1.16 . . . . 1.0 107.867 -168.625 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 9.8 p -112.65 126.6 55.55 Favored 'General case' 0 N--CA 1.431 -1.423 0 CA-C-O 121.662 0.744 . . . . 1.0 112.508 -170.319 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 43' ' ' PHE . . . . . . . . . . . . . 1.6 p90 -119.97 159.83 23.94 Favored 'General case' 0 N--CA 1.429 -1.489 0 O-C-N 120.558 -1.339 . . . . 1.0 110.405 174.048 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -66.03 -15.08 62.73 Favored 'General case' 0 N--CA 1.43 -1.475 0 N-CA-C 117.762 2.505 . . . . 1.0 117.762 -163.454 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 45.1 m-80 -71.8 -7.74 50.1 Favored 'General case' 0 N--CA 1.43 -1.429 0 C-N-CA 125.935 1.694 . . . . 1.0 113.845 173.472 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 88.76 41.42 6.0 Favored Glycine 0 N--CA 1.429 -1.819 0 O-C-N 120.942 -1.098 . . . . 1.0 114.668 165.888 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 17.0 m -150.99 168.92 23.08 Favored 'General case' 0 N--CA 1.43 -1.45 0 N-CA-C 106.058 -1.831 . . . . 1.0 106.058 179.597 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -156.96 153.27 27.78 Favored 'General case' 0 N--CA 1.43 -1.442 0 N-CA-C 114.295 1.22 . . . . 1.0 114.295 -168.202 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 5.0 mm -97.61 140.62 17.43 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.478 0 C-N-CA 125.825 1.65 . . . . 1.0 106.963 177.598 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 4.7 mm -115.85 118.16 57.9 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.468 0 C-N-CA 124.616 1.166 . . . . 1.0 110.176 -171.935 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 3.4 mt -128.68 120.87 53.55 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.479 0 CA-C-O 122.806 1.288 . . . . 1.0 112.476 -176.876 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 52' ' ' ASN . . . . . 0.446 ' H ' ' HD1' ' A' ' 61' ' ' TRP . 47.2 t30 -156.46 169.17 25.24 Favored 'General case' 0 N--CA 1.429 -1.488 0 N-CA-C 105.374 -2.084 . . . . 1.0 105.374 -178.739 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 29.6 ptt180 -140.57 127.22 20.3 Favored 'General case' 0 N--CA 1.431 -1.409 0 C-N-CA 124.777 1.231 . . . . 1.0 113.004 -159.315 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -110.46 108.2 18.13 Favored 'General case' 0 N--CA 1.43 -1.469 0 C-N-CA 125.212 1.405 . . . . 1.0 110.935 -174.641 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 86.8 mt-10 -64.82 -52.76 48.2 Favored Pre-proline 0 N--CA 1.43 -1.462 0 N-CA-C 118.363 2.727 . . . . 1.0 118.363 -169.497 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 31.9 Cg_exo -73.52 -10.62 23.89 Favored 'Trans proline' 0 N--CA 1.433 -2.033 0 CA-C-N 128.01 3.896 . . . . 1.0 114.01 -168.971 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 35.0 mt -94.1 -22.37 18.53 Favored 'General case' 0 N--CA 1.431 -1.425 0 C-N-CA 126.282 1.833 . . . . 1.0 109.159 177.535 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 32.3 m80 65.91 47.92 1.92 Allowed 'General case' 0 N--CA 1.429 -1.494 0 C-N-CA 126.614 1.965 . . . . 1.0 111.193 175.145 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 13.9 pt20 -144.01 149.33 36.55 Favored 'General case' 0 N--CA 1.429 -1.49 0 C-N-CA 124.31 1.044 . . . . 1.0 110.733 -178.769 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 4.2 t -100.2 153.23 4.6 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.5 0 N-CA-C 108.372 -0.973 . . . . 1.0 108.372 172.043 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 61' ' ' TRP . . . . . 0.446 ' HD1' ' H ' ' A' ' 52' ' ' ASN . 0.0 OUTLIER -102.73 155.3 18.41 Favored 'General case' 0 N--CA 1.43 -1.443 0 O-C-N 119.856 -1.777 . . . . 1.0 113.784 173.337 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . 0.4 ' O ' ' HA2' ' A' ' 68' ' ' GLY . 18.2 mt -125.52 94.93 4.28 Favored 'General case' 0 N--CA 1.432 -1.36 0 N-CA-C 106.16 -1.793 . . . . 1.0 106.16 164.207 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -98.56 140.7 32.4 Favored 'General case' 0 N--CA 1.429 -1.49 0 CA-C-O 122.712 1.244 . . . . 1.0 110.113 171.812 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 64' ' ' THR . . . . . . . . . . . . . 6.3 t -153.47 -130.04 0.04 OUTLIER 'General case' 0 N--CA 1.431 -1.414 0 O-C-N 120.767 -1.208 . . . . 1.0 109.011 -169.883 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 3.4 tmtp? -72.01 -64.96 0.83 Allowed 'General case' 0 N--CA 1.429 -1.498 0 O-C-N 119.969 -1.707 . . . . 1.0 111.537 -179.871 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -128.24 -26.69 2.79 Favored 'General case' 0 N--CA 1.429 -1.507 0 O-C-N 121.41 -0.806 . . . . 1.0 112.011 179.139 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . -94.84 61.96 1.62 Allowed Glycine 0 N--CA 1.431 -1.668 0 O-C-N 121.062 -1.024 . . . . 1.0 113.486 -168.62 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . 0.4 ' HA2' ' O ' ' A' ' 62' ' ' LEU . . . -75.17 83.81 0.84 Allowed Glycine 0 N--CA 1.43 -1.705 0 CA-C-O 122.609 1.116 . . . . 1.0 115.663 174.412 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 20.0 m-30 -113.96 148.28 37.16 Favored 'General case' 0 N--CA 1.43 -1.432 0 N-CA-C 107.454 -1.313 . . . . 1.0 107.454 -169.634 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 18.1 p-80 -86.52 157.77 19.69 Favored 'General case' 0 N--CA 1.43 -1.428 0 O-C-N 120.288 -1.507 . . . . 1.0 111.272 174.593 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 71' ' ' PHE . . . . . . . . . . . . 0.294 86.9 t80 -121.41 113.18 19.51 Favored 'General case' 0 N--CA 1.43 -1.447 0 C-N-CA 125.671 1.588 . . . . 1.0 107.951 -157.147 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 12.1 m-20 -146.99 157.57 43.66 Favored 'General case' 0 N--CA 1.428 -1.56 0 CA-C-N 119.501 1.046 . . . . 1.0 111.323 -175.532 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 27.5 tp -84.78 137.09 33.4 Favored 'General case' 0 N--CA 1.432 -1.366 0 O-C-N 120.465 -1.397 . . . . 1.0 113.711 -172.302 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 38.9 mmtm -106.14 -96.63 0.35 Allowed 'General case' 0 N--CA 1.429 -1.475 0 C-N-CA 125.143 1.377 . . . . 1.0 108.926 166.971 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -100.7 -96.28 2.22 Favored Glycine 0 N--CA 1.429 -1.774 0 O-C-N 120.946 -1.096 . . . . 1.0 112.989 178.637 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 44.2 t0 -98.19 17.02 19.55 Favored 'General case' 0 N--CA 1.431 -1.394 0 C-N-CA 125.409 1.484 . . . . 1.0 108.182 173.587 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 5.3 mm-40 -135.78 124.58 23.97 Favored 'General case' 0 N--CA 1.43 -1.472 0 N-CA-C 106.162 -1.792 . . . . 1.0 106.162 -167.834 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 78' ' ' TRP . . . . . . . . . . . . . 46.8 m95 -80.56 102.22 9.63 Favored 'General case' 0 N--CA 1.43 -1.472 0 N-CA-C 104.639 -2.356 . . . . 1.0 104.639 161.536 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 1.7 pt -89.22 158.04 2.99 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.474 0 O-C-N 119.184 -2.197 . . . . 1.0 108.122 179.313 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 89.6 m -81.63 116.04 21.18 Favored 'General case' 0 N--CA 1.432 -1.359 0 N-CA-C 106.409 -1.7 . . . . 1.0 106.409 170.974 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 6.1 t70 -69.91 -41.58 74.47 Favored 'General case' 0 N--CA 1.431 -1.412 0 C-N-CA 126.147 1.779 . . . . 1.0 112.538 -161.744 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 27.3 ttt180 -73.24 125.23 27.29 Favored 'General case' 0 N--CA 1.431 -1.389 0 C-N-CA 125.8 1.64 . . . . 1.0 109.514 172.345 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 83' ' ' SER . . . . . . . . . . . . 0.341 56.8 m 73.17 -42.44 0.53 Allowed 'General case' 0 N--CA 1.43 -1.462 0 C-N-CA 126.511 1.924 . . . . 1.0 115.717 -174.947 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 107.18 70.16 0.72 Allowed Glycine 0 N--CA 1.43 -1.752 0 O-C-N 120.629 -1.294 . . . . 1.0 114.38 166.564 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 64.1 mm-40 -120.27 -126.62 0.27 Allowed 'General case' 0 N--CA 1.429 -1.481 0 CA-C-N 117.953 0.877 . . . . 1.0 112.519 -169.383 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 92.7 m -158.59 140.22 13.54 Favored 'General case' 0 N--CA 1.43 -1.467 0 O-C-N 119.806 -1.808 . . . . 1.0 108.851 -168.527 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 0.8 OUTLIER -42.94 -92.46 0.0 OUTLIER 'General case' 0 N--CA 1.43 -1.47 0 C-N-CA 127.699 2.399 . . . . 1.0 115.704 172.366 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 88' ' ' TRP . . . . . . . . . . . . . 1.1 t-105 -75.57 -26.61 58.08 Favored 'General case' 0 N--CA 1.428 -1.535 0 O-C-N 120.517 -1.365 . . . . 1.0 111.01 -164.739 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 60.2 m-20 -63.8 -42.53 97.69 Favored 'General case' 0 N--CA 1.43 -1.442 0 O-C-N 120.175 -1.578 . . . . 1.0 114.586 173.531 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 33.3 tp -74.66 -41.74 59.76 Favored 'General case' 0 N--CA 1.428 -1.526 0 O-C-N 119.457 -2.027 . . . . 1.0 111.733 178.589 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 37.0 tp -55.06 -35.4 64.47 Favored 'General case' 0 N--CA 1.431 -1.415 0 C-N-CA 126.617 1.967 . . . . 1.0 114.371 169.947 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 3.0 tm-20 -61.9 -53.51 54.81 Favored 'General case' 0 N--CA 1.43 -1.428 0 C-N-CA 126.189 1.796 . . . . 1.0 111.222 167.466 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 6.5 tt0 -56.01 -46.33 78.82 Favored 'General case' 0 N--CA 1.43 -1.435 0 CA-C-N 120.808 1.64 . . . . 1.0 115.151 176.514 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -51.67 -58.19 7.07 Favored 'General case' 0 N--CA 1.43 -1.438 0 C-N-CA 127.104 2.162 . . . . 1.0 114.584 171.859 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -64.63 -42.61 95.36 Favored 'General case' 0 N--CA 1.429 -1.487 0 O-C-N 120.5 -1.375 . . . . 1.0 113.604 178.366 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 44.5 m -57.87 -48.35 80.07 Favored 'General case' 0 N--CA 1.43 -1.431 0 C-N-CA 126.561 1.945 . . . . 1.0 112.56 175.403 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 2.0 pt20 -70.3 -28.36 65.13 Favored 'General case' 0 N--CA 1.429 -1.485 0 O-C-N 120.185 -1.572 . . . . 1.0 114.043 -179.953 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 3.6 mm-40 -81.84 -36.65 28.04 Favored 'General case' 0 N--CA 1.429 -1.477 0 O-C-N 120.033 -1.667 . . . . 1.0 114.263 175.656 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -86.14 -34.57 20.54 Favored 'General case' 0 N--CA 1.43 -1.435 0 O-C-N 120.518 -1.364 . . . . 1.0 114.186 -179.817 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . 92.67 22.06 29.69 Favored Glycine 0 N--CA 1.429 -1.794 0 O-C-N 120.514 -1.366 . . . . 1.0 114.073 178.156 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 12.0 pt-20 -158.17 158.46 34.64 Favored 'General case' 0 N--CA 1.43 -1.436 0 N-CA-C 104.707 -2.331 . . . . 1.0 104.707 -172.631 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 39.7 m -74.02 112.68 10.38 Favored 'General case' 0 N--CA 1.43 -1.444 0 CA-C-N 121.318 1.872 . . . . 1.0 111.848 178.205 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 44.7 t -107.24 101.59 12.72 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.444 0 CA-C-O 122.623 1.201 . . . . 1.0 108.315 177.071 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 66.1 p -139.76 149.91 44.14 Favored 'General case' 0 N--CA 1.429 -1.494 0 O-C-N 120.939 -1.101 . . . . 1.0 113.823 -168.057 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 105' ' ' PHE . . . . . . . . . . . . 0.262 0.0 OUTLIER -106.74 -21.94 12.88 Favored 'General case' 0 N--CA 1.429 -1.49 0 C-N-CA 124.679 1.192 . . . . 1.0 110.602 158.76 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 5.2 mmm180 . . . . . 0 C--O 1.26 1.628 0 CA-C-O 117.659 -1.162 . . . . 1.0 111.118 -178.855 . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 54.1 ttp . . . . . 0 CA--C 1.489 -1.386 0 CA-C-O 121.749 0.785 . . . . 1.0 109.119 . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 1.8 p30 -170.5 -39.72 0.02 OUTLIER 'General case' 0 N--CA 1.43 -1.435 0 O-C-N 120.871 -1.143 . . . . 1.0 112.278 -173.389 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 3.8 m-20 -55.71 -48.67 74.75 Favored 'General case' 0 N--CA 1.431 -1.424 0 C-N-CA 126.605 1.962 . . . . 1.0 114.784 -173.079 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 19.2 m -52.36 -53.93 38.3 Favored 'General case' 0 N--CA 1.43 -1.456 0 C-N-CA 125.186 1.394 . . . . 1.0 113.905 178.418 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 45.0 mt-10 -57.48 -58.59 7.62 Favored 'General case' 0 N--CA 1.431 -1.425 0 C-N-CA 125.49 1.516 . . . . 1.0 112.082 176.414 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 6' ' ' PHE . . . . . 0.474 ' HB2' ' CD2' ' A' ' 58' ' ' HIS . 2.7 t80 -56.56 -39.44 73.45 Favored 'General case' 0 N--CA 1.43 -1.459 0 N-CA-C 116.481 2.03 . . . . 1.0 116.481 178.967 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 29.7 m170 -67.82 -44.16 77.92 Favored 'General case' 0 CA--C 1.489 -1.372 0 O-C-N 121.061 -1.024 . . . . 1.0 113.454 179.418 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -70.89 -41.6 71.11 Favored 'General case' 0 N--CA 1.431 -1.392 0 O-C-N 121.091 -1.006 . . . . 1.0 112.295 178.53 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 89.9 mt -62.49 -39.07 92.28 Favored 'General case' 0 N--CA 1.431 -1.421 0 O-C-N 119.682 -1.886 . . . . 1.0 113.554 174.157 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -59.74 -53.2 60.75 Favored 'General case' 0 N--CA 1.43 -1.473 0 C-N-CA 125.047 1.339 . . . . 1.0 112.776 172.53 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 40.1 t0 -47.44 -54.97 9.94 Favored 'General case' 0 N--CA 1.43 -1.473 0 C-N-CA 127.609 2.364 . . . . 1.0 112.965 177.098 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 42.4 mt-30 -55.23 -50.73 68.69 Favored 'General case' 0 N--CA 1.43 -1.46 0 N-CA-C 116.375 1.991 . . . . 1.0 116.375 173.705 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 1.8 pp -71.27 -38.35 71.85 Favored 'General case' 0 N--CA 1.429 -1.497 0 O-C-N 119.942 -1.724 . . . . 1.0 115.386 178.888 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 0.5 OUTLIER -45.78 -57.19 4.49 Favored 'General case' 0 N--CA 1.429 -1.489 0 C-N-CA 128.231 2.612 . . . . 1.0 113.45 168.195 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 3.0 pp -70.55 -30.34 67.04 Favored 'General case' 0 N--CA 1.43 -1.431 0 O-C-N 120.764 -1.21 . . . . 1.0 112.926 -179.193 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 97.3 m -64.27 -50.19 68.91 Favored 'General case' 0 N--CA 1.43 -1.45 0 C-N-CA 124.419 1.088 . . . . 1.0 112.815 174.516 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 82.7 mt -60.49 -47.53 92.29 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.477 0 O-C-N 120.621 -1.3 . . . . 1.0 111.706 175.422 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 3.8 tt0 -52.45 -57.23 10.52 Favored 'General case' 0 N--CA 1.43 -1.432 0 N-CA-C 114.611 1.337 . . . . 1.0 114.611 175.115 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 21.9 tt0 -75.64 -33.36 60.47 Favored 'General case' 0 N--CA 1.429 -1.504 0 N-CA-C 114.719 1.377 . . . . 1.0 114.719 -174.488 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 2.0 tpm_? -64.81 -44.28 90.39 Favored 'General case' 0 N--CA 1.43 -1.426 0 O-C-N 119.668 -1.895 . . . . 1.0 112.433 174.133 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 4.6 mm? -74.13 -31.41 62.74 Favored 'General case' 0 N--CA 1.431 -1.424 0 N-CA-C 113.18 0.807 . . . . 1.0 113.18 178.435 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 20.1 t70 -54.55 -53.57 52.71 Favored 'General case' 0 N--CA 1.431 -1.423 0 O-C-N 120.432 -1.418 . . . . 1.0 113.171 167.909 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 6.0 t70 -96.52 29.64 2.86 Favored 'General case' 0 N--CA 1.43 -1.435 0 CA-C-O 122.175 0.988 . . . . 1.0 112.721 -174.27 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 24' ' ' TRP . . . . . . . . . . . . . 54.6 t-105 -80.27 -177.71 6.25 Favored 'General case' 0 N--CA 1.43 -1.449 0 O-C-N 120.037 -1.664 . . . . 1.0 111.379 177.083 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 40.1 t0 -81.16 65.82 6.44 Favored 'General case' 0 N--CA 1.429 -1.499 0 O-C-N 119.857 -1.777 . . . . 1.0 111.199 179.525 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -179.84 138.74 3.52 Favored Glycine 0 N--CA 1.429 -1.789 0 N-CA-C 107.056 -2.418 . . . . 1.0 107.056 -179.844 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 3.9 t70 -108.74 -43.68 4.2 Favored 'General case' 0 N--CA 1.43 -1.474 0 N-CA-C 108.446 -0.946 . . . . 1.0 108.446 -179.705 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 67.8 m -85.57 159.92 19.76 Favored 'General case' 0 N--CA 1.43 -1.472 0 C-N-CA 126.041 1.737 . . . . 1.0 109.953 171.876 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . 0.655 ' HA ' ' H ' ' A' ' 44' ' ' GLU 0.3 15.9 t70 61.26 20.53 11.12 Favored 'General case' 0 N--CA 1.429 -1.497 0 C-N-CA 128.156 2.582 . . . . 1.0 116.572 176.854 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 10.0 tp -147.21 111.36 0.8 Allowed 'Isoleucine or valine' 0 N--CA 1.43 -1.458 0 O-C-N 120.148 -1.595 . . . . 1.0 107.814 173.219 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 38.2 t0 -153.31 108.68 3.23 Favored 'General case' 0 N--CA 1.43 -1.462 0 O-C-N 120.544 -1.347 . . . . 1.0 108.421 -175.514 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 11.8 t -86.31 143.86 27.67 Favored 'General case' 0 N--CA 1.429 -1.477 0 O-C-N 118.055 -2.903 . . . . 1.0 113.099 -174.855 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 91.7 mt-10 -92.77 136.94 32.8 Favored 'General case' 0 N--CA 1.431 -1.417 0 C-N-CA 125.735 1.614 . . . . 1.0 108.481 167.164 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 4.3 mp -129.66 105.94 12.91 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.444 0 N-CA-C 106.421 -1.696 . . . . 1.0 106.421 177.451 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 35.1 m120 -128.48 77.63 1.79 Allowed 'General case' 0 N--CA 1.43 -1.475 0 CA-C-N 114.768 -1.105 . . . . 1.0 111.045 -178.647 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . 62.49 26.77 68.57 Favored Glycine 0 N--CA 1.429 -1.806 0 N-CA-C 118.587 2.195 . . . . 1.0 118.587 161.255 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 130.92 -32.8 2.94 Favored Glycine 0 N--CA 1.431 -1.685 0 N-CA-C 109.785 -1.326 . . . . 1.0 109.785 -173.82 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 44.9 t -88.41 128.17 40.86 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.434 0 O-C-N 121.639 -0.918 . . . . 1.0 109.212 175.562 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 80.2 mt -114.9 130.26 56.87 Favored 'General case' 0 N--CA 1.43 -1.445 0 N-CA-C 108.089 -1.078 . . . . 1.0 108.089 169.12 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -122.98 114.98 21.14 Favored 'General case' 0 N--CA 1.43 -1.426 0 N-CA-C 106.188 -1.782 . . . . 1.0 106.188 174.926 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 58.7 mt -88.05 112.13 23.21 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.482 0 N-CA-C 105.25 -2.13 . . . . 1.0 105.25 -178.788 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 33.3 m -108.7 143.04 38.32 Favored 'General case' 0 N--CA 1.43 -1.446 0 CA-C-O 122.237 1.017 . . . . 1.0 109.916 -166.024 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 43' ' ' PHE . . . . . . . . . . . . . 53.0 m-85 -115.31 155.96 26.34 Favored 'General case' 0 N--CA 1.43 -1.433 0 C-N-CA 124.874 1.27 . . . . 1.0 108.127 -172.806 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . 0.655 ' H ' ' HA ' ' A' ' 29' ' ' ASP . 5.3 mm-40 -66.12 -23.16 66.44 Favored 'General case' 0 N--CA 1.429 -1.501 0 O-C-N 119.291 -2.131 . . . . 1.0 115.299 164.268 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 49.4 m-80 -65.92 -7.26 15.66 Favored 'General case' 0 N--CA 1.429 -1.48 0 C-N-CA 124.989 1.316 . . . . 1.0 114.128 164.963 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 94.99 -8.49 70.25 Favored Glycine 0 N--CA 1.431 -1.694 0 O-C-N 119.962 -1.711 . . . . 1.0 113.925 169.219 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 1.5 m -80.71 -170.33 2.59 Favored 'General case' 0 N--CA 1.43 -1.45 0 C-N-CA 126.626 1.971 . . . . 1.0 113.001 -171.635 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 44.7 pttt -168.6 126.49 1.07 Allowed 'General case' 0 N--CA 1.43 -1.439 0 O-C-N 119.922 -1.736 . . . . 1.0 114.497 -162.819 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 5.9 mm -100.23 107.41 20.92 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.45 0 N-CA-C 106.737 -1.579 . . . . 1.0 106.737 166.298 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 4.5 tp -106.18 117.6 52.24 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.506 0 O-C-N 120.036 -1.665 . . . . 1.0 110.886 -173.942 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 3.7 mt -128.55 131.65 68.58 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.408 0 C-N-CA 125.864 1.666 . . . . 1.0 109.943 -171.444 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 16.8 t30 -161.26 175.03 12.74 Favored 'General case' 0 N--CA 1.432 -1.374 0 N-CA-C 104.628 -2.36 . . . . 1.0 104.628 -172.267 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 60.7 ttp85 -151.22 138.4 19.27 Favored 'General case' 0 N--CA 1.43 -1.46 0 O-C-N 120.033 -1.667 . . . . 1.0 108.238 -162.27 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 1.6 tt0 -149.03 -45.35 0.14 Allowed 'General case' 0 CA--C 1.489 -1.394 0 O-C-N 121.154 -0.966 . . . . 1.0 109.339 -168.647 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 55.5 mt-10 -76.05 147.77 80.64 Favored Pre-proline 0 N--CA 1.43 -1.468 0 N-CA-C 114.277 1.214 . . . . 1.0 114.277 -164.553 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 47.8 Cg_endo -77.6 -174.61 2.29 Favored 'Trans proline' 0 C--N 1.299 -2.06 0 C-N-CA 122.811 2.341 . . . . 1.0 111.478 166.221 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . 0.505 ' O ' ' CD2' ' A' ' 58' ' ' HIS . 22.8 mt 79.34 -48.66 0.4 Allowed 'General case' 0 N--CA 1.431 -1.402 0 C-N-CA 128.89 2.876 . . . . 1.0 112.122 178.305 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 58' ' ' HIS . . . . . 0.505 ' CD2' ' O ' ' A' ' 57' ' ' LEU . 20.8 m170 143.82 88.33 0.0 OUTLIER 'General case' 0 N--CA 1.43 -1.452 1 C-N-CA 132.382 4.273 . . . . 1.0 108.014 172.382 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 8.1 tt0 -154.25 145.27 22.7 Favored 'General case' 0 N--CA 1.43 -1.458 0 CA-C-N 123.06 2.664 . . . . 1.0 111.922 168.302 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 2.2 t -127.93 160.16 37.97 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.466 0 C-N-CA 127.478 2.311 . . . . 1.0 111.723 -175.395 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 61' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -109.48 152.44 25.41 Favored 'General case' 0 N--CA 1.431 -1.424 0 C-N-CA 124.564 1.146 . . . . 1.0 110.987 177.222 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 2.3 pt? -154.24 124.08 6.73 Favored 'General case' 0 N--CA 1.43 -1.45 0 CA-C-O 122.655 1.216 . . . . 1.0 109.935 168.781 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -124.24 130.48 52.59 Favored 'General case' 0 N--CA 1.429 -1.487 0 N-CA-C 115.042 1.497 . . . . 1.0 115.042 -178.813 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 64' ' ' THR . . . . . . . . . . . . . 8.6 m -123.97 -102.44 0.38 Allowed 'General case' 0 N--CA 1.432 -1.352 0 C-N-CA 124.467 1.107 . . . . 1.0 110.983 177.553 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 9.1 tmtm? -125.92 -40.63 2.01 Favored 'General case' 0 N--CA 1.429 -1.483 0 O-C-N 120.369 -1.457 . . . . 1.0 111.814 -163.648 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 5.2 tm0? -79.42 -23.96 42.84 Favored 'General case' 0 N--CA 1.428 -1.537 0 O-C-N 120.662 -1.274 . . . . 1.0 112.576 -172.872 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . -176.18 -62.58 0.06 OUTLIER Glycine 0 N--CA 1.43 -1.761 0 O-C-N 120.36 -1.462 . . . . 1.0 112.501 171.229 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 107.61 109.59 3.37 Favored Glycine 0 N--CA 1.43 -1.703 0 C-N-CA 124.894 1.235 . . . . 1.0 110.732 -171.322 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 23.1 m-85 -121.64 170.83 9.33 Favored 'General case' 0 N--CA 1.431 -1.404 0 C-N-CA 125.027 1.331 . . . . 1.0 108.665 -169.096 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 70' ' ' HIS . . . . . 0.402 ' HE1' ' OD2' ' A' ' 81' ' ' ASP . 5.6 p80 -115.85 161.08 19.29 Favored 'General case' 0 N--CA 1.43 -1.463 0 O-C-N 120.278 -1.514 . . . . 1.0 110.025 171.606 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 71' ' ' PHE . . . . . . . . . . . . 0.273 65.6 t80 -135.27 120.77 19.27 Favored 'General case' 0 N--CA 1.43 -1.431 0 C-N-CA 124.721 1.208 . . . . 1.0 109.829 -144.418 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 51.4 t0 -139.54 165.82 26.23 Favored 'General case' 0 N--CA 1.43 -1.436 0 CA-C-O 121.884 0.85 . . . . 1.0 110.424 -176.96 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 55.9 tp -103.03 121.59 42.88 Favored 'General case' 0 N--CA 1.43 -1.435 0 O-C-N 120.268 -1.52 . . . . 1.0 113.209 -167.48 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 29.6 mmtm -112.65 84.98 2.07 Favored 'General case' 0 N--CA 1.43 -1.439 0 O-C-N 120.9 -1.125 . . . . 1.0 109.305 170.926 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . 73.38 -95.52 0.77 Allowed Glycine 0 N--CA 1.43 -1.736 0 O-C-N 120.573 -1.33 . . . . 1.0 114.823 174.365 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 55.9 m-20 -104.31 -3.83 23.71 Favored 'General case' 0 N--CA 1.43 -1.425 0 C-N-CA 125.645 1.578 . . . . 1.0 112.975 -176.639 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 33.3 tt0 -150.24 132.39 15.37 Favored 'General case' 0 N--CA 1.429 -1.501 0 N-CA-C 106.317 -1.734 . . . . 1.0 106.317 -169.59 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 78' ' ' TRP . . . . . . . . . . . . . 33.7 m95 -79.93 127.29 32.08 Favored 'General case' 0 N--CA 1.43 -1.441 0 O-C-N 120.666 -1.271 . . . . 1.0 108.878 177.224 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 9.5 mt -103.14 135.86 38.56 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.513 0 C-N-CA 125.766 1.626 . . . . 1.0 107.016 177.565 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -81.39 134.63 35.58 Favored 'General case' 0 N--CA 1.43 -1.456 0 O-C-N 121.009 -1.057 . . . . 1.0 109.168 178.36 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 81' ' ' ASP . . . . . 0.402 ' OD2' ' HE1' ' A' ' 70' ' ' HIS . 25.7 t70 -77.6 -20.74 53.47 Favored 'General case' 0 N--CA 1.431 -1.411 0 N-CA-C 115.359 1.615 . . . . 1.0 115.359 -162.684 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 4.3 mmp_? -82.71 -90.03 0.08 Allowed 'General case' 0 N--CA 1.43 -1.432 0 O-C-N 120.349 -1.469 . . . . 1.0 113.462 -174.868 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 31.7 p -72.06 -29.64 64.35 Favored 'General case' 0 N--CA 1.431 -1.39 0 O-C-N 120.069 -1.644 . . . . 1.0 114.16 -176.854 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 106.24 83.37 1.62 Allowed Glycine 0 N--CA 1.43 -1.747 0 N-CA-C 109.716 -1.354 . . . . 1.0 109.716 -171.851 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 5.0 mm-40 -140.66 -172.27 3.41 Favored 'General case' 0 N--CA 1.431 -1.422 0 N-CA-C 105.693 -1.966 . . . . 1.0 105.693 -170.854 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 30.1 m -145.84 131.99 19.4 Favored 'General case' 0 N--CA 1.43 -1.444 0 O-C-N 120.578 -1.326 . . . . 1.0 111.435 -155.077 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 1.1 t80 -21.83 -97.08 0.0 OUTLIER 'General case' 0 N--CA 1.43 -1.433 0 N-CA-C 120.418 3.488 . . . . 1.0 120.418 175.523 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 88' ' ' TRP . . . . . . . . . . . . . 29.9 m95 -71.69 -26.83 62.67 Favored 'General case' 0 N--CA 1.431 -1.419 0 O-C-N 120.247 -1.533 . . . . 1.0 110.889 -167.445 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 16.2 m-20 -79.25 -42.21 26.41 Favored 'General case' 0 N--CA 1.43 -1.456 0 C-N-CA 126.432 1.893 . . . . 1.0 112.747 -176.879 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -70.3 -39.94 74.55 Favored 'General case' 0 N--CA 1.43 -1.452 0 O-C-N 119.716 -1.865 . . . . 1.0 111.54 176.007 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 41.0 tp -53.74 -47.28 70.78 Favored 'General case' 0 N--CA 1.429 -1.484 0 C-N-CA 126.252 1.821 . . . . 1.0 113.589 170.345 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 30.2 tt0 -56.73 -56.19 24.68 Favored 'General case' 0 N--CA 1.43 -1.448 0 C-N-CA 125.08 1.352 . . . . 1.0 113.917 169.832 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 38.6 mt-30 -55.34 -42.91 74.48 Favored 'General case' 0 N--CA 1.43 -1.442 0 C-N-CA 125.168 1.387 . . . . 1.0 113.678 179.248 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -59.21 -55.34 36.2 Favored 'General case' 0 N--CA 1.428 -1.526 0 C-N-CA 127.055 2.142 . . . . 1.0 114.395 173.538 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -65.68 -40.64 92.58 Favored 'General case' 0 N--CA 1.429 -1.498 0 O-C-N 120.222 -1.549 . . . . 1.0 113.314 -179.377 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 31.8 m -56.23 -45.81 79.81 Favored 'General case' 0 N--CA 1.43 -1.426 0 C-N-CA 125.215 1.406 . . . . 1.0 114.335 168.257 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 9.0 pt20 -71.8 -22.27 61.59 Favored 'General case' 0 N--CA 1.431 -1.397 0 O-C-N 120.589 -1.319 . . . . 1.0 114.129 -178.465 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 2.4 mm-40 -72.79 -57.64 3.94 Favored 'General case' 0 N--CA 1.431 -1.381 0 O-C-N 121.441 -0.787 . . . . 1.0 112.83 166.549 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -77.09 -41.95 40.13 Favored 'General case' 0 N--CA 1.43 -1.461 0 N-CA-C 117.089 2.255 . . . . 1.0 117.089 -170.563 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . 83.99 43.27 7.22 Favored Glycine 0 N--CA 1.43 -1.704 0 O-C-N 120.86 -1.15 . . . . 1.0 111.907 -165.868 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 4.9 tp10 -161.28 154.53 21.36 Favored 'General case' 0 N--CA 1.431 -1.419 0 N-CA-C 107.409 -1.33 . . . . 1.0 107.409 -169.69 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 93.2 m -78.47 93.68 4.8 Favored 'General case' 0 N--CA 1.43 -1.449 0 O-C-N 118.953 -2.342 . . . . 1.0 110.594 168.821 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 47.9 t -105.48 90.29 1.53 Allowed 'Isoleucine or valine' 0 N--CA 1.43 -1.437 0 C-N-CA 125.844 1.658 . . . . 1.0 106.931 -179.398 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 59.5 p -143.07 178.23 7.83 Favored 'General case' 0 N--CA 1.43 -1.444 0 O-C-N 120.709 -1.245 . . . . 1.0 113.754 -172.678 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -108.93 -40.41 5.03 Favored 'General case' 0 N--CA 1.43 -1.452 0 O-C-N 120.633 -1.292 . . . . 1.0 110.646 177.577 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 24.9 ttp180 . . . . . 0 C--O 1.259 1.581 0 O-C-N 120.766 -1.209 . . . . 1.0 111.824 -165.549 . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 2.3 mpt? . . . . . 0 CA--C 1.49 -1.333 0 N-CA-C 111.51 0.189 . . . . 1.0 111.51 . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 4.3 p30 -152.33 153.36 33.51 Favored 'General case' 0 N--CA 1.43 -1.435 0 O-C-N 120.74 -1.225 . . . . 1.0 110.145 -179.817 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 1.1 p-10 -66.58 -30.49 70.8 Favored 'General case' 0 N--CA 1.43 -1.447 0 N-CA-C 114.978 1.473 . . . . 1.0 114.978 -176.67 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 8.5 t -63.52 -54.3 38.45 Favored 'General case' 0 N--CA 1.43 -1.47 0 O-C-N 120.492 -1.38 . . . . 1.0 113.368 174.019 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 53.9 mt-10 -63.38 -42.2 98.81 Favored 'General case' 0 N--CA 1.431 -1.385 0 O-C-N 120.615 -1.303 . . . . 1.0 113.624 176.625 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 6' ' ' PHE . . . . . 0.405 ' CD1' ' HA ' ' A' ' 58' ' ' HIS . 11.6 t80 -44.89 -55.37 5.5 Favored 'General case' 0 N--CA 1.429 -1.479 0 C-N-CA 125.666 1.586 . . . . 1.0 114.5 167.309 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 0.7 OUTLIER -70.08 -30.41 67.63 Favored 'General case' 0 N--CA 1.431 -1.402 0 N-CA-C 114.514 1.302 . . . . 1.0 114.514 -179.61 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 31.1 ttt85 -68.88 -48.78 62.55 Favored 'General case' 0 N--CA 1.43 -1.45 0 C-N-CA 125.816 1.646 . . . . 1.0 113.182 179.152 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 92.1 mt -64.7 -36.77 85.36 Favored 'General case' 0 N--CA 1.429 -1.516 0 C-N-CA 126.193 1.797 . . . . 1.0 112.366 173.589 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -57.78 -47.44 82.53 Favored 'General case' 0 N--CA 1.43 -1.464 0 C-N-CA 124.293 1.037 . . . . 1.0 113.107 171.914 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -56.57 -43.95 80.52 Favored 'General case' 0 N--CA 1.429 -1.522 0 C-N-CA 126.703 2.001 . . . . 1.0 113.4 175.131 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 19.1 mm-40 -54.99 -63.25 1.21 Allowed 'General case' 0 N--CA 1.431 -1.401 0 C-N-CA 124.879 1.272 . . . . 1.0 113.524 172.855 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 3.7 pp -69.86 -39.85 76.12 Favored 'General case' 0 N--CA 1.43 -1.435 0 O-C-N 120.23 -1.543 . . . . 1.0 114.969 -173.621 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 9.3 m0 -55.02 -48.66 73.07 Favored 'General case' 0 N--CA 1.43 -1.428 0 N-CA-C 114.179 1.178 . . . . 1.0 114.179 172.032 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 41.1 tp -63.71 -39.41 94.24 Favored 'General case' 0 N--CA 1.43 -1.442 0 N-CA-C 113.05 0.759 . . . . 1.0 113.05 175.876 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 25.6 m -52.36 -50.81 61.61 Favored 'General case' 0 N--CA 1.429 -1.497 0 C-N-CA 125.377 1.471 . . . . 1.0 114.709 172.921 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 20.6 mt -66.71 -48.61 79.57 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.483 0 O-C-N 120.174 -1.579 . . . . 1.0 112.206 178.078 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 41.1 tt0 -53.85 -54.56 36.82 Favored 'General case' 0 N--CA 1.43 -1.461 0 C-N-CA 124.638 1.175 . . . . 1.0 112.294 178.114 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 33.9 tt0 -58.32 -49.71 76.23 Favored 'General case' 0 N--CA 1.431 -1.403 0 C-N-CA 126.45 1.9 . . . . 1.0 114.241 178.414 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 8.7 tpm_? -60.49 -44.76 95.61 Favored 'General case' 0 N--CA 1.43 -1.469 0 CA-C-N 119.817 1.19 . . . . 1.0 112.913 -178.964 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 98.1 mt -72.29 -41.14 66.97 Favored 'General case' 0 N--CA 1.43 -1.443 0 N-CA-C 114.594 1.331 . . . . 1.0 114.594 175.769 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 38.0 t70 -59.48 -36.75 76.63 Favored 'General case' 0 N--CA 1.429 -1.483 0 O-C-N 119.365 -2.084 . . . . 1.0 113.566 174.967 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 24.6 t0 -105.17 33.83 3.49 Favored 'General case' 0 N--CA 1.43 -1.475 0 O-C-N 120.181 -1.575 . . . . 1.0 111.261 174.225 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 24' ' ' TRP . . . . . . . . . . . . . 22.6 t-105 -83.41 -61.76 1.76 Allowed 'General case' 0 N--CA 1.429 -1.494 0 O-C-N 119.872 -1.768 . . . . 1.0 109.896 168.515 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 28.1 t70 70.07 -111.66 0.08 Allowed 'General case' 0 N--CA 1.43 -1.438 0 C-N-CA 125.051 1.34 . . . . 1.0 111.501 174.344 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 76.35 -115.7 4.51 Favored Glycine 0 N--CA 1.43 -1.761 0 O-C-N 120.025 -1.672 . . . . 1.0 114.147 172.921 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -101.89 -19.45 15.27 Favored 'General case' 0 N--CA 1.431 -1.419 0 C-N-CA 124.962 1.305 . . . . 1.0 109.788 172.159 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 54.0 p -80.71 173.63 12.41 Favored 'General case' 0 N--CA 1.429 -1.476 0 N-CA-C 115.949 1.833 . . . . 1.0 115.949 -170.262 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 4.7 t70 -130.53 150.77 51.59 Favored 'General case' 0 N--CA 1.431 -1.416 0 N-CA-C 106.31 -1.737 . . . . 1.0 106.31 161.952 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER -155.16 114.27 0.32 Allowed 'Isoleucine or valine' 0 N--CA 1.431 -1.404 0 C-N-CA 125.047 1.339 . . . . 1.0 108.45 -159.923 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 21.1 m-20 -120.35 107.2 12.65 Favored 'General case' 0 N--CA 1.43 -1.441 0 C-N-CA 125.39 1.476 . . . . 1.0 110.645 174.12 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 27.6 t -86.34 136.22 33.22 Favored 'General case' 0 N--CA 1.431 -1.382 0 O-C-N 119.762 -1.836 . . . . 1.0 109.85 165.904 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 79.1 mt-10 -112.22 135.53 52.78 Favored 'General case' 0 N--CA 1.429 -1.478 0 O-C-N 120.904 -1.122 . . . . 1.0 109.342 179.292 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 3.2 tp -111.03 105.48 18.89 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.419 0 CA-C-O 125.1 2.381 . . . . 1.0 107.766 176.297 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 76.6 m-20 -115.63 74.68 0.9 Allowed 'General case' 0 N--CA 1.431 -1.408 0 CA-C-N 113.102 -1.863 . . . . 1.0 109.11 -179.382 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . 76.34 -92.16 0.96 Allowed Glycine 0 N--CA 1.43 -1.733 0 O-C-N 120.663 -1.273 . . . . 1.0 114.588 174.42 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -120.75 20.51 8.7 Favored Glycine 0 N--CA 1.431 -1.695 0 C-N-CA 124.308 0.956 . . . . 1.0 111.054 174.156 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 40.8 t -121.43 123.96 70.8 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.459 0 N-CA-C 107.543 -1.28 . . . . 1.0 107.543 178.257 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 12.6 mt -111.93 130.1 55.96 Favored 'General case' 0 N--CA 1.43 -1.448 0 CA-C-O 122.865 1.317 . . . . 1.0 107.973 167.308 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 17.9 p -126.33 125.8 42.86 Favored 'General case' 0 N--CA 1.431 -1.425 0 N-CA-C 107.387 -1.338 . . . . 1.0 107.387 177.868 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 22.8 mt -106.11 122.77 60.21 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.416 0 N-CA-C 108.846 -0.798 . . . . 1.0 108.846 -177.166 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 39.6 p -116.69 128.21 55.13 Favored 'General case' 0 N--CA 1.43 -1.449 0 CA-C-O 121.177 0.513 . . . . 1.0 112.055 -173.229 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 43' ' ' PHE . . . . . . . . . . . . . 26.1 p90 -119.66 171.85 8.09 Favored 'General case' 0 N--CA 1.431 -1.415 0 C-N-CA 124.447 1.099 . . . . 1.0 111.333 175.504 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 37.3 mm-40 -51.21 -30.88 18.57 Favored 'General case' 0 N--CA 1.43 -1.431 0 N-CA-C 118.88 2.918 . . . . 1.0 118.88 -173.154 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 6.6 m120 -66.95 -17.88 65.12 Favored 'General case' 0 N--CA 1.431 -1.424 0 O-C-N 119.761 -1.837 . . . . 1.0 114.0 179.007 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 86.95 -0.26 86.14 Favored Glycine 0 N--CA 1.429 -1.776 0 O-C-N 120.505 -1.372 . . . . 1.0 113.463 179.449 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 48.2 m -88.48 158.08 18.45 Favored 'General case' 0 N--CA 1.429 -1.502 0 C-N-CA 125.428 1.491 . . . . 1.0 107.66 167.702 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 6.8 ptpt -154.76 159.58 40.74 Favored 'General case' 0 N--CA 1.43 -1.431 0 O-C-N 120.933 -1.104 . . . . 1.0 112.878 -167.294 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 8.9 mm -100.37 137.64 27.23 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.477 0 N-CA-C 106.587 -1.635 . . . . 1.0 106.587 177.107 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 50' ' ' ILE . . . . . 0.434 ' HB ' ' HB1' ' A' ' 63' ' ' ALA . 4.7 mm -126.21 116.7 46.44 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.472 0 C-N-CA 124.518 1.127 . . . . 1.0 109.692 -178.516 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 3.3 mt -128.47 128.11 67.78 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.428 0 CA-C-O 122.424 1.107 . . . . 1.0 112.378 -179.629 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 52' ' ' ASN . . . . . 0.481 ' H ' ' HD1' ' A' ' 61' ' ' TRP . 20.4 t-20 -151.35 162.47 40.87 Favored 'General case' 0 N--CA 1.43 -1.471 0 C-N-CA 126.452 1.901 . . . . 1.0 105.995 174.379 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -129.09 145.87 51.18 Favored 'General case' 0 N--CA 1.43 -1.432 0 C-N-CA 125.829 1.651 . . . . 1.0 109.897 -174.498 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 2.2 tt0 -151.25 -38.9 0.12 Allowed 'General case' 0 N--CA 1.431 -1.419 0 O-C-N 120.878 -1.139 . . . . 1.0 111.323 -168.993 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 28.8 mm-40 -70.99 156.55 91.9 Favored Pre-proline 0 N--CA 1.43 -1.47 0 N-CA-C 114.417 1.265 . . . . 1.0 114.417 -168.83 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 39.1 Cg_endo -75.88 -25.86 10.13 Favored 'Trans proline' 0 C--N 1.3 -1.987 0 C-N-CA 121.916 1.744 . . . . 1.0 114.126 -165.626 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 49.4 mt -93.51 -112.87 0.1 Allowed 'General case' 0 N--CA 1.429 -1.496 0 CA-C-O 122.726 1.251 . . . . 1.0 111.018 -173.804 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 58' ' ' HIS . . . . . 0.405 ' HA ' ' CD1' ' A' ' 6' ' ' PHE . 39.3 m170 -125.85 70.1 1.2 Allowed 'General case' 0 N--CA 1.431 -1.394 0 C-N-CA 124.619 1.168 . . . . 1.0 109.171 174.827 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 9.6 mt-30 -141.06 125.44 17.59 Favored 'General case' 0 N--CA 1.431 -1.42 0 O-C-N 120.362 -1.461 . . . . 1.0 109.93 -175.683 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 88.6 t -124.32 156.41 32.0 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.509 0 O-C-N 120.942 -1.099 . . . . 1.0 108.825 -174.77 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 61' ' ' TRP . . . . . 0.481 ' HD1' ' H ' ' A' ' 52' ' ' ASN . 0.0 OUTLIER -92.6 152.22 19.7 Favored 'General case' 0 N--CA 1.43 -1.426 0 O-C-N 120.142 -1.599 . . . . 1.0 110.553 -178.201 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 2.2 tm? -137.27 98.26 3.68 Favored 'General case' 0 N--CA 1.429 -1.5 0 O-C-N 120.41 -1.432 . . . . 1.0 110.465 176.107 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . 0.434 ' HB1' ' HB ' ' A' ' 50' ' ' ILE . . . -103.95 139.61 38.86 Favored 'General case' 0 N--CA 1.431 -1.422 0 CA-C-O 123.314 1.531 . . . . 1.0 111.812 172.378 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 64' ' ' THR . . . . . 0.446 HG21 ' H ' ' A' ' 65' ' ' LYS . 0.0 OUTLIER -153.98 -80.16 0.09 Allowed 'General case' 0 N--CA 1.43 -1.436 0 C-N-CA 126.301 1.84 . . . . 1.0 107.066 -174.304 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . 0.446 ' H ' HG21 ' A' ' 64' ' ' THR . 3.6 tmtt? -116.65 -53.74 2.49 Favored 'General case' 0 N--CA 1.429 -1.494 0 C-N-CA 125.182 1.393 . . . . 1.0 113.376 176.831 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 50.7 mt-30 -72.43 -24.35 61.21 Favored 'General case' 0 N--CA 1.429 -1.499 0 N-CA-C 117.99 2.589 . . . . 1.0 117.99 -160.803 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 151.49 -9.93 0.7 Allowed Glycine 0 N--CA 1.43 -1.711 0 N-CA-C 116.714 1.446 . . . . 1.0 116.714 174.593 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 98.85 77.01 1.29 Allowed Glycine 0 N--CA 1.43 -1.731 0 CA-C-N 118.902 1.351 . . . . 1.0 110.77 -176.066 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 14.5 m-30 -102.22 122.14 43.61 Favored 'General case' 0 N--CA 1.43 -1.468 0 C-N-CA 124.345 1.058 . . . . 1.0 108.547 -175.589 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -86.5 157.25 19.82 Favored 'General case' 0 N--CA 1.431 -1.411 0 O-C-N 119.974 -1.704 . . . . 1.0 114.288 -179.271 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 49.6 p90 -129.37 138.45 51.53 Favored 'General case' 0 N--CA 1.429 -1.499 0 N-CA-C 113.296 0.85 . . . . 1.0 113.296 -165.558 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 23.5 t0 -126.99 159.54 33.77 Favored 'General case' 0 N--CA 1.43 -1.443 0 C-N-CA 126.34 1.856 . . . . 1.0 110.183 -176.779 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 7.0 tt -91.78 122.44 34.33 Favored 'General case' 0 N--CA 1.429 -1.495 0 O-C-N 120.471 -1.393 . . . . 1.0 112.664 -170.764 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 28.9 tptp -83.56 -56.59 3.65 Favored 'General case' 0 N--CA 1.43 -1.47 0 O-C-N 120.441 -1.412 . . . . 1.0 110.782 167.826 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -170.84 -79.65 0.05 OUTLIER Glycine 0 CA--C 1.487 -1.663 0 O-C-N 120.91 -1.119 . . . . 1.0 111.411 -179.805 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 7.6 m-20 -93.79 5.59 51.15 Favored 'General case' 0 N--CA 1.43 -1.451 0 C-N-CA 124.936 1.294 . . . . 1.0 111.139 178.93 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 7.7 pt-20 -165.59 145.33 6.57 Favored 'General case' 0 N--CA 1.431 -1.414 0 N-CA-C 104.383 -2.451 . . . . 1.0 104.383 -153.716 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 78' ' ' TRP . . . . . . . . . . . . . 27.4 m95 -111.79 139.1 47.54 Favored 'General case' 0 N--CA 1.431 -1.39 0 N-CA-C 107.633 -1.247 . . . . 1.0 107.633 178.254 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 40.4 mt -96.32 135.73 29.48 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.483 0 C-N-CA 127.247 2.219 . . . . 1.0 107.977 -179.379 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 75.8 m -82.5 122.19 27.73 Favored 'General case' 0 N--CA 1.431 -1.41 0 N-CA-C 108.154 -1.054 . . . . 1.0 108.154 171.684 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 16.3 t70 -66.68 -47.87 71.1 Favored 'General case' 0 N--CA 1.429 -1.485 0 N-CA-C 114.224 1.194 . . . . 1.0 114.224 -167.227 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 17.1 mmt180 -72.25 129.24 37.97 Favored 'General case' 0 N--CA 1.43 -1.455 0 O-C-N 120.899 -1.126 . . . . 1.0 109.55 177.804 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 83' ' ' SER . . . . . . . . . . . . 0.27 5.6 t 76.45 -47.64 0.55 Allowed 'General case' 0 N--CA 1.428 -1.532 0 C-N-CA 126.869 2.068 . . . . 1.0 114.124 -168.473 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 99.33 70.91 0.97 Allowed Glycine 0 N--CA 1.429 -1.773 0 O-C-N 120.69 -1.256 . . . . 1.0 111.024 176.68 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 5.5 mm-40 -128.97 -131.89 0.22 Allowed 'General case' 0 N--CA 1.431 -1.418 0 C-N-CA 124.156 0.983 . . . . 1.0 110.752 -166.35 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 93.9 m -153.76 133.61 13.1 Favored 'General case' 0 N--CA 1.431 -1.383 0 O-C-N 120.551 -1.343 . . . . 1.0 109.46 -157.34 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . 0.309 0.0 OUTLIER -49.3 -83.11 0.01 OUTLIER 'General case' 0 N--CA 1.43 -1.446 0 N-CA-C 119.939 3.311 . . . . 1.0 119.939 -175.911 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 88' ' ' TRP . . . . . . . . . . . . . 7.9 m95 -65.83 -34.37 78.01 Favored 'General case' 0 N--CA 1.43 -1.443 0 O-C-N 119.84 -1.788 . . . . 1.0 113.367 -175.106 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -61.64 -41.97 98.25 Favored 'General case' 0 N--CA 1.431 -1.408 0 N-CA-C 114.409 1.263 . . . . 1.0 114.409 176.148 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 17.9 tp -67.82 -48.93 64.86 Favored 'General case' 0 N--CA 1.43 -1.454 0 O-C-N 120.647 -1.283 . . . . 1.0 111.054 175.808 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 58.0 tp -51.96 -46.33 64.76 Favored 'General case' 0 N--CA 1.429 -1.492 0 C-N-CA 126.268 1.827 . . . . 1.0 113.752 174.017 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 18.6 tt0 -53.32 -54.39 37.17 Favored 'General case' 0 N--CA 1.429 -1.501 0 C-N-CA 125.983 1.713 . . . . 1.0 111.873 171.639 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -59.23 -53.25 60.4 Favored 'General case' 0 N--CA 1.43 -1.429 0 N-CA-C 113.418 0.896 . . . . 1.0 113.418 -178.188 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -59.7 -43.92 93.88 Favored 'General case' 0 N--CA 1.43 -1.436 0 C-N-CA 125.841 1.656 . . . . 1.0 115.381 178.455 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -71.31 -40.31 70.87 Favored 'General case' 0 N--CA 1.429 -1.517 0 O-C-N 120.497 -1.377 . . . . 1.0 112.988 178.53 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 95.1 m -63.65 -37.02 85.76 Favored 'General case' 0 N--CA 1.43 -1.44 0 C-N-CA 126.415 1.886 . . . . 1.0 112.06 174.304 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -57.35 -54.54 45.67 Favored 'General case' 0 CA--C 1.489 -1.395 0 C-N-CA 127.108 2.163 . . . . 1.0 112.205 173.382 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 2.3 pt20 -73.57 -33.73 64.79 Favored 'General case' 0 N--CA 1.43 -1.454 0 N-CA-C 115.217 1.562 . . . . 1.0 115.217 179.165 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -75.36 -41.24 56.94 Favored 'General case' 0 N--CA 1.43 -1.47 0 O-C-N 120.111 -1.618 . . . . 1.0 115.206 177.863 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . 85.87 24.41 41.84 Favored Glycine 0 N--CA 1.429 -1.791 0 C-N-CA 124.692 1.139 . . . . 1.0 112.763 -175.198 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 9.3 pt-20 -175.44 159.19 2.39 Favored 'General case' 0 N--CA 1.43 -1.462 0 C-N-CA 126.495 1.918 . . . . 1.0 106.117 -176.24 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 44.0 m -69.79 130.77 43.22 Favored 'General case' 0 N--CA 1.43 -1.456 0 O-C-N 120.792 -1.193 . . . . 1.0 113.271 -169.041 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 69.3 t -102.1 120.96 52.52 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.416 0 N-CA-C 107.771 -1.196 . . . . 1.0 107.771 173.768 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 19.7 m -107.03 141.94 37.46 Favored 'General case' 0 N--CA 1.429 -1.493 0 N-CA-C 115.103 1.52 . . . . 1.0 115.103 -160.285 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 2.6 p90 -127.28 -43.36 1.63 Allowed 'General case' 0 N--CA 1.43 -1.467 0 C-N-CA 125.509 1.524 . . . . 1.0 110.783 179.191 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 30.2 mtt-85 . . . . . 0 C--O 1.261 1.671 0 C-N-CA 124.465 1.106 . . . . 1.0 111.05 -179.907 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 7.1 p30 . . . . . 0 N--CA 1.43 -1.458 0 N-CA-C 113.842 1.053 . . . . 1.0 113.842 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 35.3 t70 -55.92 -40.08 72.59 Favored 'General case' 0 N--CA 1.429 -1.479 0 C-N-CA 127.125 2.17 . . . . 1.0 113.46 -178.543 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 5.2 p -68.49 -37.94 80.55 Favored 'General case' 0 N--CA 1.43 -1.467 0 C-N-CA 126.274 1.83 . . . . 1.0 114.359 174.972 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 5' ' ' GLU . . . . . 0.452 ' HG2' ' HE1' ' A' ' 58' ' ' HIS . 14.2 tp10 -67.74 -53.06 30.44 Favored 'General case' 0 N--CA 1.43 -1.435 0 C-N-CA 125.226 1.41 . . . . 1.0 110.115 177.925 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 16.3 t80 -47.25 -50.94 20.17 Favored 'General case' 0 N--CA 1.431 -1.425 0 C-N-CA 127.425 2.29 . . . . 1.0 114.821 169.657 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 35.2 m-70 -63.97 -41.43 97.56 Favored 'General case' 0 N--CA 1.43 -1.452 0 N-CA-C 114.907 1.447 . . . . 1.0 114.907 177.989 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -70.76 -37.19 73.38 Favored 'General case' 0 N--CA 1.43 -1.435 0 O-C-N 120.366 -1.459 . . . . 1.0 114.074 178.887 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 79.7 mt -59.58 -51.55 69.37 Favored 'General case' 0 N--CA 1.43 -1.444 0 C-N-CA 124.99 1.316 . . . . 1.0 111.747 168.239 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -54.06 -50.34 66.95 Favored 'General case' 0 N--CA 1.431 -1.416 0 C-N-CA 125.011 1.324 . . . . 1.0 113.458 176.991 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -51.58 -49.71 61.57 Favored 'General case' 0 N--CA 1.43 -1.425 0 N-CA-C 114.783 1.401 . . . . 1.0 114.783 173.136 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 12.2 pt20 -68.9 -33.27 73.49 Favored 'General case' 0 N--CA 1.43 -1.433 0 N-CA-C 115.583 1.697 . . . . 1.0 115.583 179.764 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 84.8 mt -66.74 -59.07 3.89 Favored 'General case' 0 N--CA 1.431 -1.419 0 O-C-N 120.087 -1.633 . . . . 1.0 111.02 174.753 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 1.2 m-90 -50.3 -50.11 51.58 Favored 'General case' 0 N--CA 1.429 -1.487 0 C-N-CA 125.65 1.58 . . . . 1.0 113.27 -179.565 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 41.0 tp -61.85 -59.05 5.71 Favored 'General case' 0 N--CA 1.43 -1.447 0 N-CA-C 113.626 0.973 . . . . 1.0 113.626 175.775 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 59.6 m -64.88 -37.42 87.58 Favored 'General case' 0 N--CA 1.431 -1.4 0 N-CA-C 114.252 1.204 . . . . 1.0 114.252 -173.621 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 93.5 mt -64.63 -54.24 32.7 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.458 0 C-N-CA 124.923 1.289 . . . . 1.0 111.686 174.83 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 1.7 tt0 -55.48 -49.66 71.94 Favored 'General case' 0 N--CA 1.43 -1.473 0 C-N-CA 123.984 0.914 . . . . 1.0 113.386 178.565 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 44.4 tt0 -54.65 -49.1 71.38 Favored 'General case' 0 N--CA 1.429 -1.493 0 C-N-CA 125.966 1.706 . . . . 1.0 114.025 174.173 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 7.4 tpm_? -58.95 -45.92 89.29 Favored 'General case' 0 N--CA 1.431 -1.406 0 O-C-N 120.726 -1.234 . . . . 1.0 114.291 179.818 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 3.8 pp -83.51 -26.97 29.71 Favored 'General case' 0 N--CA 1.431 -1.384 0 N-CA-C 115.097 1.517 . . . . 1.0 115.097 -177.387 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 8.7 t70 -62.71 -34.09 76.44 Favored 'General case' 0 CA--C 1.488 -1.405 0 O-C-N 120.336 -1.478 . . . . 1.0 113.342 163.591 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 19.2 t70 -70.59 -55.08 9.65 Favored 'General case' 0 N--CA 1.43 -1.472 0 C-N-CA 126.201 1.8 . . . . 1.0 114.559 178.405 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 24' ' ' TRP . . . . . . . . . . . . . 32.4 t-105 -73.03 138.68 46.11 Favored 'General case' 0 N--CA 1.43 -1.456 0 O-C-N 120.703 -1.248 . . . . 1.0 113.104 -172.643 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 63.3 m-20 -84.16 -141.33 0.07 Allowed 'General case' 0 N--CA 1.431 -1.408 0 O-C-N 120.327 -1.483 . . . . 1.0 112.054 177.519 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 164.3 -164.8 36.9 Favored Glycine 0 N--CA 1.431 -1.664 0 O-C-N 118.592 -2.568 . . . . 1.0 114.181 -175.221 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 37.4 t70 -86.84 -53.43 4.92 Favored 'General case' 0 N--CA 1.43 -1.463 0 C-N-CA 125.238 1.415 . . . . 1.0 107.911 169.242 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 4.5 t -82.7 -176.48 6.3 Favored 'General case' 0 N--CA 1.431 -1.414 0 C-N-CA 125.728 1.611 . . . . 1.0 109.691 178.94 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 32.9 t0 -99.85 178.63 4.76 Favored 'General case' 0 N--CA 1.43 -1.449 0 O-C-N 120.26 -1.525 . . . . 1.0 108.142 175.218 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 9.3 tp -152.26 126.58 1.41 Allowed 'Isoleucine or valine' 0 N--CA 1.43 -1.431 0 N-CA-C 106.936 -1.505 . . . . 1.0 106.936 -173.974 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 28.4 t70 -131.73 119.07 20.82 Favored 'General case' 0 N--CA 1.43 -1.439 0 CA-C-O 122.956 1.36 . . . . 1.0 109.13 163.299 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 17.3 p -86.21 131.17 34.3 Favored 'General case' 0 N--CA 1.43 -1.445 0 O-C-N 120.088 -1.632 . . . . 1.0 111.228 174.349 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 41.0 mm-40 -100.06 137.5 38.42 Favored 'General case' 0 N--CA 1.429 -1.488 0 C-N-CA 124.708 1.203 . . . . 1.0 108.916 174.651 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 3.5 tp -127.42 114.1 34.79 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.407 0 CA-C-O 124.046 1.879 . . . . 1.0 106.245 178.81 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 1.6 t-20 -125.81 179.98 4.93 Favored 'General case' 0 N--CA 1.43 -1.427 0 C-N-CA 124.805 1.242 . . . . 1.0 107.828 176.663 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -71.36 87.36 0.41 Allowed Glycine 0 N--CA 1.431 -1.653 0 O-C-N 120.566 -1.334 . . . . 1.0 115.898 -168.657 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 82.2 23.57 56.67 Favored Glycine 0 N--CA 1.429 -1.792 0 C-N-CA 125.379 1.466 . . . . 1.0 112.526 -171.889 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 61.8 t -138.84 135.05 42.92 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.475 0 CA-C-N 118.307 1.053 . . . . 1.0 109.109 -173.253 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 31.1 mt -118.07 142.01 47.86 Favored 'General case' 0 N--CA 1.43 -1.427 0 CA-C-O 122.919 1.343 . . . . 1.0 108.799 166.273 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -138.49 111.3 7.71 Favored 'General case' 0 N--CA 1.43 -1.426 0 O-C-N 120.422 -1.424 . . . . 1.0 108.436 178.032 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 70.3 mt -96.83 105.41 17.07 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.467 0 N-CA-C 107.362 -1.347 . . . . 1.0 107.362 -165.859 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 14.0 m -118.44 131.2 56.28 Favored 'General case' 0 N--CA 1.43 -1.457 0 CA-C-N 118.896 0.771 . . . . 1.0 112.994 -163.053 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 43' ' ' PHE . . . . . . . . . . . . . 1.4 m-85 -99.56 173.68 6.61 Favored 'General case' 0 N--CA 1.43 -1.431 0 O-C-N 120.608 -1.308 . . . . 1.0 111.193 -179.381 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -71.77 -19.03 62.08 Favored 'General case' 0 N--CA 1.429 -1.481 0 O-C-N 119.219 -2.175 . . . . 1.0 113.476 -179.466 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 29.0 t-20 -67.21 -17.97 65.05 Favored 'General case' 0 N--CA 1.429 -1.502 0 C-N-CA 126.811 2.044 . . . . 1.0 113.512 170.731 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 92.34 -14.9 63.5 Favored Glycine 0 N--CA 1.43 -1.74 0 O-C-N 119.962 -1.712 . . . . 1.0 113.683 179.666 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 13.8 m -77.8 167.86 20.86 Favored 'General case' 0 N--CA 1.431 -1.425 0 O-C-N 121.082 -1.246 . . . . 1.0 111.077 172.943 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 12.9 ptpt -169.93 157.68 6.82 Favored 'General case' 0 N--CA 1.43 -1.439 0 O-C-N 121.156 -0.965 . . . . 1.0 113.07 -162.668 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 5.3 mm -101.54 137.11 30.39 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.438 0 C-N-CA 125.791 1.636 . . . . 1.0 107.389 171.823 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 16.1 mm -111.17 116.85 53.61 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.437 0 C-N-CA 125.032 1.333 . . . . 1.0 109.382 -178.013 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 3.0 mt -125.43 124.76 67.68 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.506 0 O-C-N 120.717 -1.239 . . . . 1.0 110.695 179.297 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 52' ' ' ASN . . . . . 0.481 ' H ' ' HD1' ' A' ' 61' ' ' TRP . 26.6 t30 -162.52 172.93 14.7 Favored 'General case' 0 N--CA 1.43 -1.471 0 N-CA-C 103.142 -2.91 . . . . 1.0 103.142 -172.815 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 1.9 ptm180 -139.76 150.57 44.93 Favored 'General case' 0 N--CA 1.429 -1.524 0 CA-C-O 122.546 1.165 . . . . 1.0 112.337 -158.913 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 15.8 mm-40 -107.16 -108.42 0.31 Allowed 'General case' 0 N--CA 1.43 -1.448 0 C-N-CA 124.653 1.181 . . . . 1.0 109.562 -167.173 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 33.2 mm-40 -79.23 135.75 57.6 Favored Pre-proline 0 N--CA 1.43 -1.446 0 CA-C-O 117.718 -1.134 . . . . 1.0 112.799 -172.041 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 98.5 Cg_endo -73.45 62.69 4.46 Favored 'Trans proline' 0 N--CA 1.434 -1.999 0 C-N-CA 123.277 2.651 . . . . 1.0 112.319 162.997 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 73.1 mt -120.32 -103.0 0.41 Allowed 'General case' 0 N--CA 1.429 -1.493 0 N-CA-C 102.841 -3.022 . . . . 1.0 102.841 164.483 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 58' ' ' HIS . . . . . 0.452 ' HE1' ' HG2' ' A' ' 5' ' ' GLU . 1.8 m-70 -132.47 92.02 3.01 Favored 'General case' 0 N--CA 1.429 -1.489 0 N-CA-C 106.622 -1.622 . . . . 1.0 106.622 159.412 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 22.1 tt0 -158.68 122.05 3.84 Favored 'General case' 0 N--CA 1.429 -1.516 0 CA-C-N 121.687 2.04 . . . . 1.0 114.161 173.005 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 86.4 t -133.36 157.57 42.63 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.451 0 C-N-CA 127.031 2.132 . . . . 1.0 109.437 -179.013 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 61' ' ' TRP . . . . . 0.481 ' HD1' ' H ' ' A' ' 52' ' ' ASN . 0.0 OUTLIER -111.36 156.06 22.16 Favored 'General case' 0 N--CA 1.429 -1.505 0 C-N-CA 127.867 2.467 . . . . 1.0 109.755 -174.169 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . 0.277 2.3 pt? -150.91 134.01 16.03 Favored 'General case' 0 N--CA 1.432 -1.364 0 CA-C-N 120.686 1.584 . . . . 1.0 113.916 150.939 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -120.08 147.29 45.03 Favored 'General case' 0 N--CA 1.429 -1.514 0 C-N-CA 125.367 1.467 . . . . 1.0 114.429 -179.557 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 64' ' ' THR . . . . . . . . . . . . . 12.5 t -153.96 -149.52 0.29 Allowed 'General case' 0 N--CA 1.429 -1.509 0 C-N-CA 126.745 2.018 . . . . 1.0 112.388 -172.694 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 5.6 tmtm? -63.56 -53.57 49.64 Favored 'General case' 0 N--CA 1.43 -1.456 0 C-N-CA 130.116 3.366 . . . . 1.0 114.362 -174.404 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 31.3 tt0 -82.24 2.19 33.02 Favored 'General case' 0 N--CA 1.429 -1.492 0 CA-C-O 122.581 1.181 . . . . 1.0 111.602 -177.008 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 117.5 -72.92 0.29 Allowed Glycine 0 N--CA 1.43 -1.732 0 N-CA-C 107.343 -2.303 . . . . 1.0 107.343 -177.4 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 106.06 -173.43 19.85 Favored Glycine 0 N--CA 1.43 -1.733 0 C-N-CA 124.229 0.918 . . . . 1.0 112.486 -176.382 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -162.05 169.83 20.29 Favored 'General case' 0 N--CA 1.431 -1.423 0 N-CA-C 107.284 -1.376 . . . . 1.0 107.284 -173.008 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 19.8 p80 -79.87 159.9 26.25 Favored 'General case' 0 N--CA 1.431 -1.422 0 O-C-N 119.775 -1.828 . . . . 1.0 114.653 174.504 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 71' ' ' PHE . . . . . . . . . . . . 0.3 72.3 t80 -112.21 113.77 26.2 Favored 'General case' 0 N--CA 1.431 -1.402 0 C-N-CA 127.744 2.418 . . . . 1.0 107.019 -158.565 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 5.7 m-20 -134.12 155.1 50.66 Favored 'General case' 0 N--CA 1.43 -1.459 0 CA-C-O 121.851 0.834 . . . . 1.0 110.546 -173.99 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 8.0 tt -97.37 133.53 41.84 Favored 'General case' 0 N--CA 1.431 -1.42 0 O-C-N 119.68 -1.888 . . . . 1.0 111.869 -166.677 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 53.5 tttm -101.81 -56.39 2.29 Favored 'General case' 0 N--CA 1.43 -1.471 0 O-C-N 120.823 -1.173 . . . . 1.0 109.556 174.539 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -157.03 -96.91 0.12 Allowed Glycine 0 N--CA 1.431 -1.677 0 O-C-N 121.035 -1.041 . . . . 1.0 111.346 175.863 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 27.9 m-20 -89.72 16.31 8.17 Favored 'General case' 0 N--CA 1.429 -1.479 0 O-C-N 121.047 -1.266 . . . . 1.0 111.405 179.94 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 32.9 tt0 -166.02 132.83 2.66 Favored 'General case' 0 N--CA 1.43 -1.427 0 N-CA-C 102.046 -3.316 . . . . 1.0 102.046 -161.484 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 78' ' ' TRP . . . . . . . . . . . . . 50.2 m95 -87.75 144.88 26.39 Favored 'General case' 0 N--CA 1.432 -1.37 0 N-CA-C 106.322 -1.732 . . . . 1.0 106.322 175.186 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 9.4 pt -102.35 167.54 2.33 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.485 0 N-CA-C 106.618 -1.623 . . . . 1.0 106.618 174.083 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 1.4 m -89.79 135.65 33.5 Favored 'General case' 0 N--CA 1.429 -1.484 0 O-C-N 120.195 -1.565 . . . . 1.0 107.193 155.29 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 36.8 t70 -59.94 -38.87 83.66 Favored 'General case' 0 N--CA 1.43 -1.447 0 CA-C-N 120.689 1.586 . . . . 1.0 115.069 -174.238 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -9.85 -84.34 0.0 OUTLIER 'General case' 0 N--CA 1.43 -1.467 0 C-N-CA 131.628 3.971 . . . . 1.0 118.457 176.634 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 58.8 m -111.19 -12.79 14.09 Favored 'General case' 0 CA--C 1.489 -1.371 0 O-C-N 120.485 -1.384 . . . . 1.0 109.588 158.126 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 115.85 76.41 0.63 Allowed Glycine 0 N--CA 1.43 -1.763 0 N-CA-C 108.041 -2.023 . . . . 1.0 108.041 -173.509 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 5.2 mm-40 -100.74 -136.4 0.31 Allowed 'General case' 0 N--CA 1.431 -1.419 0 N-CA-C 109.141 -0.688 . . . . 1.0 109.141 -175.583 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 95.5 m -154.2 133.95 12.94 Favored 'General case' 0 N--CA 1.43 -1.445 0 O-C-N 120.156 -1.59 . . . . 1.0 110.402 -171.317 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 1.1 t80 -38.02 -92.13 0.0 OUTLIER 'General case' 0 CA--C 1.489 -1.375 0 C-N-CA 128.432 2.693 . . . . 1.0 115.842 168.895 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 88' ' ' TRP . . . . . . . . . . . . . 50.7 m95 -63.16 -32.69 74.14 Favored 'General case' 0 N--CA 1.431 -1.419 0 C-N-CA 125.649 1.58 . . . . 1.0 113.454 -167.195 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 35.7 t70 -77.96 -42.94 31.24 Favored 'General case' 0 N--CA 1.43 -1.456 0 C-N-CA 125.088 1.355 . . . . 1.0 113.027 -175.898 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 35.0 tp -75.3 -38.9 60.08 Favored 'General case' 0 N--CA 1.43 -1.46 0 O-C-N 119.427 -2.045 . . . . 1.0 111.332 179.335 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 41.9 tp -54.78 -38.64 67.51 Favored 'General case' 0 N--CA 1.43 -1.427 0 C-N-CA 126.33 1.852 . . . . 1.0 113.626 168.106 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 3.4 tm-20 -56.85 -59.9 4.35 Favored 'General case' 0 N--CA 1.429 -1.506 0 C-N-CA 124.611 1.164 . . . . 1.0 112.043 165.875 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 35.9 mt-30 -51.92 -41.81 62.29 Favored 'General case' 0 N--CA 1.43 -1.425 0 N-CA-C 116.28 1.956 . . . . 1.0 116.28 177.394 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -59.19 -58.39 8.84 Favored 'General case' 0 N--CA 1.43 -1.473 0 C-N-CA 126.523 1.929 . . . . 1.0 113.906 172.424 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -62.77 -49.11 76.3 Favored 'General case' 0 N--CA 1.429 -1.507 0 O-C-N 120.41 -1.431 . . . . 1.0 113.446 179.783 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 66.1 m -48.18 -47.55 35.11 Favored 'General case' 0 N--CA 1.43 -1.437 0 C-N-CA 127.859 2.464 . . . . 1.0 114.913 170.501 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 6.6 pt20 -73.4 -30.93 63.59 Favored 'General case' 0 N--CA 1.43 -1.441 0 O-C-N 120.306 -1.496 . . . . 1.0 114.428 -179.222 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 49.7 mt-30 -81.03 -37.93 28.3 Favored 'General case' 0 N--CA 1.431 -1.379 0 O-C-N 120.323 -1.486 . . . . 1.0 113.868 174.715 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -79.42 -42.76 24.73 Favored 'General case' 0 N--CA 1.43 -1.456 0 O-C-N 120.32 -1.488 . . . . 1.0 114.98 -179.686 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . 106.98 17.75 11.35 Favored Glycine 0 N--CA 1.431 -1.695 0 O-C-N 120.683 -1.261 . . . . 1.0 115.762 175.408 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 4.9 tt0 -162.41 152.78 16.81 Favored 'General case' 0 N--CA 1.43 -1.455 0 N-CA-C 104.946 -2.242 . . . . 1.0 104.946 179.527 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 35.1 m -53.48 108.31 0.33 Allowed 'General case' 0 N--CA 1.43 -1.463 0 C-N-CA 125.238 1.415 . . . . 1.0 114.571 175.317 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 49.0 t -89.43 110.49 21.69 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.414 0 CA-C-O 123.258 1.504 . . . . 1.0 108.244 176.892 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 61.5 m -94.19 98.98 11.33 Favored 'General case' 0 N--CA 1.43 -1.46 0 N-CA-C 113.615 0.968 . . . . 1.0 113.615 -162.525 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 88.5 m-85 -89.17 -32.91 17.24 Favored 'General case' 0 N--CA 1.429 -1.485 0 O-C-N 120.961 -1.087 . . . . 1.0 112.884 176.738 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 30.7 mmt180 . . . . . 0 C--O 1.26 1.647 0 N-CA-C 107.3 -1.37 . . . . 1.0 107.3 172.78 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 76.8 m-20 . . . . . 0 N--CA 1.431 -1.405 0 CA-C-O 121.172 0.51 . . . . 1.0 110.542 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -56.86 -45.95 82.12 Favored 'General case' 0 N--CA 1.43 -1.446 0 C-N-CA 126.723 2.009 . . . . 1.0 110.611 170.95 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 49.5 m -60.06 -40.79 90.69 Favored 'General case' 0 N--CA 1.431 -1.416 0 C-N-CA 125.285 1.434 . . . . 1.0 114.776 176.57 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 26.1 tt0 -62.8 -57.34 11.25 Favored 'General case' 0 N--CA 1.429 -1.494 0 C-N-CA 124.236 1.014 . . . . 1.0 111.933 175.265 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 2.4 m-85 -67.31 -24.79 65.79 Favored 'General case' 0 N--CA 1.429 -1.499 0 N-CA-C 115.506 1.669 . . . . 1.0 115.506 178.555 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 10.0 t60 -62.56 -43.28 99.19 Favored 'General case' 0 N--CA 1.43 -1.429 0 O-C-N 119.709 -1.869 . . . . 1.0 112.982 167.857 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -73.84 -45.47 51.02 Favored 'General case' 0 N--CA 1.43 -1.458 0 O-C-N 120.355 -1.465 . . . . 1.0 113.683 177.965 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 84.2 mt -59.76 -44.82 93.69 Favored 'General case' 0 N--CA 1.429 -1.495 0 C-N-CA 124.539 1.135 . . . . 1.0 112.782 173.441 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -58.47 -40.57 83.06 Favored 'General case' 0 N--CA 1.43 -1.47 0 O-C-N 120.538 -1.351 . . . . 1.0 113.427 173.01 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -58.51 -38.48 77.78 Favored 'General case' 0 N--CA 1.431 -1.417 0 CA-C-N 120.276 1.398 . . . . 1.0 114.138 172.358 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 57.9 mm-40 -63.06 -47.94 80.79 Favored 'General case' 0 N--CA 1.43 -1.453 0 O-C-N 119.999 -1.688 . . . . 1.0 114.98 171.719 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 77.6 mt -60.71 -50.06 75.0 Favored 'General case' 0 N--CA 1.431 -1.422 0 O-C-N 120.283 -1.51 . . . . 1.0 112.508 173.863 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 0.4 OUTLIER -46.5 -61.75 1.67 Allowed 'General case' 0 N--CA 1.43 -1.451 0 C-N-CA 127.594 2.358 . . . . 1.0 111.799 177.416 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 53.0 tp -53.62 -58.21 7.99 Favored 'General case' 0 N--CA 1.431 -1.415 0 C-N-CA 125.041 1.336 . . . . 1.0 113.304 174.519 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 28.7 m -60.93 -44.13 97.64 Favored 'General case' 0 N--CA 1.429 -1.485 0 N-CA-C 115.038 1.496 . . . . 1.0 115.038 -170.234 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 7.4 mt -83.41 -27.85 7.69 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.408 0 O-C-N 120.237 -1.539 . . . . 1.0 111.4 -178.196 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 5.4 tt0 -59.33 -50.23 74.78 Favored 'General case' 0 N--CA 1.431 -1.394 0 O-C-N 119.852 -1.78 . . . . 1.0 110.944 167.714 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 53.3 mt-10 -51.84 -52.86 46.41 Favored 'General case' 0 N--CA 1.429 -1.48 0 C-N-CA 126.234 1.814 . . . . 1.0 114.397 172.315 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -63.94 -45.28 89.9 Favored 'General case' 0 N--CA 1.43 -1.472 0 O-C-N 120.277 -1.515 . . . . 1.0 114.843 -177.933 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 96.0 mt -63.93 -49.17 73.67 Favored 'General case' 0 N--CA 1.43 -1.447 0 N-CA-C 115.486 1.661 . . . . 1.0 115.486 174.207 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 25.2 t0 -58.28 -37.58 75.3 Favored 'General case' 0 N--CA 1.429 -1.492 0 O-C-N 119.517 -1.99 . . . . 1.0 114.501 174.349 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 18.2 t70 -91.21 28.32 1.67 Allowed 'General case' 0 N--CA 1.43 -1.46 0 C-N-CA 125.643 1.577 . . . . 1.0 113.9 177.201 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 24' ' ' TRP . . . . . . . . . . . . . 14.1 t90 -65.41 -66.81 0.5 Allowed 'General case' 0 N--CA 1.43 -1.47 0 O-C-N 119.51 -1.994 . . . . 1.0 113.356 176.844 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 29.0 t0 83.2 167.71 0.11 Allowed 'General case' 0 N--CA 1.43 -1.452 0 C-N-CA 127.368 2.267 . . . . 1.0 113.841 172.912 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 116.51 -134.59 11.45 Favored Glycine 0 N--CA 1.431 -1.686 0 C-N-CA 124.803 1.192 . . . . 1.0 111.785 177.223 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -80.57 -28.54 37.16 Favored 'General case' 0 N--CA 1.429 -1.519 0 C-N-CA 126.524 1.93 . . . . 1.0 111.054 -174.921 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 81.9 p -77.42 171.51 14.77 Favored 'General case' 0 N--CA 1.432 -1.366 0 C-N-CA 127.176 2.191 . . . . 1.0 115.68 -172.387 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 17.2 t0 -132.32 157.66 43.88 Favored 'General case' 0 N--CA 1.429 -1.478 0 N-CA-C 107.051 -1.462 . . . . 1.0 107.051 166.18 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 16.6 tt -159.62 123.33 0.41 Allowed 'Isoleucine or valine' 0 N--CA 1.43 -1.461 0 CA-C-O 123.088 1.423 . . . . 1.0 107.754 -169.274 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 31.9 t0 -115.7 101.59 8.97 Favored 'General case' 0 N--CA 1.43 -1.472 0 C-N-CA 127.554 2.342 . . . . 1.0 108.212 -179.377 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 21.7 p -89.26 134.48 34.03 Favored 'General case' 0 N--CA 1.43 -1.447 0 O-C-N 120.283 -1.511 . . . . 1.0 110.345 174.841 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 19.5 mt-10 -129.03 130.11 46.19 Favored 'General case' 0 N--CA 1.431 -1.379 0 O-C-N 120.488 -1.383 . . . . 1.0 111.475 -175.996 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 3.3 tp -106.51 110.77 32.71 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.456 0 C-N-CA 127.34 2.256 . . . . 1.0 105.893 178.335 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 62.7 m-80 -115.17 -178.5 3.39 Favored 'General case' 0 N--CA 1.429 -1.503 0 C-N-CA 126.255 1.822 . . . . 1.0 107.786 175.524 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -71.98 92.79 0.56 Allowed Glycine 0 N--CA 1.431 -1.669 0 O-C-N 119.816 -1.803 . . . . 1.0 115.695 -167.031 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 85.76 11.42 74.05 Favored Glycine 0 N--CA 1.429 -1.782 0 C-N-CA 125.898 1.713 . . . . 1.0 113.264 -174.194 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 48.5 t -136.97 125.89 35.8 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.426 0 O-C-N 121.615 -0.932 . . . . 1.0 111.048 -165.429 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 13.5 mt -105.47 126.0 51.63 Favored 'General case' 0 N--CA 1.43 -1.437 0 CA-C-O 124.511 2.101 . . . . 1.0 108.933 161.587 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -126.66 120.73 30.21 Favored 'General case' 0 N--CA 1.43 -1.449 0 N-CA-C 104.412 -2.44 . . . . 1.0 104.412 -178.621 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 4.5 mp -119.09 126.29 75.23 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.484 0 N-CA-C 108.011 -1.107 . . . . 1.0 108.011 -173.676 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 44.0 p -129.88 130.45 45.22 Favored 'General case' 0 N--CA 1.428 -1.547 0 CA-C-O 121.421 0.629 . . . . 1.0 110.932 -171.83 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 43' ' ' PHE . . . . . . . . . . . . . 1.9 p90 -120.02 172.31 7.83 Favored 'General case' 0 N--CA 1.429 -1.494 0 O-C-N 120.552 -1.343 . . . . 1.0 111.343 -176.395 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -64.02 -24.43 67.71 Favored 'General case' 0 N--CA 1.43 -1.466 0 N-CA-C 116.774 2.138 . . . . 1.0 116.774 -160.062 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 31.1 m120 -66.22 -18.17 65.18 Favored 'General case' 0 N--CA 1.429 -1.489 0 N-CA-C 115.369 1.618 . . . . 1.0 115.369 173.848 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 83.57 43.69 7.23 Favored Glycine 0 N--CA 1.429 -1.774 0 N-CA-C 109.898 -1.281 . . . . 1.0 109.898 -169.929 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 57.8 m -123.94 158.71 31.38 Favored 'General case' 0 N--CA 1.43 -1.468 0 C-N-CA 126.336 1.855 . . . . 1.0 107.213 -177.382 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 22.1 ptmt -151.35 142.3 23.0 Favored 'General case' 0 N--CA 1.43 -1.442 0 N-CA-C 115.21 1.559 . . . . 1.0 115.21 -160.985 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 4.7 mm -109.18 132.71 56.53 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.433 0 N-CA-C 106.136 -1.801 . . . . 1.0 106.136 166.651 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 2.7 tp -125.0 119.75 56.69 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.505 0 CA-C-O 123.116 1.436 . . . . 1.0 109.19 174.243 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 3.0 mt -124.69 96.02 3.58 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.386 0 C-N-CA 126.229 1.812 . . . . 1.0 110.769 -179.035 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 39.4 m-80 -94.68 150.77 19.88 Favored 'General case' 0 N--CA 1.43 -1.473 0 CA-C-O 123.864 1.792 . . . . 1.0 108.469 166.97 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 5.8 tmm_? -153.51 141.6 20.38 Favored 'General case' 0 N--CA 1.429 -1.495 0 CA-C-O 123.237 1.494 . . . . 1.0 110.933 -163.977 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -111.57 132.02 54.84 Favored 'General case' 0 N--CA 1.428 -1.541 0 C-N-CA 127.484 2.314 . . . . 1.0 107.352 178.047 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 56.0 mt-10 -67.33 -48.88 45.5 Favored Pre-proline 0 N--CA 1.43 -1.44 0 CA-C-O 115.687 -2.101 . . . . 1.0 115.295 165.573 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 92.4 Cg_endo -77.29 -172.31 1.41 Allowed 'Trans proline' 0 N--CA 1.434 -2.004 0 CA-C-N 126.449 3.339 . . . . 1.0 112.586 172.401 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 22.3 mt 77.7 -44.54 0.42 Allowed 'General case' 0 N--CA 1.43 -1.45 0 C-N-CA 127.419 2.288 . . . . 1.0 114.609 173.989 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER 91.15 47.0 0.01 OUTLIER 'General case' 0 N--CA 1.43 -1.458 0 C-N-CA 128.865 2.866 . . . . 1.0 112.673 169.035 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -150.49 161.86 41.72 Favored 'General case' 0 N--CA 1.43 -1.454 0 O-C-N 120.403 -1.435 . . . . 1.0 107.169 174.984 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 91.3 t -123.14 154.5 28.77 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.403 0 N-CA-C 108.126 -1.064 . . . . 1.0 108.126 173.166 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 61' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -90.1 153.67 20.36 Favored 'General case' 0 N--CA 1.43 -1.451 0 CA-C-N 120.91 1.687 . . . . 1.0 110.376 176.665 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 2.1 tm? -147.61 103.93 3.57 Favored 'General case' 0 N--CA 1.429 -1.477 0 O-C-N 119.144 -2.222 . . . . 1.0 111.035 178.761 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -123.97 136.07 54.06 Favored 'General case' 0 N--CA 1.43 -1.433 0 O-C-N 120.818 -1.176 . . . . 1.0 113.742 172.915 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 64' ' ' THR . . . . . . . . . . . . 0.258 0.1 OUTLIER -134.66 -80.84 0.44 Allowed 'General case' 0 N--CA 1.429 -1.475 0 N-CA-C 107.415 -1.328 . . . . 1.0 107.415 171.456 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 6.1 tmtm? -82.31 -83.69 0.12 Allowed 'General case' 0 N--CA 1.43 -1.442 0 O-C-N 120.242 -1.536 . . . . 1.0 113.161 -175.84 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 20.9 tt0 -128.51 -26.38 2.77 Favored 'General case' 0 N--CA 1.43 -1.464 0 O-C-N 120.218 -1.551 . . . . 1.0 111.733 -175.357 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . -92.19 71.25 1.67 Allowed Glycine 0 N--CA 1.431 -1.689 0 O-C-N 120.692 -1.255 . . . . 1.0 110.839 -179.466 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . -77.97 94.78 1.23 Allowed Glycine 0 N--CA 1.43 -1.759 0 C-N-CA 123.382 0.515 . . . . 1.0 112.522 168.831 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 15.5 m-85 -126.45 151.53 47.62 Favored 'General case' 0 N--CA 1.43 -1.447 0 N-CA-C 107.699 -1.223 . . . . 1.0 107.699 -171.625 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 5.1 p-80 -92.71 158.17 16.06 Favored 'General case' 0 N--CA 1.431 -1.392 0 O-C-N 120.187 -1.571 . . . . 1.0 111.063 169.411 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 47.1 p90 -130.01 143.32 50.73 Favored 'General case' 0 N--CA 1.431 -1.423 0 N-CA-C 114.379 1.252 . . . . 1.0 114.379 -162.503 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 30.8 m-20 -125.02 154.35 41.41 Favored 'General case' 0 N--CA 1.43 -1.464 0 C-N-CA 125.74 1.616 . . . . 1.0 110.496 -177.729 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 64.2 tp -87.07 137.48 32.31 Favored 'General case' 0 N--CA 1.43 -1.433 0 C-N-CA 125.625 1.57 . . . . 1.0 111.555 -178.397 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 2.5 mmmp? -101.46 -76.15 0.57 Allowed 'General case' 0 N--CA 1.43 -1.471 0 O-C-N 120.694 -1.254 . . . . 1.0 109.279 165.076 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -146.12 -76.35 0.02 OUTLIER Glycine 0 N--CA 1.43 -1.741 0 O-C-N 121.133 -0.98 . . . . 1.0 112.062 -178.674 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 37.8 m-20 -113.99 39.7 2.65 Favored 'General case' 0 N--CA 1.429 -1.502 0 C-N-CA 124.695 1.198 . . . . 1.0 109.382 170.637 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 15.0 tp10 -168.63 138.0 2.3 Favored 'General case' 0 N--CA 1.43 -1.453 0 N-CA-C 103.624 -2.732 . . . . 1.0 103.624 -178.81 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 78' ' ' TRP . . . . . . . . . . . . . 45.1 m95 -101.65 141.55 34.34 Favored 'General case' 0 N--CA 1.429 -1.477 0 N-CA-C 104.984 -2.228 . . . . 1.0 104.984 165.51 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 9.9 pt -105.11 160.6 5.21 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.432 0 O-C-N 120.527 -1.358 . . . . 1.0 107.93 176.744 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 39.0 m -82.74 133.54 35.15 Favored 'General case' 0 N--CA 1.43 -1.431 0 O-C-N 121.041 -1.037 . . . . 1.0 108.674 167.765 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 29.0 t70 -65.25 -43.29 91.84 Favored 'General case' 0 N--CA 1.43 -1.469 0 CA-C-N 120.577 1.535 . . . . 1.0 112.774 -178.092 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 29.2 tpt85 -66.63 101.79 0.83 Allowed 'General case' 0 N--CA 1.43 -1.428 0 C-N-CA 126.822 2.049 . . . . 1.0 111.38 -179.054 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 83' ' ' SER . . . . . . . . . . . . 0.279 15.4 m 80.52 -43.49 0.23 Allowed 'General case' 0 N--CA 1.43 -1.433 0 C-N-CA 128.619 2.767 . . . . 1.0 114.931 -171.87 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 110.86 81.78 1.23 Allowed Glycine 0 N--CA 1.43 -1.751 0 N-CA-C 109.71 -1.356 . . . . 1.0 109.71 -176.181 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 85' ' ' GLU . . . . . . . . . . . . 0.264 16.0 mt-10 -124.72 -140.5 0.29 Allowed 'General case' 0 N--CA 1.43 -1.455 0 CA-C-N 118.19 0.995 . . . . 1.0 109.535 -172.0 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 62.9 m -146.04 129.2 16.63 Favored 'General case' 0 N--CA 1.43 -1.461 0 O-C-N 119.592 -1.942 . . . . 1.0 110.004 -169.388 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 15.0 t80 -58.86 -81.87 0.02 OUTLIER 'General case' 0 N--CA 1.429 -1.481 0 N-CA-C 117.11 2.263 . . . . 1.0 117.11 -171.277 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 88' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -66.94 -34.38 77.65 Favored 'General case' 0 N--CA 1.429 -1.487 0 O-C-N 120.608 -1.307 . . . . 1.0 112.958 -170.697 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 35.5 t70 -59.93 -47.51 85.47 Favored 'General case' 0 N--CA 1.43 -1.458 0 C-N-CA 126.233 1.813 . . . . 1.0 114.62 173.074 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 49.3 tp -69.81 -41.42 75.05 Favored 'General case' 0 N--CA 1.429 -1.524 0 O-C-N 119.541 -1.974 . . . . 1.0 111.981 178.521 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 45.3 tp -50.58 -44.27 56.78 Favored 'General case' 0 N--CA 1.429 -1.519 0 C-N-CA 126.584 1.954 . . . . 1.0 113.763 167.698 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 2.7 tm-20 -59.55 -50.36 74.21 Favored 'General case' 0 N--CA 1.429 -1.504 0 C-N-CA 125.329 1.452 . . . . 1.0 113.122 172.324 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 37.5 mt-30 -53.33 -45.55 69.1 Favored 'General case' 0 N--CA 1.43 -1.446 0 CA-C-N 120.188 1.358 . . . . 1.0 114.373 173.693 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -62.71 -44.47 96.14 Favored 'General case' 0 N--CA 1.43 -1.461 0 O-C-N 120.219 -1.551 . . . . 1.0 115.133 175.024 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -71.21 -45.23 63.77 Favored 'General case' 0 N--CA 1.43 -1.426 0 O-C-N 119.692 -1.88 . . . . 1.0 113.808 178.233 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 63.0 m -57.46 -30.83 65.36 Favored 'General case' 0 N--CA 1.431 -1.409 0 C-N-CA 127.764 2.425 . . . . 1.0 112.521 174.631 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -63.54 -72.36 0.14 Allowed 'General case' 0 N--CA 1.429 -1.507 0 C-N-CA 125.004 1.321 . . . . 1.0 112.098 168.711 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 3.2 pt20 -70.5 -12.17 61.4 Favored 'General case' 0 N--CA 1.43 -1.425 0 N-CA-C 116.756 2.132 . . . . 1.0 116.756 -169.76 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -90.51 -48.2 7.24 Favored 'General case' 0 N--CA 1.43 -1.446 0 C-N-CA 124.854 1.261 . . . . 1.0 112.139 164.643 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . 110.62 4.33 28.38 Favored Glycine 0 N--CA 1.43 -1.702 0 O-C-N 121.037 -1.039 . . . . 1.0 114.379 -178.614 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 11.2 pt-20 -162.91 165.87 24.61 Favored 'General case' 0 N--CA 1.429 -1.511 0 N-CA-C 106.754 -1.573 . . . . 1.0 106.754 -177.087 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 96.4 m -70.83 121.66 18.45 Favored 'General case' 0 N--CA 1.431 -1.424 0 CA-C-N 120.313 1.415 . . . . 1.0 113.424 -173.342 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 76.6 t -98.62 121.36 49.1 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.493 0 C-N-CA 127.272 2.229 . . . . 1.0 109.421 -179.625 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 29.6 m -67.27 124.07 22.09 Favored 'General case' 0 N--CA 1.43 -1.457 0 C-N-CA 128.845 2.858 . . . . 1.0 115.557 -172.721 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 1.6 p90 -140.85 -56.12 0.5 Allowed 'General case' 0 N--CA 1.429 -1.482 0 O-C-N 120.196 -1.565 . . . . 1.0 112.174 -156.032 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 17.6 ttt180 . . . . . 0 C--O 1.262 1.723 0 C-N-CA 125.346 1.459 . . . . 1.0 111.13 -171.938 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 2' ' ' ASN . . . . . 0.502 ' N ' HD21 ' A' ' 2' ' ' ASN . 0.8 OUTLIER . . . . . 0 N--CA 1.431 -1.406 0 N-CA-C 118.876 2.917 . . . . 1.0 118.876 . . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 11.0 p-10 -71.51 -25.34 62.21 Favored 'General case' 0 N--CA 1.43 -1.436 0 O-C-N 120.181 -1.574 . . . . 1.0 114.129 -175.989 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 28.2 m -71.3 -53.65 13.54 Favored 'General case' 0 N--CA 1.43 -1.451 0 C-N-CA 124.877 1.271 . . . . 1.0 110.338 175.943 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 44.6 mm-40 -57.55 -51.17 70.59 Favored 'General case' 0 N--CA 1.429 -1.483 0 C-N-CA 126.622 1.969 . . . . 1.0 113.509 175.778 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 5.1 t80 -56.42 -39.73 73.54 Favored 'General case' 0 CA--C 1.489 -1.4 0 N-CA-C 114.833 1.42 . . . . 1.0 114.833 172.768 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . 0.31 0.2 OUTLIER -67.61 -40.42 84.69 Favored 'General case' 0 N--CA 1.43 -1.429 0 O-C-N 119.543 -1.973 . . . . 1.0 115.009 173.015 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 81.5 mtt180 -56.4 -53.96 51.26 Favored 'General case' 0 N--CA 1.429 -1.476 0 C-N-CA 125.28 1.432 . . . . 1.0 113.832 177.957 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 9' ' ' LEU . . . . . 0.454 HD12 ' N ' ' A' ' 10' ' ' ALA . 3.4 pp -62.0 -42.28 98.98 Favored 'General case' 0 N--CA 1.429 -1.504 0 C-N-CA 124.042 0.937 . . . . 1.0 112.865 176.936 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 10' ' ' ALA . . . . . 0.454 ' N ' HD12 ' A' ' 9' ' ' LEU . . . -56.92 -47.06 81.48 Favored 'General case' 0 N--CA 1.431 -1.419 0 C-N-CA 124.927 1.291 . . . . 1.0 113.996 172.598 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 58.7 m-20 -58.85 -41.7 87.6 Favored 'General case' 0 N--CA 1.43 -1.447 0 C-N-CA 125.484 1.514 . . . . 1.0 113.07 176.265 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . 0.26 15.6 pt20 -70.83 -39.24 73.12 Favored 'General case' 0 N--CA 1.431 -1.42 0 O-C-N 119.696 -1.877 . . . . 1.0 115.859 175.405 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 4.2 pp -73.01 -34.58 66.46 Favored 'General case' 0 N--CA 1.431 -1.376 0 O-C-N 119.183 -2.198 . . . . 1.0 114.028 175.128 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -51.73 -52.05 51.48 Favored 'General case' 0 N--CA 1.43 -1.47 0 C-N-CA 126.257 1.823 . . . . 1.0 112.438 166.434 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 50.8 tp -58.69 -45.83 88.6 Favored 'General case' 0 N--CA 1.429 -1.5 0 C-N-CA 124.643 1.177 . . . . 1.0 113.65 175.088 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 75.3 m -57.0 -59.81 4.51 Favored 'General case' 0 N--CA 1.43 -1.435 0 C-N-CA 125.699 1.6 . . . . 1.0 113.063 175.858 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 84.4 mt -50.15 -45.43 23.7 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.449 0 C-N-CA 126.515 1.926 . . . . 1.0 114.765 172.218 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 10.7 mt-10 -55.57 -63.83 1.04 Allowed 'General case' 0 N--CA 1.43 -1.459 0 O-C-N 119.901 -1.749 . . . . 1.0 113.15 173.65 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 95.2 mt-10 -62.53 -46.55 87.9 Favored 'General case' 0 N--CA 1.43 -1.449 0 C-N-CA 124.998 1.319 . . . . 1.0 113.736 -175.448 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 3.3 tpt180 -73.9 -24.03 59.65 Favored 'General case' 0 N--CA 1.43 -1.447 0 N-CA-C 114.372 1.249 . . . . 1.0 114.372 -174.553 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -88.01 -48.25 7.9 Favored 'General case' 0 N--CA 1.43 -1.43 0 O-C-N 120.742 -1.224 . . . . 1.0 112.088 172.895 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 26.2 t70 -60.33 -50.31 74.14 Favored 'General case' 0 N--CA 1.431 -1.408 0 O-C-N 120.25 -1.531 . . . . 1.0 114.531 -179.244 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 15.5 t70 -93.68 106.99 18.92 Favored 'General case' 0 N--CA 1.429 -1.499 0 O-C-N 119.88 -1.762 . . . . 1.0 109.441 171.047 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 24' ' ' TRP . . . . . . . . . . . . . 14.4 t90 -146.47 175.48 10.53 Favored 'General case' 0 N--CA 1.43 -1.471 0 C-N-CA 126.019 1.728 . . . . 1.0 108.335 -179.165 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 61.0 m-20 -100.48 112.15 24.49 Favored 'General case' 0 N--CA 1.432 -1.351 0 O-C-N 120.356 -1.465 . . . . 1.0 108.502 173.335 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -173.71 167.81 40.49 Favored Glycine 0 N--CA 1.429 -1.797 0 C-N-CA 119.136 -1.506 . . . . 1.0 112.892 176.85 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 31.2 m-20 -88.92 -34.21 17.01 Favored 'General case' 0 N--CA 1.43 -1.475 0 C-N-CA 126.837 2.055 . . . . 1.0 110.607 177.593 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 58.5 p -75.79 147.43 39.22 Favored 'General case' 0 CA--C 1.488 -1.42 0 C-N-CA 124.776 1.23 . . . . 1.0 113.302 -178.717 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 3.3 t0 -90.5 170.58 10.08 Favored 'General case' 0 N--CA 1.431 -1.416 0 O-C-N 120.453 -1.404 . . . . 1.0 111.127 -175.555 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 6.9 mm -152.5 122.59 0.87 Allowed 'Isoleucine or valine' 0 N--CA 1.429 -1.485 0 C-N-CA 128.473 2.709 . . . . 1.0 105.623 -171.288 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 60.6 m-20 -111.39 101.72 10.16 Favored 'General case' 0 N--CA 1.429 -1.513 0 C-N-CA 124.146 0.978 . . . . 1.0 108.803 158.419 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 14.3 p -85.08 124.83 32.22 Favored 'General case' 0 N--CA 1.43 -1.463 0 O-C-N 120.57 -1.331 . . . . 1.0 111.666 173.213 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 36.0 mm-40 -99.4 139.4 35.11 Favored 'General case' 0 N--CA 1.43 -1.429 0 O-C-N 119.781 -1.824 . . . . 1.0 109.534 -174.688 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 4.0 mp -127.2 112.53 28.85 Favored 'Isoleucine or valine' 0 N--CA 1.432 -1.366 0 N-CA-C 105.7 -1.963 . . . . 1.0 105.7 174.437 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 48.5 m-80 -123.8 175.26 6.99 Favored 'General case' 0 N--CA 1.43 -1.455 0 C-N-CA 126.918 2.087 . . . . 1.0 108.244 173.104 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -68.07 86.87 0.18 Allowed Glycine 0 N--CA 1.429 -1.781 0 N-CA-C 116.455 1.342 . . . . 1.0 116.455 -170.615 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 85.86 16.6 63.1 Favored Glycine 0 N--CA 1.43 -1.758 0 C-N-CA 125.29 1.424 . . . . 1.0 112.584 -174.152 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 94.7 t -136.54 122.98 30.13 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.395 0 C-N-CA 124.549 1.139 . . . . 1.0 109.162 -169.828 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 98.9 mt -112.91 140.72 47.47 Favored 'General case' 0 N--CA 1.431 -1.386 0 O-C-N 120.411 -1.431 . . . . 1.0 109.064 168.822 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -134.45 121.06 20.54 Favored 'General case' 0 N--CA 1.43 -1.442 0 O-C-N 120.361 -1.462 . . . . 1.0 108.204 179.229 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 96.4 mt -97.02 115.26 36.14 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.483 0 N-CA-C 106.784 -1.561 . . . . 1.0 106.784 -177.882 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 2.9 m -124.77 122.71 38.2 Favored 'General case' 0 N--CA 1.43 -1.472 0 N-CA-C 108.698 -0.853 . . . . 1.0 108.698 -177.354 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 43' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -115.07 173.28 6.57 Favored 'General case' 0 N--CA 1.429 -1.522 0 C-N-CA 124.339 1.055 . . . . 1.0 110.611 179.882 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -68.89 -23.27 64.18 Favored 'General case' 0 N--CA 1.43 -1.471 0 N-CA-C 116.474 2.027 . . . . 1.0 116.474 -161.017 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 8.4 t-20 -66.85 -18.56 65.44 Favored 'General case' 0 N--CA 1.429 -1.484 0 C-N-CA 124.81 1.244 . . . . 1.0 112.925 169.07 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 99.71 5.06 55.59 Favored Glycine 0 N--CA 1.429 -1.768 0 O-C-N 120.603 -1.311 . . . . 1.0 113.49 172.776 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 1.3 t -89.9 171.83 9.31 Favored 'General case' 0 N--CA 1.431 -1.379 0 CA-C-N 118.277 1.038 . . . . 1.0 112.795 -177.293 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 73.7 tttt -138.17 129.38 27.41 Favored 'General case' 0 N--CA 1.43 -1.468 0 N-CA-C 113.816 1.043 . . . . 1.0 113.816 -157.301 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 1.4 mm -112.32 127.14 69.7 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.39 0 N-CA-C 105.242 -2.133 . . . . 1.0 105.242 161.528 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 50' ' ' ILE . . . . . 0.511 HG23 ' HB3' ' A' ' 63' ' ' ALA . 3.0 tp -123.07 117.89 53.08 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.464 0 CA-C-O 123.67 1.7 . . . . 1.0 109.311 -178.803 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 6.6 mt -121.13 131.64 72.52 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.472 0 C-N-CA 125.703 1.601 . . . . 1.0 109.976 -170.127 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 52' ' ' ASN . . . . . 0.495 ' H ' ' HD1' ' A' ' 61' ' ' TRP . 6.8 t-20 -162.91 163.8 26.17 Favored 'General case' 0 N--CA 1.43 -1.439 0 CA-C-O 124.049 1.881 . . . . 1.0 107.108 -170.993 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 2.6 ttp180 -156.81 117.37 3.62 Favored 'General case' 0 N--CA 1.43 -1.456 0 CA-C-N 114.204 -1.362 . . . . 1.0 109.337 -156.098 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 32.2 mm-40 -104.55 122.29 45.27 Favored 'General case' 0 N--CA 1.43 -1.473 0 C-N-CA 126.562 1.945 . . . . 1.0 106.876 -179.342 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 23.5 mt-10 -55.72 -39.77 79.79 Favored Pre-proline 0 N--CA 1.43 -1.473 0 N-CA-C 119.332 3.086 . . . . 1.0 119.332 -175.505 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 50.1 Cg_exo -67.44 114.01 3.11 Favored 'Trans proline' 0 N--CA 1.434 -1.997 0 CA-C-N 126.107 3.217 . . . . 1.0 113.051 172.752 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . 0.389 5.3 mp 76.89 132.84 0.05 Allowed 'General case' 0 N--CA 1.429 -1.499 0 C-N-CA 126.83 2.052 . . . . 1.0 114.376 -166.872 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 35.4 m170 -73.78 43.65 0.16 Allowed 'General case' 0 N--CA 1.43 -1.451 0 C-N-CA 127.191 2.196 . . . . 1.0 114.48 -175.29 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 85.5 mt-30 -116.98 134.57 54.58 Favored 'General case' 0 N--CA 1.43 -1.474 0 O-C-N 119.877 -1.765 . . . . 1.0 110.321 -172.618 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 59.3 t -105.83 156.26 6.67 Favored 'Isoleucine or valine' 0 N--CA 1.427 -1.591 0 N-CA-C 106.173 -1.788 . . . . 1.0 106.173 177.91 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 61' ' ' TRP . . . . . 0.495 ' HD1' ' H ' ' A' ' 52' ' ' ASN . 0.0 OUTLIER -104.29 144.55 31.47 Favored 'General case' 0 N--CA 1.431 -1.394 0 O-C-N 119.788 -1.82 . . . . 1.0 111.447 170.82 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 13.1 mt -112.86 95.34 5.36 Favored 'General case' 0 N--CA 1.431 -1.392 0 N-CA-C 104.578 -2.379 . . . . 1.0 104.578 163.873 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 63' ' ' ALA . . . . . 0.511 ' HB3' HG23 ' A' ' 50' ' ' ILE . . . -90.79 125.91 35.86 Favored 'General case' 0 N--CA 1.43 -1.444 0 CA-C-O 123.174 1.464 . . . . 1.0 109.224 169.655 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 64' ' ' THR . . . . . . . . . . . . . 9.4 t -152.55 -169.44 3.34 Favored 'General case' 0 N--CA 1.43 -1.453 0 N-CA-C 107.414 -1.328 . . . . 1.0 107.414 -154.9 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 2.3 tptm -56.25 -44.44 79.67 Favored 'General case' 0 N--CA 1.43 -1.466 0 N-CA-C 115.778 1.77 . . . . 1.0 115.778 -178.326 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 82.1 mt-30 -71.66 -24.14 61.79 Favored 'General case' 0 N--CA 1.431 -1.418 0 N-CA-C 115.229 1.566 . . . . 1.0 115.229 -177.313 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 147.25 -46.78 0.71 Allowed Glycine 0 N--CA 1.43 -1.708 0 O-C-N 120.595 -1.315 . . . . 1.0 113.299 175.213 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 125.88 116.77 2.11 Favored Glycine 0 N--CA 1.431 -1.686 0 N-CA-C 117.816 1.886 . . . . 1.0 117.816 178.755 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 20.1 m-30 -123.59 131.99 53.76 Favored 'General case' 0 N--CA 1.431 -1.398 0 C-N-CA 124.791 1.237 . . . . 1.0 109.219 -178.912 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 4.0 p-80 -88.7 158.18 18.29 Favored 'General case' 0 N--CA 1.429 -1.487 0 O-C-N 120.372 -1.455 . . . . 1.0 114.024 173.502 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 48.0 p90 -148.19 148.8 30.94 Favored 'General case' 0 N--CA 1.431 -1.406 0 N-CA-C 115.469 1.655 . . . . 1.0 115.469 -161.369 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 6.2 m-20 -116.46 175.23 5.66 Favored 'General case' 0 N--CA 1.431 -1.414 0 C-N-CA 127.349 2.26 . . . . 1.0 111.808 -172.648 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 50.2 tp -111.3 116.74 31.51 Favored 'General case' 0 N--CA 1.431 -1.416 0 C-N-CA 125.723 1.609 . . . . 1.0 112.039 -178.998 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -72.91 -42.35 63.62 Favored 'General case' 0 N--CA 1.429 -1.495 0 O-C-N 121.14 -0.975 . . . . 1.0 112.476 163.375 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . 166.63 -66.64 0.2 Allowed Glycine 0 N--CA 1.431 -1.694 0 O-C-N 121.035 -1.04 . . . . 1.0 111.815 178.003 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 18.0 p-10 -110.45 6.07 21.86 Favored 'General case' 0 N--CA 1.43 -1.458 0 C-N-CA 124.888 1.275 . . . . 1.0 111.716 -179.108 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 20.2 tt0 -151.72 132.58 14.15 Favored 'General case' 0 N--CA 1.43 -1.44 0 N-CA-C 103.921 -2.622 . . . . 1.0 103.921 -177.574 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 78' ' ' TRP . . . . . 0.445 ' HZ2' HD13 ' A' ' 9' ' ' LEU . 71.3 m95 -89.12 135.54 33.51 Favored 'General case' 0 N--CA 1.43 -1.441 0 N-CA-C 105.667 -1.975 . . . . 1.0 105.667 173.495 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -133.96 136.92 53.13 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.452 0 N-CA-C 104.992 -2.225 . . . . 1.0 104.992 -161.737 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 60.5 m -78.69 137.42 37.79 Favored 'General case' 0 N--CA 1.431 -1.384 0 O-C-N 120.089 -1.632 . . . . 1.0 111.957 -173.194 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 23.8 t0 -72.78 -56.82 4.68 Favored 'General case' 0 N--CA 1.43 -1.428 0 CA-C-O 123.12 1.438 . . . . 1.0 109.548 177.311 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 1.9 tpt85 -72.73 128.59 36.0 Favored 'General case' 0 N--CA 1.43 -1.449 0 C-N-CA 125.535 1.534 . . . . 1.0 110.076 178.59 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 11.0 t 77.86 -63.2 0.34 Allowed 'General case' 0 N--CA 1.43 -1.471 0 C-N-CA 127.33 2.252 . . . . 1.0 112.916 -170.773 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 110.67 71.68 0.66 Allowed Glycine 0 N--CA 1.429 -1.779 0 C-N-CA 124.62 1.105 . . . . 1.0 110.813 -176.774 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 59.6 mt-10 -136.05 -146.36 0.24 Allowed 'General case' 0 N--CA 1.43 -1.441 0 C-N-CA 125.023 1.329 . . . . 1.0 109.444 -170.246 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 88.7 m -143.32 134.8 26.22 Favored 'General case' 0 N--CA 1.43 -1.464 0 O-C-N 120.427 -1.42 . . . . 1.0 109.998 -156.789 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 31.1 t80 -61.03 -76.85 0.05 OUTLIER 'General case' 0 N--CA 1.43 -1.444 0 N-CA-C 117.353 2.353 . . . . 1.0 117.353 -177.535 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 88' ' ' TRP . . . . . . . . . . . . . 55.0 m95 -60.77 -31.88 71.21 Favored 'General case' 0 N--CA 1.431 -1.425 0 O-C-N 120.032 -1.668 . . . . 1.0 114.727 -169.674 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 6.1 t70 -78.14 -36.2 48.04 Favored 'General case' 0 N--CA 1.43 -1.441 0 C-N-CA 125.83 1.652 . . . . 1.0 113.16 177.721 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 50.5 tp -70.63 -41.39 72.26 Favored 'General case' 0 N--CA 1.431 -1.409 0 O-C-N 118.679 -2.513 . . . . 1.0 110.989 175.591 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 31.6 tp -55.46 -37.8 68.23 Favored 'General case' 0 N--CA 1.431 -1.383 0 C-N-CA 126.554 1.942 . . . . 1.0 114.074 169.614 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 35.0 tt0 -60.66 -54.23 47.84 Favored 'General case' 0 N--CA 1.43 -1.434 0 C-N-CA 125.454 1.502 . . . . 1.0 113.028 169.804 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 10.9 tm0? -51.71 -53.81 35.22 Favored 'General case' 0 N--CA 1.43 -1.438 0 C-N-CA 125.995 1.718 . . . . 1.0 114.268 175.133 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -52.21 -55.56 20.36 Favored 'General case' 0 N--CA 1.431 -1.408 0 C-N-CA 127.721 2.408 . . . . 1.0 113.954 176.053 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -61.58 -44.9 96.16 Favored 'General case' 0 N--CA 1.429 -1.49 0 N-CA-C 114.528 1.307 . . . . 1.0 114.528 177.066 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 93.4 m -64.71 -21.21 66.69 Favored 'General case' 0 N--CA 1.429 -1.478 0 O-C-N 119.634 -1.916 . . . . 1.0 113.779 175.324 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 7.5 tp60 -74.45 -65.13 0.89 Allowed 'General case' 0 N--CA 1.429 -1.496 0 O-C-N 120.345 -1.472 . . . . 1.0 110.927 171.749 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 13.3 pt20 -77.38 -28.37 52.81 Favored 'General case' 0 N--CA 1.429 -1.486 0 N-CA-C 115.478 1.658 . . . . 1.0 115.478 -170.963 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -85.6 -46.2 11.02 Favored 'General case' 0 N--CA 1.43 -1.447 0 O-C-N 120.667 -1.271 . . . . 1.0 112.866 171.602 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . 95.61 32.46 6.91 Favored Glycine 0 N--CA 1.43 -1.742 0 O-C-N 120.878 -1.139 . . . . 1.0 114.655 -178.848 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 14.1 pt-20 -158.37 163.1 37.6 Favored 'General case' 0 N--CA 1.43 -1.433 0 O-C-N 120.955 -1.321 . . . . 1.0 108.987 179.57 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 92.6 m -77.9 85.38 4.16 Favored 'General case' 0 N--CA 1.429 -1.502 0 O-C-N 119.862 -1.774 . . . . 1.0 112.58 -178.937 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 47.8 t -85.12 100.38 8.27 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.42 0 C-N-CA 126.914 2.085 . . . . 1.0 106.617 168.378 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 34.9 t -143.09 154.72 44.23 Favored 'General case' 0 N--CA 1.431 -1.415 0 C-N-CA 125.261 1.424 . . . . 1.0 107.93 -174.78 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -110.98 -16.77 13.44 Favored 'General case' 0 N--CA 1.43 -1.456 0 O-C-N 120.437 -1.415 . . . . 1.0 112.217 176.262 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 16.1 mtp180 . . . . . 0 C--O 1.259 1.574 0 N-CA-C 115.519 1.674 . . . . 1.0 115.519 -167.16 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 18.8 m120 . . . . . 0 N--CA 1.43 -1.46 0 N-CA-C 114.02 1.119 . . . . 1.0 114.02 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -57.3 -47.61 81.04 Favored 'General case' 0 CA--C 1.49 -1.361 0 C-N-CA 127.493 2.317 . . . . 1.0 113.197 -173.235 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 10.5 m -60.07 -42.5 94.67 Favored 'General case' 0 N--CA 1.43 -1.43 0 C-N-CA 125.743 1.617 . . . . 1.0 113.567 177.106 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 9.0 tp10 -70.6 -46.47 63.35 Favored 'General case' 0 N--CA 1.43 -1.426 0 C-N-CA 125.083 1.353 . . . . 1.0 111.729 -178.732 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 4.4 t80 -50.36 -54.69 19.83 Favored 'General case' 0 N--CA 1.429 -1.5 0 C-N-CA 125.802 1.641 . . . . 1.0 114.63 166.572 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 30.4 m170 -59.47 -45.16 92.42 Favored 'General case' 0 N--CA 1.43 -1.454 0 N-CA-C 115.475 1.657 . . . . 1.0 115.475 178.434 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 73.4 mtp85 -56.52 -56.27 23.34 Favored 'General case' 0 N--CA 1.43 -1.433 0 N-CA-C 113.338 0.866 . . . . 1.0 113.338 173.282 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 82.7 mt -66.23 -40.59 90.37 Favored 'General case' 0 N--CA 1.43 -1.441 0 N-CA-C 114.676 1.361 . . . . 1.0 114.676 -179.161 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -62.79 -48.5 78.87 Favored 'General case' 0 N--CA 1.43 -1.468 0 C-N-CA 124.905 1.282 . . . . 1.0 113.383 178.509 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 58.7 m-20 -66.22 -36.33 82.77 Favored 'General case' 0 N--CA 1.429 -1.485 0 O-C-N 120.829 -1.17 . . . . 1.0 113.071 175.812 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 29.1 mm100 -61.65 -46.73 88.52 Favored 'General case' 0 N--CA 1.43 -1.461 0 O-C-N 120.116 -1.615 . . . . 1.0 114.845 170.398 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 1.2 pp -70.05 -37.18 75.48 Favored 'General case' 0 N--CA 1.43 -1.451 0 O-C-N 119.942 -1.724 . . . . 1.0 114.503 -179.688 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 0.1 OUTLIER -43.82 -62.09 1.22 Allowed 'General case' 0 N--CA 1.43 -1.459 0 C-N-CA 127.786 2.434 . . . . 1.0 112.411 163.348 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 44.7 tp -60.06 -47.85 84.15 Favored 'General case' 0 N--CA 1.43 -1.44 0 C-N-CA 124.738 1.215 . . . . 1.0 113.499 177.88 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 32.6 m -57.33 -50.83 71.71 Favored 'General case' 0 N--CA 1.43 -1.474 0 C-N-CA 125.743 1.617 . . . . 1.0 113.686 179.482 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 95.9 mt -65.32 -45.45 93.37 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.465 0 O-C-N 120.353 -1.467 . . . . 1.0 111.554 179.718 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -57.65 -55.05 39.89 Favored 'General case' 0 N--CA 1.428 -1.532 0 O-C-N 121.774 -0.579 . . . . 1.0 112.542 176.26 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 5.5 tm-20 -58.21 -49.7 76.14 Favored 'General case' 0 N--CA 1.43 -1.467 0 C-N-CA 126.103 1.761 . . . . 1.0 114.591 178.008 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.28 -38.54 77.19 Favored 'General case' 0 N--CA 1.43 -1.471 0 C-N-CA 124.72 1.208 . . . . 1.0 113.912 -179.388 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 21' ' ' LEU . . . . . 0.44 HD23 HG21 ' A' ' 41' ' ' ILE . 2.7 tp -86.08 -38.32 17.92 Favored 'General case' 0 N--CA 1.429 -1.495 0 N-CA-C 113.877 1.065 . . . . 1.0 113.877 177.914 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 37.3 t70 -61.23 -26.41 67.72 Favored 'General case' 0 N--CA 1.43 -1.469 0 O-C-N 119.281 -2.137 . . . . 1.0 113.969 173.709 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 29.8 t70 -59.85 -35.51 74.93 Favored 'General case' 0 N--CA 1.429 -1.478 0 C-N-CA 126.247 1.819 . . . . 1.0 114.506 171.02 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 24' ' ' TRP . . . . . . . . . . . . . 48.7 t90 -83.93 138.78 32.98 Favored 'General case' 0 N--CA 1.43 -1.46 0 CA-C-O 122.062 0.934 . . . . 1.0 113.124 -167.349 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 24.0 t70 -133.64 131.46 39.59 Favored 'General case' 0 N--CA 1.431 -1.393 0 O-C-N 121.236 -0.915 . . . . 1.0 109.298 -179.661 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -125.88 -141.35 5.52 Favored Glycine 0 N--CA 1.43 -1.74 0 N-CA-C 109.843 -1.303 . . . . 1.0 109.843 177.272 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -89.07 -26.83 21.18 Favored 'General case' 0 N--CA 1.43 -1.438 0 O-C-N 120.825 -1.397 . . . . 1.0 109.134 165.632 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 88.1 p -82.12 163.98 21.63 Favored 'General case' 0 N--CA 1.431 -1.4 0 O-C-N 120.375 -1.453 . . . . 1.0 111.935 165.448 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 9.4 t70 -117.48 175.48 5.61 Favored 'General case' 0 N--CA 1.43 -1.448 0 N-CA-C 107.442 -1.318 . . . . 1.0 107.442 177.653 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 9.1 tp -159.08 114.24 0.15 Allowed 'Isoleucine or valine' 0 N--CA 1.429 -1.499 0 CA-C-O 123.81 1.767 . . . . 1.0 109.502 -159.884 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 25.1 t0 -131.21 102.47 6.01 Favored 'General case' 0 N--CA 1.43 -1.44 0 C-N-CA 125.501 1.52 . . . . 1.0 110.247 -168.079 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 28.2 t -85.57 135.22 33.9 Favored 'General case' 0 N--CA 1.429 -1.509 0 O-C-N 118.899 -2.376 . . . . 1.0 111.976 176.631 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 38.5 mt-10 -85.11 139.59 31.6 Favored 'General case' 0 N--CA 1.43 -1.44 0 O-C-N 120.953 -1.092 . . . . 1.0 110.856 171.538 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 7.9 mm -111.85 105.39 18.7 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.419 0 N-CA-C 104.927 -2.249 . . . . 1.0 104.927 166.859 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 8.0 t30 -122.95 68.25 0.98 Allowed 'General case' 0 N--CA 1.431 -1.413 0 C-N-CA 125.696 1.599 . . . . 1.0 108.208 -176.58 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . 66.61 -88.48 0.13 Allowed Glycine 0 N--CA 1.429 -1.771 0 O-C-N 120.524 -1.36 . . . . 1.0 115.986 176.584 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -113.88 4.57 24.18 Favored Glycine 0 N--CA 1.43 -1.708 0 C-N-CA 124.866 1.222 . . . . 1.0 112.955 177.953 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 40.3 t -117.54 131.17 71.04 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.483 0 C-N-CA 124.786 1.234 . . . . 1.0 107.679 176.919 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 40.1 mt -110.82 131.05 55.38 Favored 'General case' 0 N--CA 1.429 -1.478 0 O-C-N 120.702 -1.249 . . . . 1.0 108.14 166.771 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -130.6 111.69 12.46 Favored 'General case' 0 N--CA 1.431 -1.423 0 CA-C-O 123.119 1.438 . . . . 1.0 108.003 -174.245 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 41' ' ' ILE . . . . . 0.44 HG21 HD23 ' A' ' 21' ' ' LEU . 69.9 mt -89.66 114.83 28.2 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.421 0 O-C-N 120.762 -1.211 . . . . 1.0 108.023 -170.153 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 6.4 m -111.99 128.87 56.3 Favored 'General case' 0 N--CA 1.43 -1.451 0 CA-C-O 121.694 0.759 . . . . 1.0 111.295 -170.631 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 43' ' ' PHE . . . . . . . . . . . . . 2.7 m-85 -114.74 149.42 36.89 Favored 'General case' 0 N--CA 1.43 -1.445 0 O-C-N 120.437 -1.414 . . . . 1.0 107.731 -175.408 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 4.5 mt-10 -65.8 -17.01 64.34 Favored 'General case' 0 N--CA 1.43 -1.458 0 N-CA-C 116.304 1.965 . . . . 1.0 116.304 176.248 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 3.6 m-20 -64.7 -17.76 64.39 Favored 'General case' 0 N--CA 1.429 -1.478 0 O-C-N 120.66 -1.275 . . . . 1.0 113.538 172.771 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 104.45 -4.46 43.75 Favored Glycine 0 N--CA 1.429 -1.792 0 O-C-N 120.996 -1.065 . . . . 1.0 111.092 -177.861 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 69.0 m -73.92 164.57 26.47 Favored 'General case' 0 N--CA 1.43 -1.442 0 C-N-CA 129.115 2.966 . . . . 1.0 113.458 -179.865 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 81.8 tttt -168.48 132.25 1.54 Allowed 'General case' 0 N--CA 1.43 -1.466 0 O-C-N 120.778 -1.201 . . . . 1.0 114.088 -167.799 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 5.5 mm -112.98 144.4 20.71 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.471 0 C-N-CA 125.082 1.353 . . . . 1.0 108.401 174.417 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 50' ' ' ILE . . . . . 0.431 ' HB ' ' HB3' ' A' ' 63' ' ' ALA . 3.6 mm -120.0 119.39 60.0 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.483 0 C-N-CA 125.494 1.517 . . . . 1.0 109.942 -178.979 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 3.7 mt -126.99 125.6 66.84 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.474 0 O-C-N 120.304 -1.498 . . . . 1.0 111.357 -178.894 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 52' ' ' ASN . . . . . 0.409 ' H ' ' HD1' ' A' ' 61' ' ' TRP . 45.7 t-20 -160.56 166.39 29.12 Favored 'General case' 0 N--CA 1.429 -1.477 0 C-N-CA 126.759 2.024 . . . . 1.0 105.833 -177.206 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 11.1 ptm180 -133.61 145.09 49.71 Favored 'General case' 0 N--CA 1.43 -1.442 0 C-N-CA 125.513 1.525 . . . . 1.0 110.996 -162.49 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 6.2 mm-40 -128.45 -72.61 0.61 Allowed 'General case' 0 N--CA 1.429 -1.476 0 O-C-N 120.728 -1.232 . . . . 1.0 112.623 -175.052 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 54.1 mm-40 -74.12 121.64 85.68 Favored Pre-proline 0 N--CA 1.429 -1.488 0 CA-C-O 117.329 -1.32 . . . . 1.0 112.765 -165.809 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 38.4 Cg_endo -81.13 36.55 0.63 Allowed 'Trans proline' 0 C--N 1.3 -1.998 0 C-N-CA 123.877 3.051 . . . . 1.0 112.918 -174.006 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 55.4 mt -109.79 -100.42 0.39 Allowed 'General case' 0 N--CA 1.431 -1.413 0 N-CA-C 104.354 -2.462 . . . . 1.0 104.354 171.754 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 5.9 m-70 -137.52 79.0 1.72 Allowed 'General case' 0 N--CA 1.43 -1.427 0 C-N-CA 125.57 1.548 . . . . 1.0 111.182 170.22 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 17.9 tt0 -155.5 132.75 10.89 Favored 'General case' 0 N--CA 1.43 -1.451 0 CA-C-N 121.84 2.109 . . . . 1.0 113.155 173.24 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 85.0 t -135.82 164.15 33.03 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.454 0 N-CA-C 107.339 -1.356 . . . . 1.0 107.339 179.933 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 61' ' ' TRP . . . . . 0.409 ' HD1' ' H ' ' A' ' 52' ' ' ASN . 0.1 OUTLIER -105.59 153.97 21.05 Favored 'General case' 0 N--CA 1.43 -1.441 0 O-C-N 119.971 -1.706 . . . . 1.0 114.127 178.298 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 68.9 mt -123.19 97.39 5.4 Favored 'General case' 0 N--CA 1.43 -1.446 0 N-CA-C 107.229 -1.397 . . . . 1.0 107.229 162.605 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 63' ' ' ALA . . . . . 0.431 ' HB3' ' HB ' ' A' ' 50' ' ' ILE . . . -98.24 139.11 34.52 Favored 'General case' 0 N--CA 1.431 -1.417 0 O-C-N 120.811 -1.18 . . . . 1.0 108.744 172.959 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 64' ' ' THR . . . . . . . . . . . . . 6.6 t -152.68 -158.52 0.9 Allowed 'General case' 0 N--CA 1.431 -1.405 0 O-C-N 120.595 -1.316 . . . . 1.0 111.39 -158.794 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 41.3 tptt -57.2 -62.85 1.47 Allowed 'General case' 0 N--CA 1.43 -1.473 0 C-N-CA 127.391 2.276 . . . . 1.0 114.373 178.762 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 31.3 tt0 -76.63 -23.56 53.35 Favored 'General case' 0 N--CA 1.429 -1.51 0 CA-C-O 122.489 1.138 . . . . 1.0 112.933 -171.605 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 155.73 -67.16 0.3 Allowed Glycine 0 N--CA 1.43 -1.704 0 N-CA-C 108.014 -2.034 . . . . 1.0 108.014 -178.398 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 85.92 170.92 47.55 Favored Glycine 0 N--CA 1.43 -1.712 0 C-N-CA 124.245 0.926 . . . . 1.0 114.971 -177.689 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -155.95 164.89 37.91 Favored 'General case' 0 N--CA 1.429 -1.509 0 C-N-CA 123.732 0.813 . . . . 1.0 110.7 -166.375 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 28.2 p80 -82.77 157.76 23.1 Favored 'General case' 0 N--CA 1.431 -1.422 0 N-CA-C 114.952 1.464 . . . . 1.0 114.952 177.518 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 42.6 p90 -121.02 134.42 55.29 Favored 'General case' 0 N--CA 1.431 -1.423 0 CA-C-N 114.835 -1.075 . . . . 1.0 113.55 -175.076 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -131.4 147.33 52.55 Favored 'General case' 0 N--CA 1.43 -1.451 0 C-N-CA 125.207 1.403 . . . . 1.0 108.203 -177.604 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 1.5 tt -85.76 114.0 22.37 Favored 'General case' 0 N--CA 1.43 -1.461 0 O-C-N 119.695 -1.878 . . . . 1.0 112.0 -169.468 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 32.3 mmtp -115.51 72.5 0.8 Allowed 'General case' 0 N--CA 1.43 -1.472 0 O-C-N 120.639 -1.288 . . . . 1.0 111.705 177.944 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . 97.84 -100.27 2.35 Favored Glycine 0 N--CA 1.43 -1.735 0 O-C-N 120.198 -1.564 . . . . 1.0 112.716 175.631 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 34.2 m-20 -115.74 11.09 15.59 Favored 'General case' 0 N--CA 1.431 -1.399 0 C-N-CA 124.436 1.094 . . . . 1.0 111.731 179.908 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 5.3 tp10 -151.44 146.32 25.86 Favored 'General case' 0 N--CA 1.43 -1.467 0 N-CA-C 105.418 -2.068 . . . . 1.0 105.418 -179.957 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 78' ' ' TRP . . . . . 0.449 ' HB2' ' HB2' ' A' ' 87' ' ' PHE . 23.7 m95 -90.25 125.63 35.56 Favored 'General case' 0 N--CA 1.429 -1.499 0 N-CA-C 107.159 -1.423 . . . . 1.0 107.159 176.266 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 2.4 mt -89.44 137.98 20.23 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.469 0 C-N-CA 127.191 2.196 . . . . 1.0 109.396 178.272 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 20.8 m -82.05 141.6 33.05 Favored 'General case' 0 N--CA 1.431 -1.425 0 N-CA-C 108.073 -1.084 . . . . 1.0 108.073 175.655 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 24.7 t70 -78.39 -1.54 33.94 Favored 'General case' 0 N--CA 1.43 -1.426 0 CA-C-N 120.201 1.364 . . . . 1.0 114.555 -175.834 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 2.0 ptt180 -82.29 176.79 9.17 Favored 'General case' 0 N--CA 1.43 -1.446 0 O-C-N 119.171 -2.206 . . . . 1.0 112.312 170.56 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 52.5 m -76.09 65.01 2.03 Favored 'General case' 0 N--CA 1.431 -1.375 0 O-C-N 119.899 -1.751 . . . . 1.0 113.051 170.878 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 170.44 103.14 0.16 Allowed Glycine 0 N--CA 1.43 -1.717 0 N-CA-C 105.577 -3.009 . . . . 1.0 105.577 170.486 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 3.2 pt-20 -116.44 82.08 1.73 Allowed 'General case' 0 N--CA 1.43 -1.444 0 N-CA-C 114.521 1.304 . . . . 1.0 114.521 -146.324 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -162.41 129.41 3.7 Favored 'General case' 0 N--CA 1.431 -1.399 0 N-CA-C 115.545 1.683 . . . . 1.0 115.545 -173.329 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 87' ' ' PHE . . . . . 0.449 ' HB2' ' HB2' ' A' ' 78' ' ' TRP . 4.4 t80 -63.63 -89.24 0.01 OUTLIER 'General case' 0 N--CA 1.43 -1.463 0 N-CA-C 116.432 2.012 . . . . 1.0 116.432 173.048 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 88' ' ' TRP . . . . . . . . . . . . . 68.5 m95 -62.1 -27.31 68.83 Favored 'General case' 0 N--CA 1.429 -1.476 0 C-N-CA 125.313 1.445 . . . . 1.0 113.217 -173.022 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . 0.276 0.6 OUTLIER -78.1 -39.41 41.5 Favored 'General case' 0 N--CA 1.429 -1.479 0 C-N-CA 126.291 1.836 . . . . 1.0 112.916 178.683 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 26.5 tp -72.08 -37.66 69.56 Favored 'General case' 0 N--CA 1.43 -1.436 0 O-C-N 118.419 -2.676 . . . . 1.0 111.784 171.15 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 18.5 tp -54.37 -40.33 68.03 Favored 'General case' 0 N--CA 1.43 -1.435 0 C-N-CA 125.43 1.492 . . . . 1.0 114.144 170.325 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 31.4 tt0 -55.71 -56.23 22.87 Favored 'General case' 0 N--CA 1.431 -1.385 0 C-N-CA 124.535 1.134 . . . . 1.0 112.88 165.908 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 60.7 mt-30 -61.25 -39.38 90.12 Favored 'General case' 0 N--CA 1.43 -1.428 0 N-CA-C 115.14 1.533 . . . . 1.0 115.14 -177.736 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -62.51 -46.7 87.21 Favored 'General case' 0 N--CA 1.43 -1.469 0 O-C-N 119.402 -2.061 . . . . 1.0 112.91 170.622 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -67.59 -36.57 81.14 Favored 'General case' 0 N--CA 1.429 -1.501 0 O-C-N 119.566 -1.959 . . . . 1.0 114.263 176.678 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -57.72 -38.67 75.68 Favored 'General case' 0 N--CA 1.43 -1.448 0 C-N-CA 127.033 2.133 . . . . 1.0 112.474 173.617 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 8.2 pt20 -78.15 -37.11 46.74 Favored 'General case' 0 N--CA 1.431 -1.41 0 O-C-N 121.097 -1.002 . . . . 1.0 113.455 174.963 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 6.9 mm-40 -72.69 -41.91 64.8 Favored 'General case' 0 N--CA 1.43 -1.467 0 N-CA-C 115.308 1.596 . . . . 1.0 115.308 -177.486 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -84.91 -39.15 18.55 Favored 'General case' 0 N--CA 1.429 -1.494 0 C-N-CA 124.804 1.242 . . . . 1.0 112.136 174.255 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . 105.61 12.56 26.24 Favored Glycine 0 N--CA 1.43 -1.715 0 O-C-N 121.004 -1.06 . . . . 1.0 114.256 176.105 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 8.4 pt-20 -165.2 163.44 20.25 Favored 'General case' 0 N--CA 1.43 -1.435 0 N-CA-C 105.439 -2.059 . . . . 1.0 105.439 -175.486 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 94.9 m -67.47 114.06 5.83 Favored 'General case' 0 N--CA 1.43 -1.472 0 CA-C-N 120.286 1.403 . . . . 1.0 113.717 -172.09 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 76.1 t -95.6 122.61 47.23 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.448 0 C-N-CA 126.899 2.08 . . . . 1.0 106.325 171.694 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 59.5 m -103.16 102.63 12.63 Favored 'General case' 0 N--CA 1.43 -1.461 0 C-N-CA 124.556 1.142 . . . . 1.0 112.66 -162.363 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 45.7 m-85 -95.57 -36.67 11.18 Favored 'General case' 0 N--CA 1.43 -1.45 0 O-C-N 120.317 -1.489 . . . . 1.0 111.825 177.363 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 11.7 mmt85 . . . . . 0 C--O 1.26 1.658 0 C-N-CA 124.174 0.99 . . . . 1.0 110.778 -179.42 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 19.6 m120 . . . . . 0 N--CA 1.43 -1.45 0 N-CA-C 109.235 -0.654 . . . . 1.0 109.235 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 25.7 t70 -56.84 -50.35 72.68 Favored 'General case' 0 N--CA 1.43 -1.47 0 C-N-CA 128.239 2.616 . . . . 1.0 112.321 178.947 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 41.9 t -44.7 -50.23 10.07 Favored 'General case' 0 N--CA 1.429 -1.488 0 C-N-CA 128.253 2.621 . . . . 1.0 114.181 170.086 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 14.5 tt0 -74.04 -51.41 15.9 Favored 'General case' 0 N--CA 1.43 -1.457 0 C-N-CA 125.33 1.452 . . . . 1.0 113.024 -177.0 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 11.1 t80 -49.95 -43.51 50.07 Favored 'General case' 0 N--CA 1.431 -1.409 0 N-CA-C 115.753 1.76 . . . . 1.0 115.753 170.698 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 15.2 m-70 -69.9 -33.65 72.47 Favored 'General case' 0 N--CA 1.43 -1.425 0 N-CA-C 114.664 1.357 . . . . 1.0 114.664 175.458 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -66.0 -46.39 78.14 Favored 'General case' 0 N--CA 1.43 -1.458 0 O-C-N 120.731 -1.23 . . . . 1.0 112.96 169.742 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 97.7 mt -60.3 -34.73 74.18 Favored 'General case' 0 N--CA 1.43 -1.438 0 O-C-N 120.57 -1.331 . . . . 1.0 113.745 173.647 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -59.05 -46.69 87.62 Favored 'General case' 0 N--CA 1.43 -1.473 0 C-N-CA 125.692 1.597 . . . . 1.0 113.245 170.307 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -58.28 -41.49 84.46 Favored 'General case' 0 N--CA 1.429 -1.482 0 C-N-CA 124.658 1.183 . . . . 1.0 113.11 172.359 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 55.1 mt-30 -58.13 -58.43 8.47 Favored 'General case' 0 N--CA 1.431 -1.42 0 N-CA-C 115.166 1.543 . . . . 1.0 115.166 172.092 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 3.7 pp -66.36 -40.15 89.58 Favored 'General case' 0 N--CA 1.43 -1.433 0 O-C-N 120.15 -1.594 . . . . 1.0 114.996 -176.483 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 33.7 m0 -64.6 -44.19 91.42 Favored 'General case' 0 N--CA 1.429 -1.487 0 C-N-CA 124.814 1.246 . . . . 1.0 112.948 174.548 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 63.0 tp -58.6 -54.77 43.29 Favored 'General case' 0 N--CA 1.431 -1.417 0 O-C-N 120.564 -1.335 . . . . 1.0 112.506 171.533 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 29.4 m -57.42 -53.39 58.66 Favored 'General case' 0 N--CA 1.43 -1.451 0 C-N-CA 125.492 1.517 . . . . 1.0 113.228 -174.381 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 14.4 mt -68.22 -44.24 84.2 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.44 0 O-C-N 120.499 -1.376 . . . . 1.0 113.846 178.826 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 32.3 tt0 -60.86 -47.57 85.78 Favored 'General case' 0 N--CA 1.431 -1.399 0 CA-C-N 120.641 1.564 . . . . 1.0 112.883 179.09 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 34.0 tt0 -58.75 -55.0 40.69 Favored 'General case' 0 N--CA 1.43 -1.438 0 C-N-CA 125.109 1.364 . . . . 1.0 113.551 174.381 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 16.3 tpt180 -58.39 -44.06 88.81 Favored 'General case' 0 N--CA 1.43 -1.462 0 C-N-CA 124.798 1.239 . . . . 1.0 114.11 -176.084 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 84.8 mt -74.83 -43.38 54.88 Favored 'General case' 0 N--CA 1.43 -1.436 0 O-C-N 121.0 -1.062 . . . . 1.0 113.845 179.013 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 21.1 t70 -64.09 -35.14 79.77 Favored 'General case' 0 CA--C 1.488 -1.434 0 O-C-N 120.527 -1.358 . . . . 1.0 114.433 176.092 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 29.4 t70 -71.8 -43.36 65.78 Favored 'General case' 0 N--CA 1.431 -1.404 0 O-C-N 120.33 -1.481 . . . . 1.0 113.84 179.715 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 24' ' ' TRP . . . . . . . . . . . . . 68.8 t-105 -78.71 154.45 30.07 Favored 'General case' 0 N--CA 1.43 -1.474 0 CA-C-O 122.342 1.068 . . . . 1.0 113.523 -173.304 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 52.5 m-20 -96.93 -153.76 0.43 Allowed 'General case' 0 N--CA 1.431 -1.419 0 O-C-N 120.384 -1.447 . . . . 1.0 111.381 -176.165 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 153.16 -173.68 31.99 Favored Glycine 0 N--CA 1.431 -1.639 0 N-CA-C 109.003 -1.639 . . . . 1.0 109.003 -178.275 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 6.6 t70 -78.06 -44.64 25.77 Favored 'General case' 0 N--CA 1.432 -1.351 0 O-C-N 121.418 -1.048 . . . . 1.0 108.322 170.326 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 21.9 t -68.31 156.4 37.79 Favored 'General case' 0 N--CA 1.43 -1.469 0 C-N-CA 125.912 1.685 . . . . 1.0 113.743 172.661 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 4.6 t70 -86.52 175.45 8.34 Favored 'General case' 0 N--CA 1.429 -1.475 0 C-N-CA 125.833 1.653 . . . . 1.0 107.735 164.471 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -162.89 119.63 0.16 Allowed 'Isoleucine or valine' 0 N--CA 1.43 -1.436 0 O-C-N 120.223 -1.548 . . . . 1.0 107.508 -172.051 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 26.3 t70 -131.93 111.26 11.41 Favored 'General case' 0 N--CA 1.43 -1.458 0 O-C-N 120.189 -1.569 . . . . 1.0 108.743 174.258 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 96.3 m -90.25 134.93 33.99 Favored 'General case' 0 N--CA 1.431 -1.385 0 O-C-N 119.231 -2.168 . . . . 1.0 109.857 174.399 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 37.0 mt-10 -101.97 132.78 47.59 Favored 'General case' 0 N--CA 1.431 -1.419 0 C-N-CA 125.012 1.325 . . . . 1.0 109.157 -178.605 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 3.6 tp -112.48 113.59 44.57 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.449 0 CA-C-O 123.792 1.758 . . . . 1.0 106.379 175.756 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -136.42 99.08 3.99 Favored 'General case' 0 N--CA 1.43 -1.45 0 CA-C-N 114.578 -1.192 . . . . 1.0 111.219 -177.849 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . 71.77 26.24 73.25 Favored Glycine 0 N--CA 1.429 -1.774 0 O-C-N 120.251 -1.531 . . . . 1.0 116.34 164.395 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 86.95 20.71 52.76 Favored Glycine 0 N--CA 1.43 -1.752 0 C-N-CA 123.798 0.713 . . . . 1.0 112.889 -173.785 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 84.9 t -125.08 131.48 72.45 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.394 0 N-CA-C 105.815 -1.921 . . . . 1.0 105.815 173.068 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 42.5 mt -102.6 132.25 48.82 Favored 'General case' 0 N--CA 1.431 -1.398 0 CA-C-O 122.56 1.172 . . . . 1.0 109.615 165.785 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 40' ' ' THR . . . . . 0.402 HG23 HD13 ' A' ' 50' ' ' ILE . 0.1 OUTLIER -118.13 124.62 48.45 Favored 'General case' 0 N--CA 1.43 -1.427 0 N-CA-C 106.724 -1.584 . . . . 1.0 106.724 171.392 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 69.7 mt -101.42 121.57 52.48 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.475 0 N-CA-C 108.406 -0.961 . . . . 1.0 108.406 -173.626 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 20.2 p -123.72 118.51 27.38 Favored 'General case' 0 N--CA 1.431 -1.397 0 N-CA-C 113.942 1.09 . . . . 1.0 113.942 -173.439 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 43' ' ' PHE . . . . . . . . . . . . . 3.0 p90 -123.32 169.82 10.93 Favored 'General case' 0 N--CA 1.43 -1.44 0 C-N-CA 126.015 1.726 . . . . 1.0 114.088 174.674 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 7.5 mm-40 -53.34 -32.71 50.42 Favored 'General case' 0 N--CA 1.43 -1.441 0 N-CA-C 118.129 2.64 . . . . 1.0 118.129 -174.44 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -66.78 -12.99 60.89 Favored 'General case' 0 N--CA 1.43 -1.449 0 O-C-N 120.478 -1.389 . . . . 1.0 113.527 -179.715 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 100.96 -14.37 58.68 Favored Glycine 0 N--CA 1.43 -1.755 0 O-C-N 120.791 -1.193 . . . . 1.0 113.425 166.008 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 4.3 m -77.09 168.75 19.55 Favored 'General case' 0 N--CA 1.43 -1.451 0 C-N-CA 124.615 1.166 . . . . 1.0 111.661 176.918 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 93.1 mttt -142.91 135.48 27.64 Favored 'General case' 0 N--CA 1.43 -1.451 0 O-C-N 121.03 -1.044 . . . . 1.0 111.154 -172.266 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 49' ' ' ILE . . . . . 0.633 HD12 HG23 ' A' ' 64' ' ' THR . 4.2 mm -101.36 137.31 29.46 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.414 0 N-CA-C 105.922 -1.881 . . . . 1.0 105.922 175.671 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 50' ' ' ILE . . . . . 0.553 HG23 ' HB3' ' A' ' 63' ' ' ALA . 2.5 tp -128.06 124.83 63.44 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.469 0 CA-C-O 123.078 1.418 . . . . 1.0 109.687 -176.778 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 2.3 mt -127.45 118.03 48.47 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.496 0 C-N-CA 126.316 1.846 . . . . 1.0 111.906 -172.858 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 52' ' ' ASN . . . . . 0.417 ' H ' ' HD1' ' A' ' 61' ' ' TRP . 48.6 t30 -157.75 171.42 20.34 Favored 'General case' 0 N--CA 1.431 -1.418 0 C-N-CA 127.022 2.129 . . . . 1.0 107.792 -176.305 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -136.74 161.17 36.68 Favored 'General case' 0 N--CA 1.43 -1.474 0 C-N-CA 125.722 1.609 . . . . 1.0 114.547 -167.668 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 13.3 mm100 -108.09 129.03 55.17 Favored 'General case' 0 N--CA 1.429 -1.493 0 C-N-CA 125.998 1.719 . . . . 1.0 106.59 169.572 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 47.1 tt0 -60.69 -38.21 53.96 Favored Pre-proline 0 N--CA 1.428 -1.536 0 CA-C-O 117.132 -1.413 . . . . 1.0 114.528 164.481 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 51.9 Cg_exo -66.55 121.57 8.84 Favored 'Trans proline' 0 C--N 1.299 -2.056 0 CA-C-N 124.97 2.811 . . . . 1.0 113.745 160.716 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . 0.381 5.0 mp 75.3 131.9 0.05 OUTLIER 'General case' 0 N--CA 1.43 -1.43 0 CA-C-O 124.944 2.306 . . . . 1.0 116.336 -179.041 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 29.1 m80 -79.98 55.85 2.22 Favored 'General case' 0 N--CA 1.429 -1.502 0 C-N-CA 126.358 1.863 . . . . 1.0 114.144 -172.661 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -144.06 147.37 33.71 Favored 'General case' 0 N--CA 1.43 -1.453 0 C-N-CA 126.112 1.765 . . . . 1.0 110.528 -178.279 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 43.3 t -121.09 151.16 24.1 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.431 0 O-C-N 120.484 -1.385 . . . . 1.0 109.457 -175.372 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 61' ' ' TRP . . . . . 0.456 ' HA ' ' HA ' ' A' ' 70' ' ' HIS . 0.0 OUTLIER -88.77 152.87 21.51 Favored 'General case' 0 N--CA 1.43 -1.461 0 O-C-N 119.65 -1.906 . . . . 1.0 114.533 -178.565 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 80.6 mt -116.17 93.89 4.42 Favored 'General case' 0 N--CA 1.43 -1.444 0 N-CA-C 106.594 -1.632 . . . . 1.0 106.594 162.422 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 63' ' ' ALA . . . . . 0.553 ' HB3' HG23 ' A' ' 50' ' ' ILE . . . -92.96 100.18 12.68 Favored 'General case' 0 N--CA 1.43 -1.429 0 CA-C-O 123.26 1.505 . . . . 1.0 109.872 169.016 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 64' ' ' THR . . . . . 0.633 HG23 HD12 ' A' ' 49' ' ' ILE . 3.0 m -111.33 -113.51 0.32 Allowed 'General case' 0 N--CA 1.429 -1.509 0 N-CA-C 106.691 -1.596 . . . . 1.0 106.691 -171.909 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 13.3 tmtt? -82.81 -45.59 14.13 Favored 'General case' 0 N--CA 1.43 -1.45 0 O-C-N 119.745 -1.847 . . . . 1.0 111.01 174.452 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 66' ' ' GLN . . . . . 0.436 HE22 ' HB2' ' A' ' 94' ' ' ALA . 17.5 mp0 -74.59 -27.02 60.3 Favored 'General case' 0 N--CA 1.43 -1.469 0 N-CA-C 116.099 1.888 . . . . 1.0 116.099 -166.475 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 117.48 26.24 2.94 Favored Glycine 0 N--CA 1.43 -1.752 0 N-CA-C 117.133 1.613 . . . . 1.0 117.133 166.074 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 115.51 74.59 0.58 Allowed Glycine 0 N--CA 1.43 -1.752 0 CA-C-N 119.569 1.685 . . . . 1.0 115.735 165.185 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 18.2 m-30 -102.07 116.67 33.18 Favored 'General case' 0 N--CA 1.43 -1.468 0 N-CA-C 106.858 -1.534 . . . . 1.0 106.858 178.299 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 70' ' ' HIS . . . . . 0.456 ' HA ' ' HA ' ' A' ' 61' ' ' TRP . 40.8 p-80 -81.68 157.51 24.59 Favored 'General case' 0 N--CA 1.43 -1.468 0 O-C-N 119.802 -1.811 . . . . 1.0 113.891 -179.33 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -116.09 129.76 56.49 Favored 'General case' 0 N--CA 1.43 -1.45 0 N-CA-C 113.375 0.879 . . . . 1.0 113.375 -176.193 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 7.1 m-20 -112.32 179.39 4.0 Favored 'General case' 0 N--CA 1.431 -1.382 0 N-CA-C 107.28 -1.378 . . . . 1.0 107.28 172.483 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 26.3 tp -113.3 106.93 15.2 Favored 'General case' 0 N--CA 1.43 -1.45 0 O-C-N 119.117 -2.239 . . . . 1.0 112.079 -174.957 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 2.8 ttpm? -70.81 -45.18 65.07 Favored 'General case' 0 N--CA 1.431 -1.421 0 O-C-N 119.647 -1.908 . . . . 1.0 113.3 168.024 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -170.51 -103.06 0.16 Allowed Glycine 0 N--CA 1.43 -1.735 0 O-C-N 120.365 -1.459 . . . . 1.0 112.184 177.996 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 40.7 m-20 -89.74 17.94 6.06 Favored 'General case' 0 N--CA 1.431 -1.42 0 O-C-N 120.676 -1.485 . . . . 1.0 111.623 179.698 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 9.2 tt0 -168.13 137.12 2.42 Favored 'General case' 0 N--CA 1.43 -1.467 0 N-CA-C 102.864 -3.013 . . . . 1.0 102.864 -163.676 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 78' ' ' TRP . . . . . . . . . . . . . 33.0 m95 -88.53 145.83 25.51 Favored 'General case' 0 N--CA 1.43 -1.469 0 CA-C-O 122.195 0.998 . . . . 1.0 108.822 -177.131 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 2.1 tt -114.1 130.79 67.7 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.47 0 C-N-CA 129.394 3.078 . . . . 1.0 104.587 -168.818 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 80' ' ' CYS . . . . . 0.402 ' HB2' ' HA ' ' A' ' 85' ' ' GLU . 81.3 m -89.4 146.13 24.87 Favored 'General case' 0 N--CA 1.43 -1.472 0 O-C-N 120.679 -1.263 . . . . 1.0 113.483 -172.674 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 22.0 t70 -45.0 -53.69 7.44 Favored 'General case' 0 N--CA 1.431 -1.383 0 C-N-CA 128.27 2.628 . . . . 1.0 115.871 174.263 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 16.1 ptm180 -149.65 177.43 9.77 Favored 'General case' 0 N--CA 1.43 -1.431 0 O-C-N 120.677 -1.265 . . . . 1.0 110.19 -174.007 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 3.4 t 78.58 -73.47 0.07 Allowed 'General case' 0 N--CA 1.43 -1.439 0 C-N-CA 126.802 2.041 . . . . 1.0 113.026 -175.701 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -170.89 104.1 0.2 Allowed Glycine 0 N--CA 1.43 -1.719 0 N-CA-C 108.845 -1.702 . . . . 1.0 108.845 -176.131 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 85' ' ' GLU . . . . . 0.417 ' HG3' ' H ' ' A' ' 85' ' ' GLU . 0.0 OUTLIER -63.41 105.26 0.73 Allowed 'General case' 0 N--CA 1.429 -1.513 0 N-CA-C 119.86 3.281 . . . . 1.0 119.86 -166.807 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -173.81 127.01 0.39 Allowed 'General case' 0 N--CA 1.43 -1.472 0 C-N-CA 124.718 1.207 . . . . 1.0 112.604 166.522 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 1.2 t80 -45.53 -89.5 0.0 OUTLIER 'General case' 0 N--CA 1.43 -1.44 0 N-CA-C 119.059 2.985 . . . . 1.0 119.059 178.187 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 88' ' ' TRP . . . . . . . . . . . . . 85.7 m95 -72.38 -26.07 61.75 Favored 'General case' 0 N--CA 1.43 -1.436 0 O-C-N 120.07 -1.644 . . . . 1.0 111.546 -166.702 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 6.8 m-20 -69.87 -45.73 67.07 Favored 'General case' 0 N--CA 1.43 -1.451 0 C-N-CA 125.476 1.51 . . . . 1.0 113.283 177.578 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 35.3 tp -69.66 -41.83 75.0 Favored 'General case' 0 N--CA 1.429 -1.521 0 O-C-N 119.557 -1.964 . . . . 1.0 111.523 176.278 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 33.5 tp -56.21 -40.75 74.53 Favored 'General case' 0 N--CA 1.429 -1.52 0 C-N-CA 124.846 1.258 . . . . 1.0 114.26 169.384 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 42.2 tt0 -55.24 -49.87 70.92 Favored 'General case' 0 N--CA 1.43 -1.461 0 C-N-CA 126.711 2.004 . . . . 1.0 112.021 172.379 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 2.1 mp0 -59.96 -46.88 87.98 Favored 'General case' 0 N--CA 1.43 -1.431 0 O-C-N 120.205 -1.559 . . . . 1.0 114.649 173.773 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 94' ' ' ALA . . . . . 0.436 ' HB2' HE22 ' A' ' 66' ' ' GLN . . . -62.87 -42.18 99.67 Favored 'General case' 0 N--CA 1.43 -1.456 0 N-CA-C 115.068 1.507 . . . . 1.0 115.068 177.833 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -80.2 -37.37 33.32 Favored 'General case' 0 N--CA 1.429 -1.497 0 O-C-N 120.268 -1.52 . . . . 1.0 114.043 -179.472 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 96' ' ' THR . . . . . 0.448 HG23 HG12 ' A' ' 103' ' ' VAL . 23.2 p -58.52 -38.51 77.87 Favored 'General case' 0 N--CA 1.43 -1.452 0 CA-C-N 120.663 1.574 . . . . 1.0 112.335 170.574 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 34.1 tp60 -59.44 -61.58 2.52 Favored 'General case' 0 N--CA 1.429 -1.484 0 C-N-CA 124.837 1.255 . . . . 1.0 113.354 172.425 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 4.4 mm-40 -64.25 -43.4 95.01 Favored 'General case' 0 N--CA 1.429 -1.496 0 N-CA-C 116.145 1.906 . . . . 1.0 116.145 -179.038 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -77.45 -31.82 54.08 Favored 'General case' 0 CA--C 1.489 -1.386 0 O-C-N 120.644 -1.285 . . . . 1.0 113.427 -178.017 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . 98.26 16.63 31.81 Favored Glycine 0 N--CA 1.428 -1.857 0 C-N-CA 124.568 1.08 . . . . 1.0 115.537 169.735 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 16.4 pt-20 -168.05 174.86 7.01 Favored 'General case' 0 N--CA 1.428 -1.562 0 N-CA-C 108.204 -1.036 . . . . 1.0 108.204 -172.403 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 25.8 m -66.35 121.73 15.91 Favored 'General case' 0 N--CA 1.431 -1.385 0 O-C-N 120.645 -1.285 . . . . 1.0 112.569 -177.268 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 103' ' ' VAL . . . . . 0.448 HG12 HG23 ' A' ' 96' ' ' THR . 4.7 p -97.83 137.14 26.25 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.508 0 N-CA-C 106.046 -1.835 . . . . 1.0 106.046 179.391 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 2.8 t -117.07 78.88 1.26 Allowed 'General case' 0 N--CA 1.431 -1.396 0 O-C-N 121.181 -0.949 . . . . 1.0 112.161 -162.638 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 61.9 m-85 -103.03 -35.55 8.5 Favored 'General case' 0 N--CA 1.429 -1.486 0 O-C-N 120.06 -1.65 . . . . 1.0 110.306 174.458 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 22.6 mtm180 . . . . . 0 C--O 1.259 1.598 0 C-N-CA 123.411 0.685 . . . . 1.0 110.043 -172.597 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 22.6 m120 . . . . . 0 N--CA 1.43 -1.471 0 CA-C-O 122.491 1.139 . . . . 1.0 112.647 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 8.3 p-10 -73.48 -29.2 62.37 Favored 'General case' 0 N--CA 1.43 -1.474 0 C-N-CA 125.19 1.396 . . . . 1.0 112.433 175.786 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 48.3 p -58.66 -52.17 66.84 Favored 'General case' 0 N--CA 1.43 -1.459 0 C-N-CA 125.762 1.625 . . . . 1.0 113.151 168.752 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 95.6 mt-10 -54.31 -54.07 45.34 Favored 'General case' 0 N--CA 1.428 -1.555 0 C-N-CA 126.822 2.049 . . . . 1.0 112.573 172.037 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 43.0 t80 -48.69 -46.94 41.14 Favored 'General case' 0 N--CA 1.429 -1.49 0 N-CA-C 115.343 1.609 . . . . 1.0 115.343 172.728 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -60.98 -51.54 68.83 Favored 'General case' 0 N--CA 1.43 -1.428 0 N-CA-C 113.838 1.051 . . . . 1.0 113.838 175.884 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 94.7 mtt180 -61.45 -40.61 95.12 Favored 'General case' 0 N--CA 1.429 -1.493 0 O-C-N 120.542 -1.349 . . . . 1.0 113.92 -179.724 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 72.5 mt -64.33 -45.35 88.23 Favored 'General case' 0 N--CA 1.43 -1.469 0 C-N-CA 125.402 1.481 . . . . 1.0 112.795 173.107 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -60.3 -51.04 71.23 Favored 'General case' 0 N--CA 1.43 -1.459 0 C-N-CA 125.898 1.679 . . . . 1.0 113.641 -179.407 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 -56.64 -49.21 75.68 Favored 'General case' 0 N--CA 1.429 -1.487 0 C-N-CA 124.267 1.027 . . . . 1.0 112.207 172.818 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . 0.315 5.9 pt20 -63.82 -44.73 92.38 Favored 'General case' 0 N--CA 1.431 -1.408 0 O-C-N 120.091 -1.631 . . . . 1.0 115.108 178.705 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 4.2 pp -65.34 -36.7 84.84 Favored 'General case' 0 N--CA 1.43 -1.469 0 CA-C-N 121.375 1.898 . . . . 1.0 115.019 -179.011 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 29.6 m0 -54.9 -60.41 3.4 Favored 'General case' 0 N--CA 1.43 -1.461 0 N-CA-C 113.507 0.929 . . . . 1.0 113.507 166.683 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 35.2 mt -63.67 -33.75 76.32 Favored 'General case' 0 N--CA 1.431 -1.413 0 CA-C-N 120.561 1.528 . . . . 1.0 114.593 -178.416 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 86.0 m -54.86 -59.98 3.99 Favored 'General case' 0 N--CA 1.431 -1.416 0 C-N-CA 125.475 1.51 . . . . 1.0 111.98 173.771 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 38.9 mm -62.12 -39.12 82.71 Favored 'Isoleucine or valine' 0 CA--C 1.489 -1.374 0 N-CA-C 114.596 1.332 . . . . 1.0 114.596 176.844 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 95.4 mt-10 -51.55 -52.33 48.05 Favored 'General case' 0 N--CA 1.43 -1.434 0 CA-C-N 121.434 1.925 . . . . 1.0 113.281 171.529 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 2.4 tp10 -65.4 -36.58 84.38 Favored 'General case' 0 N--CA 1.429 -1.489 0 N-CA-C 114.246 1.202 . . . . 1.0 114.246 -179.819 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 49.8 ttt-85 -54.0 -51.03 65.24 Favored 'General case' 0 N--CA 1.43 -1.465 0 O-C-N 120.793 -1.192 . . . . 1.0 113.053 170.521 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -70.07 -45.05 67.85 Favored 'General case' 0 N--CA 1.43 -1.436 0 N-CA-C 113.085 0.772 . . . . 1.0 113.085 178.302 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 34.8 t0 -55.18 -44.56 75.36 Favored 'General case' 0 N--CA 1.43 -1.449 0 C-N-CA 125.122 1.369 . . . . 1.0 114.075 178.987 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 32.1 t70 -71.04 -28.73 64.6 Favored 'General case' 0 N--CA 1.431 -1.409 0 O-C-N 120.052 -1.655 . . . . 1.0 113.472 177.678 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 24' ' ' TRP . . . . . . . . . . . . . 37.3 t-105 -71.28 149.33 46.26 Favored 'General case' 0 N--CA 1.43 -1.462 0 O-C-N 120.063 -1.648 . . . . 1.0 112.897 -177.831 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 6.8 m-20 -151.66 163.02 40.02 Favored 'General case' 0 N--CA 1.429 -1.488 0 N-CA-C 104.002 -2.592 . . . . 1.0 104.002 163.543 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -161.27 -132.6 1.36 Allowed Glycine 0 N--CA 1.43 -1.72 0 O-C-N 120.622 -1.299 . . . . 1.0 111.417 176.565 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -68.3 -32.6 72.86 Favored 'General case' 0 N--CA 1.43 -1.437 0 O-C-N 121.466 -1.02 . . . . 1.0 110.347 171.743 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 79.9 p -112.86 172.48 6.91 Favored 'General case' 0 N--CA 1.43 -1.452 0 C-N-CA 124.347 1.059 . . . . 1.0 111.212 177.046 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 2.9 t70 -96.12 -168.94 1.83 Allowed 'General case' 0 N--CA 1.43 -1.462 0 C-N-CA 124.811 1.244 . . . . 1.0 110.28 179.091 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 7.1 tp -163.37 119.73 0.15 Allowed 'Isoleucine or valine' 0 N--CA 1.43 -1.456 0 O-C-N 120.502 -1.374 . . . . 1.0 110.652 -169.19 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 37.7 t0 -135.84 108.25 7.35 Favored 'General case' 0 N--CA 1.43 -1.432 0 O-C-N 119.86 -1.775 . . . . 1.0 110.533 169.407 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 33.7 t -81.33 143.97 31.83 Favored 'General case' 0 N--CA 1.43 -1.438 0 O-C-N 119.033 -2.292 . . . . 1.0 112.049 173.012 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 33.4 mt-10 -90.16 139.22 30.84 Favored 'General case' 0 N--CA 1.43 -1.445 0 O-C-N 120.403 -1.436 . . . . 1.0 109.13 168.765 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 3.9 mp -126.28 105.68 14.75 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.425 0 N-CA-C 104.853 -2.277 . . . . 1.0 104.853 173.927 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 48.6 t30 -132.75 76.64 1.7 Allowed 'General case' 0 N--CA 1.429 -1.48 0 C-N-CA 124.882 1.273 . . . . 1.0 110.849 -167.171 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . 78.75 -73.15 2.31 Favored Glycine 0 N--CA 1.43 -1.754 0 O-C-N 120.963 -1.086 . . . . 1.0 115.453 167.343 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -142.93 27.53 2.17 Favored Glycine 0 N--CA 1.431 -1.684 0 C-N-CA 124.906 1.241 . . . . 1.0 110.432 172.116 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 76.4 t -125.44 136.22 61.54 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.419 0 C-N-CA 125.313 1.445 . . . . 1.0 107.198 177.216 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 72.7 mt -109.62 136.66 48.63 Favored 'General case' 0 N--CA 1.43 -1.431 0 N-CA-C 107.084 -1.45 . . . . 1.0 107.084 155.684 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -138.55 111.04 7.51 Favored 'General case' 0 N--CA 1.431 -1.393 0 N-CA-C 106.035 -1.839 . . . . 1.0 106.035 178.368 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 67.9 mt -89.74 126.35 42.65 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.432 0 O-C-N 120.32 -1.488 . . . . 1.0 109.684 -171.097 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 28.3 p -119.85 126.35 50.76 Favored 'General case' 0 N--CA 1.43 -1.435 0 CA-C-O 121.728 0.775 . . . . 1.0 113.004 179.896 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 43' ' ' PHE . . . . . . . . . . . . . 1.0 OUTLIER -122.96 170.27 10.3 Favored 'General case' 0 N--CA 1.43 -1.444 0 O-C-N 120.27 -1.519 . . . . 1.0 112.302 169.909 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 4.4 mm-40 -48.41 -36.75 15.38 Favored 'General case' 0 N--CA 1.429 -1.488 0 N-CA-C 118.557 2.799 . . . . 1.0 118.557 -171.439 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 47.1 m-80 -68.86 -6.0 24.52 Favored 'General case' 0 N--CA 1.43 -1.474 0 N-CA-C 115.535 1.68 . . . . 1.0 115.535 179.716 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 80.24 30.54 41.27 Favored Glycine 0 N--CA 1.43 -1.757 0 O-C-N 120.579 -1.325 . . . . 1.0 112.791 172.142 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 51.0 m -127.12 149.52 49.91 Favored 'General case' 0 N--CA 1.43 -1.46 0 N-CA-C 105.168 -2.16 . . . . 1.0 105.168 -177.571 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 22.8 pttm -140.53 159.07 43.0 Favored 'General case' 0 N--CA 1.431 -1.404 0 N-CA-C 113.826 1.047 . . . . 1.0 113.826 -165.136 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 12.7 mm -110.61 138.56 38.1 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.471 0 N-CA-C 106.195 -1.78 . . . . 1.0 106.195 177.1 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 5.5 mm -120.77 114.91 45.3 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.414 0 CA-C-N 119.937 1.244 . . . . 1.0 110.787 -173.562 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER -125.68 89.26 1.39 Allowed 'Isoleucine or valine' 0 N--CA 1.43 -1.459 0 C-N-CA 126.187 1.795 . . . . 1.0 110.468 -172.565 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 52' ' ' ASN . . . . . 0.425 ' H ' ' HD1' ' A' ' 61' ' ' TRP . 51.3 m-20 -114.25 161.74 17.46 Favored 'General case' 0 N--CA 1.43 -1.448 0 C-N-CA 128.725 2.81 . . . . 1.0 110.239 178.545 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -154.31 151.54 29.22 Favored 'General case' 0 N--CA 1.43 -1.455 0 O-C-N 119.91 -1.744 . . . . 1.0 112.319 -168.666 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -100.33 144.17 29.65 Favored 'General case' 0 N--CA 1.43 -1.433 0 CA-C-O 123.426 1.584 . . . . 1.0 108.192 174.977 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 54.3 mt-10 -70.75 -63.55 1.56 Allowed Pre-proline 0 N--CA 1.431 -1.418 0 CA-C-O 116.034 -1.936 . . . . 1.0 114.479 172.163 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 87.3 Cg_endo -78.85 157.9 27.58 Favored 'Trans proline' 0 C--N 1.3 -1.984 0 CA-C-N 126.135 3.227 . . . . 1.0 112.622 169.959 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . 0.409 5.1 mp 72.18 134.94 0.04 OUTLIER 'General case' 0 N--CA 1.43 -1.456 0 C-N-CA 127.266 2.226 . . . . 1.0 113.588 -165.616 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 17.5 m170 -83.8 50.77 1.88 Allowed 'General case' 0 N--CA 1.431 -1.411 0 O-C-N 120.668 -1.27 . . . . 1.0 112.853 -172.596 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -152.28 158.95 43.51 Favored 'General case' 0 N--CA 1.43 -1.428 0 O-C-N 120.382 -1.449 . . . . 1.0 109.43 -178.401 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 38.2 t -126.5 161.63 32.28 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.438 0 C-N-CA 125.528 1.531 . . . . 1.0 108.55 -169.182 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 61' ' ' TRP . . . . . 0.425 ' HD1' ' H ' ' A' ' 52' ' ' ASN . 0.0 OUTLIER -93.52 154.78 17.7 Favored 'General case' 0 N--CA 1.431 -1.413 0 O-C-N 118.792 -2.443 . . . . 1.0 111.028 177.3 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -142.5 101.41 3.88 Favored 'General case' 0 N--CA 1.431 -1.409 0 O-C-N 118.362 -2.711 . . . . 1.0 112.687 169.55 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -112.22 149.62 32.03 Favored 'General case' 0 N--CA 1.43 -1.467 0 O-C-N 119.494 -2.003 . . . . 1.0 114.61 174.313 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 64' ' ' THR . . . . . . . . . . . . . 95.1 m -151.89 -87.12 0.07 Allowed 'General case' 0 N--CA 1.43 -1.436 0 C-N-CA 126.186 1.794 . . . . 1.0 109.977 -179.891 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -131.23 -54.77 1.04 Allowed 'General case' 0 N--CA 1.43 -1.445 0 O-C-N 121.139 -0.976 . . . . 1.0 113.184 -170.556 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 58.8 mt-30 -71.08 -24.75 62.38 Favored 'General case' 0 N--CA 1.431 -1.418 0 N-CA-C 114.639 1.348 . . . . 1.0 114.639 -171.003 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 177.09 -40.42 0.1 OUTLIER Glycine 0 N--CA 1.429 -1.811 0 C-N-CA 117.753 -2.165 . . . . 1.0 115.588 174.207 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 98.8 106.62 2.65 Favored Glycine 0 N--CA 1.43 -1.745 0 CA-C-O 122.557 1.087 . . . . 1.0 111.978 -173.96 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 14.8 m-85 -128.5 135.77 49.89 Favored 'General case' 0 N--CA 1.43 -1.459 0 N-CA-C 105.802 -1.925 . . . . 1.0 105.802 -167.939 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 70' ' ' HIS . . . . . 0.458 ' HE1' ' OD2' ' A' ' 81' ' ' ASP . 27.2 p80 -83.42 159.8 21.71 Favored 'General case' 0 N--CA 1.43 -1.467 0 O-C-N 119.826 -1.796 . . . . 1.0 112.881 179.905 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 71' ' ' PHE . . . . . . . . . . . . 0.321 24.5 t80 -117.9 112.46 20.37 Favored 'General case' 0 N--CA 1.43 -1.428 0 C-N-CA 127.653 2.381 . . . . 1.0 105.185 -156.875 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -126.45 165.55 18.88 Favored 'General case' 0 N--CA 1.431 -1.394 0 N-CA-C 107.574 -1.269 . . . . 1.0 107.574 -169.689 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 51.4 tp -112.06 124.81 53.21 Favored 'General case' 0 N--CA 1.43 -1.451 0 O-C-N 119.528 -1.982 . . . . 1.0 110.434 -169.963 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 6.2 tmtt? -74.64 -58.73 3.1 Favored 'General case' 0 N--CA 1.429 -1.478 0 O-C-N 121.322 -0.861 . . . . 1.0 109.599 162.277 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -179.3 -61.65 0.07 OUTLIER Glycine 0 N--CA 1.43 -1.716 0 O-C-N 121.098 -1.001 . . . . 1.0 111.551 179.033 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 24.1 t0 -99.32 -18.21 17.66 Favored 'General case' 0 N--CA 1.43 -1.425 0 C-N-CA 126.108 1.763 . . . . 1.0 110.141 179.075 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 1.1 tp10 -130.09 128.43 41.86 Favored 'General case' 0 N--CA 1.431 -1.415 0 N-CA-C 103.377 -2.823 . . . . 1.0 103.377 -170.711 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 78' ' ' TRP . . . . . . . . . . . . . 91.7 m95 -77.47 129.55 35.87 Favored 'General case' 0 N--CA 1.429 -1.481 0 N-CA-C 105.364 -2.088 . . . . 1.0 105.364 162.498 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 79' ' ' ILE . . . . . 0.455 ' HB ' ' HB2' ' A' ' 85' ' ' GLU . 0.1 OUTLIER -131.34 153.24 38.65 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.377 0 O-C-N 119.976 -1.703 . . . . 1.0 106.865 -173.876 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 5.2 m -80.55 132.37 35.65 Favored 'General case' 0 N--CA 1.429 -1.488 0 O-C-N 119.873 -1.767 . . . . 1.0 112.922 -172.378 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 81' ' ' ASP . . . . . 0.458 ' OD2' ' HE1' ' A' ' 70' ' ' HIS . 24.0 t70 -86.61 62.8 7.63 Favored 'General case' 0 N--CA 1.431 -1.42 0 O-C-N 118.928 -2.357 . . . . 1.0 110.932 177.32 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -155.71 -135.73 0.05 OUTLIER 'General case' 0 N--CA 1.43 -1.441 0 O-C-N 120.608 -1.307 . . . . 1.0 111.858 -176.027 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 35.1 p -86.0 -12.44 50.32 Favored 'General case' 0 N--CA 1.428 -1.551 0 O-C-N 119.347 -2.096 . . . . 1.0 113.887 -170.524 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -161.93 92.32 0.11 Allowed Glycine 0 N--CA 1.429 -1.768 0 O-C-N 120.684 -1.26 . . . . 1.0 113.331 -177.534 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 85' ' ' GLU . . . . . 0.455 ' HB2' ' HB ' ' A' ' 79' ' ' ILE . 8.2 pt-20 -77.55 113.41 15.35 Favored 'General case' 0 N--CA 1.431 -1.398 0 N-CA-C 119.014 2.968 . . . . 1.0 119.014 -169.845 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 86.1 m -174.46 125.25 0.31 Allowed 'General case' 0 N--CA 1.431 -1.422 0 C-N-CA 126.315 1.846 . . . . 1.0 110.574 161.775 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 2.0 t80 -52.77 -84.21 0.01 OUTLIER 'General case' 0 N--CA 1.429 -1.508 0 N-CA-C 115.378 1.621 . . . . 1.0 115.378 170.265 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 88' ' ' TRP . . . . . . . . . . . . . 56.0 m95 -58.95 -29.43 67.15 Favored 'General case' 0 N--CA 1.43 -1.445 0 N-CA-C 116.283 1.957 . . . . 1.0 116.283 -166.1 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 24.0 m-20 -76.99 -41.35 43.25 Favored 'General case' 0 N--CA 1.429 -1.479 0 C-N-CA 124.489 1.116 . . . . 1.0 112.254 175.668 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 41.9 tp -69.65 -43.23 73.03 Favored 'General case' 0 N--CA 1.43 -1.425 0 O-C-N 119.521 -1.987 . . . . 1.0 111.88 176.249 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 2.6 tm? -48.38 -50.69 29.71 Favored 'General case' 0 N--CA 1.43 -1.471 0 C-N-CA 128.941 2.896 . . . . 1.0 113.08 172.608 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 37.5 tt0 -51.66 -54.44 27.96 Favored 'General case' 0 N--CA 1.431 -1.423 0 C-N-CA 125.823 1.649 . . . . 1.0 114.547 166.852 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 4.1 tt0 -58.5 -44.73 89.54 Favored 'General case' 0 N--CA 1.43 -1.471 0 N-CA-C 114.372 1.249 . . . . 1.0 114.372 179.929 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -58.75 -48.49 81.03 Favored 'General case' 0 N--CA 1.431 -1.412 0 C-N-CA 127.53 2.332 . . . . 1.0 113.554 174.895 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -64.89 -46.56 81.24 Favored 'General case' 0 N--CA 1.429 -1.483 0 O-C-N 119.426 -2.046 . . . . 1.0 113.131 176.191 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 96.5 m -53.61 -48.89 68.87 Favored 'General case' 0 N--CA 1.431 -1.409 0 C-N-CA 127.224 2.21 . . . . 1.0 114.176 174.037 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 2.1 pt20 -70.18 -28.02 64.98 Favored 'General case' 0 N--CA 1.43 -1.45 0 O-C-N 121.061 -1.025 . . . . 1.0 113.607 -178.911 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 15.7 mm-40 -75.91 -39.02 57.13 Favored 'General case' 0 N--CA 1.43 -1.459 0 N-CA-C 114.309 1.226 . . . . 1.0 114.309 171.988 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -85.85 -46.58 10.49 Favored 'General case' 0 N--CA 1.43 -1.461 0 O-C-N 120.229 -1.545 . . . . 1.0 114.963 -176.436 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . 91.28 43.25 4.7 Favored Glycine 0 N--CA 1.43 -1.745 0 O-C-N 120.418 -1.426 . . . . 1.0 112.55 -170.825 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 18.6 tt0 -170.04 145.75 2.93 Favored 'General case' 0 N--CA 1.43 -1.455 0 N-CA-C 103.712 -2.699 . . . . 1.0 103.712 -172.865 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 13.4 m -74.49 99.95 3.72 Favored 'General case' 0 N--CA 1.429 -1.484 0 CA-C-N 121.792 2.087 . . . . 1.0 111.033 179.282 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 12.2 t -95.36 84.1 1.55 Allowed 'Isoleucine or valine' 0 N--CA 1.432 -1.362 0 CA-C-O 124.231 1.967 . . . . 1.0 107.953 178.769 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 8.2 t -92.36 177.07 6.25 Favored 'General case' 0 N--CA 1.43 -1.438 0 C-N-CA 125.718 1.607 . . . . 1.0 112.695 -168.259 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 30.8 t80 -138.58 -29.32 0.8 Allowed 'General case' 0 N--CA 1.43 -1.434 0 O-C-N 120.83 -1.169 . . . . 1.0 111.04 156.83 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 89.1 mtt180 . . . . . 0 C--O 1.26 1.634 0 O-C-N 120.368 -1.457 . . . . 1.0 110.437 179.27 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 91.9 m-20 . . . . . 0 N--CA 1.431 -1.416 0 CA-C-O 121.843 0.83 . . . . 1.0 109.995 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 22.5 m-20 -65.78 -39.16 90.72 Favored 'General case' 0 N--CA 1.429 -1.477 0 C-N-CA 125.272 1.429 . . . . 1.0 113.581 179.131 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 8.6 t -65.07 -43.29 92.7 Favored 'General case' 0 N--CA 1.43 -1.473 0 O-C-N 120.951 -1.093 . . . . 1.0 111.786 -178.854 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 14.0 mt-10 -58.36 -60.83 3.16 Favored 'General case' 0 N--CA 1.429 -1.483 0 C-N-CA 124.694 1.197 . . . . 1.0 112.364 171.148 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 1.1 t80 -53.26 -38.48 63.06 Favored 'General case' 0 N--CA 1.43 -1.425 0 N-CA-C 115.911 1.819 . . . . 1.0 115.911 179.229 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 2.5 m-70 -61.18 -50.56 72.66 Favored 'General case' 0 N--CA 1.43 -1.439 0 N-CA-C 115.524 1.676 . . . . 1.0 115.524 170.224 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 23.1 ttm180 -67.81 -45.38 74.91 Favored 'General case' 0 N--CA 1.43 -1.47 0 C-N-CA 124.17 0.988 . . . . 1.0 112.207 -176.106 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 83.4 mt -55.26 -45.59 76.12 Favored 'General case' 0 N--CA 1.43 -1.464 0 C-N-CA 126.507 1.923 . . . . 1.0 113.611 172.367 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -56.84 -55.49 33.77 Favored 'General case' 0 N--CA 1.43 -1.467 0 C-N-CA 125.27 1.428 . . . . 1.0 113.152 173.949 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -56.3 -43.53 79.01 Favored 'General case' 0 N--CA 1.431 -1.415 0 C-N-CA 124.228 1.011 . . . . 1.0 112.617 -176.05 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 28.3 mm100 -63.4 -53.86 45.76 Favored 'General case' 0 N--CA 1.43 -1.441 0 N-CA-C 115.165 1.542 . . . . 1.0 115.165 173.846 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 2.4 pp -65.2 -47.18 77.79 Favored 'General case' 0 N--CA 1.43 -1.443 0 O-C-N 120.387 -1.446 . . . . 1.0 114.272 -177.697 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 39.8 m0 -52.87 -50.04 64.61 Favored 'General case' 0 N--CA 1.43 -1.468 0 C-N-CA 126.953 2.101 . . . . 1.0 113.447 174.256 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 44.0 tp -60.79 -49.34 77.87 Favored 'General case' 0 N--CA 1.429 -1.517 0 C-N-CA 123.651 0.78 . . . . 1.0 112.719 177.49 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 36.5 m -59.11 -53.15 61.63 Favored 'General case' 0 N--CA 1.431 -1.398 0 C-N-CA 125.818 1.647 . . . . 1.0 113.276 -178.676 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 78.8 mt -57.64 -54.1 35.87 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.464 0 C-N-CA 125.839 1.656 . . . . 1.0 114.169 174.989 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 31.8 tt0 -60.18 -48.42 81.82 Favored 'General case' 0 N--CA 1.429 -1.496 0 CA-C-N 120.072 1.306 . . . . 1.0 113.117 -177.774 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 42.9 tt0 -57.85 -48.57 79.41 Favored 'General case' 0 N--CA 1.429 -1.511 0 C-N-CA 125.102 1.361 . . . . 1.0 114.164 178.144 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -71.15 -29.64 65.48 Favored 'General case' 0 N--CA 1.43 -1.456 0 N-CA-C 113.056 0.761 . . . . 1.0 113.056 -177.548 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 5.3 tp -67.14 -50.92 59.59 Favored 'General case' 0 N--CA 1.43 -1.446 0 O-C-N 120.919 -1.113 . . . . 1.0 112.597 171.393 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 11.3 t70 -62.31 -36.42 82.1 Favored 'General case' 0 N--CA 1.429 -1.507 0 O-C-N 121.023 -1.048 . . . . 1.0 112.889 -177.425 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 21.2 t0 -90.81 21.89 3.88 Favored 'General case' 0 N--CA 1.43 -1.438 0 O-C-N 120.486 -1.384 . . . . 1.0 113.847 177.515 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 24' ' ' TRP . . . . . . . . . . . . . 47.0 t-105 -84.56 -59.7 2.29 Favored 'General case' 0 N--CA 1.43 -1.452 0 O-C-N 119.025 -2.297 . . . . 1.0 113.691 -179.445 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 7.0 t70 67.03 -132.0 0.14 Allowed 'General case' 0 N--CA 1.43 -1.453 0 C-N-CA 126.784 2.034 . . . . 1.0 112.603 -176.32 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 93.1 -138.38 14.09 Favored Glycine 0 N--CA 1.43 -1.709 0 O-C-N 120.737 -1.227 . . . . 1.0 112.691 176.116 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -82.23 -26.27 33.4 Favored 'General case' 0 N--CA 1.429 -1.489 0 O-C-N 120.592 -1.534 . . . . 1.0 109.79 172.589 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 4.4 p -75.36 144.27 42.4 Favored 'General case' 0 N--CA 1.429 -1.498 0 C-N-CA 126.506 1.923 . . . . 1.0 114.434 174.642 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 29' ' ' ASP . . . . . 0.41 ' H ' ' HG2' ' A' ' 44' ' ' GLU . 13.8 t70 -104.36 138.43 40.8 Favored 'General case' 0 N--CA 1.43 -1.469 0 N-CA-C 104.137 -2.542 . . . . 1.0 104.137 162.925 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -146.15 115.48 1.47 Allowed 'Isoleucine or valine' 0 N--CA 1.429 -1.481 0 CA-C-O 122.84 1.305 . . . . 1.0 108.62 -157.653 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 13.8 m-20 -126.47 143.3 51.24 Favored 'General case' 0 N--CA 1.429 -1.493 0 C-N-CA 124.103 0.961 . . . . 1.0 109.291 168.625 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 17.8 t -109.67 149.9 29.05 Favored 'General case' 0 N--CA 1.43 -1.432 0 O-C-N 119.832 -1.793 . . . . 1.0 108.203 164.627 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 17.2 mt-10 -113.65 142.39 46.06 Favored 'General case' 0 N--CA 1.429 -1.511 0 O-C-N 120.829 -1.169 . . . . 1.0 108.113 176.822 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 3.3 tp -122.47 110.34 26.62 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.484 0 CA-C-O 124.086 1.898 . . . . 1.0 107.259 -178.099 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 48.3 m-80 -108.95 73.75 0.87 Allowed 'General case' 0 N--CA 1.431 -1.396 0 CA-C-N 114.477 -1.238 . . . . 1.0 109.088 176.677 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . 73.35 -7.65 11.3 Favored Glycine 0 N--CA 1.43 -1.761 0 N-CA-C 117.618 1.807 . . . . 1.0 117.618 171.503 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 151.91 -33.7 0.87 Allowed Glycine 0 N--CA 1.43 -1.764 0 N-CA-C 109.127 -1.589 . . . . 1.0 109.127 -168.734 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 64.7 t -79.27 105.94 9.47 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.43 0 O-C-N 120.397 -1.649 . . . . 1.0 109.595 175.5 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 18.5 mt -94.8 129.16 41.87 Favored 'General case' 0 N--CA 1.43 -1.464 0 CA-C-O 123.074 1.416 . . . . 1.0 110.206 175.667 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 18.6 p -126.52 121.89 33.61 Favored 'General case' 0 N--CA 1.43 -1.455 0 N-CA-C 107.358 -1.349 . . . . 1.0 107.358 -179.713 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 74.2 mt -97.2 122.28 48.59 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.479 0 C-N-CA 124.721 1.208 . . . . 1.0 109.32 -169.866 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 21.8 p -123.74 108.38 12.46 Favored 'General case' 0 N--CA 1.431 -1.396 0 N-CA-C 114.863 1.431 . . . . 1.0 114.863 -171.55 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 43' ' ' PHE . . . . . . . . . . . . . 9.0 p90 -114.55 164.86 13.42 Favored 'General case' 0 N--CA 1.429 -1.49 0 O-C-N 119.633 -1.917 . . . . 1.0 113.894 178.75 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 44' ' ' GLU . . . . . 0.41 ' HG2' ' H ' ' A' ' 29' ' ' ASP . 0.5 OUTLIER -61.76 -20.18 63.27 Favored 'General case' 0 N--CA 1.43 -1.442 0 C-N-CA 128.77 2.828 . . . . 1.0 118.371 -166.779 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 22.5 t30 -66.69 -15.08 63.26 Favored 'General case' 0 N--CA 1.429 -1.491 0 C-N-CA 124.674 1.19 . . . . 1.0 113.618 173.583 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 101.48 -5.25 54.72 Favored Glycine 0 N--CA 1.431 -1.686 0 O-C-N 120.508 -1.37 . . . . 1.0 113.066 171.197 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 70.0 m -93.73 159.28 15.28 Favored 'General case' 0 N--CA 1.43 -1.425 0 O-C-N 121.467 -1.02 . . . . 1.0 111.33 178.493 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 24.0 pttm -142.29 140.08 32.08 Favored 'General case' 0 N--CA 1.429 -1.497 0 O-C-N 121.526 -0.734 . . . . 1.0 111.566 -178.784 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -108.45 143.95 17.88 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.453 0 C-N-CA 126.701 2.0 . . . . 1.0 107.572 179.549 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 9.7 mm -126.38 122.43 61.21 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.458 0 C-N-CA 124.227 1.011 . . . . 1.0 110.816 -163.33 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 3.7 mt -124.61 108.18 19.79 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.428 0 CA-C-O 123.328 1.537 . . . . 1.0 112.874 -179.77 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 52' ' ' ASN . . . . . 0.444 ' H ' ' HD1' ' A' ' 61' ' ' TRP . 29.1 m-80 -120.44 160.63 22.73 Favored 'General case' 0 N--CA 1.429 -1.481 0 C-N-CA 128.224 2.61 . . . . 1.0 108.445 173.497 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 10.3 ptt180 -141.68 140.21 33.15 Favored 'General case' 0 N--CA 1.43 -1.453 0 C-N-CA 124.713 1.205 . . . . 1.0 111.737 174.083 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 24.6 mm100 -110.02 114.46 28.01 Favored 'General case' 0 N--CA 1.431 -1.406 0 C-N-CA 126.004 1.722 . . . . 1.0 108.522 174.558 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 54.8 mt-10 -48.09 -47.48 65.37 Favored Pre-proline 0 N--CA 1.431 -1.414 0 N-CA-C 119.479 3.14 . . . . 1.0 119.479 -175.548 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 50.9 Cg_exo -73.01 -11.41 25.4 Favored 'Trans proline' 0 N--CA 1.434 -2.021 0 CA-C-N 126.022 3.186 . . . . 1.0 114.829 -175.468 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 38.5 mt -84.18 -39.67 19.09 Favored 'General case' 0 N--CA 1.43 -1.443 0 CA-C-N 119.269 0.941 . . . . 1.0 111.191 -174.977 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 19.8 m80 71.33 23.73 3.91 Favored 'General case' 0 CA--C 1.488 -1.433 0 C-N-CA 125.448 1.499 . . . . 1.0 113.866 -179.423 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 1.7 pt20 -131.32 156.58 45.24 Favored 'General case' 0 N--CA 1.429 -1.483 0 C-N-CA 127.898 2.479 . . . . 1.0 106.072 172.903 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 48.0 t -116.41 158.19 16.98 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.43 0 O-C-N 121.185 -0.947 . . . . 1.0 108.687 -171.732 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 61' ' ' TRP . . . . . 0.444 ' HD1' ' H ' ' A' ' 52' ' ' ASN . 0.0 OUTLIER -101.67 152.55 20.7 Favored 'General case' 0 N--CA 1.43 -1.436 0 O-C-N 119.831 -1.793 . . . . 1.0 114.194 176.018 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 93.7 mt -125.83 97.99 5.36 Favored 'General case' 0 N--CA 1.428 -1.55 0 C-N-CA 125.957 1.703 . . . . 1.0 109.056 164.71 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 63' ' ' ALA . . . . . 0.406 ' HA ' ' HA2' ' A' ' 68' ' ' GLY . . . -94.49 141.75 28.23 Favored 'General case' 0 N--CA 1.43 -1.44 0 O-C-N 120.285 -1.509 . . . . 1.0 110.478 167.451 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 64' ' ' THR . . . . . . . . . . . . . 74.5 p -142.49 -119.71 0.1 Allowed 'General case' 0 N--CA 1.43 -1.452 0 C-N-CA 124.79 1.236 . . . . 1.0 108.223 -165.43 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 3.5 tmtt? -101.53 -40.83 6.85 Favored 'General case' 0 N--CA 1.431 -1.419 0 O-C-N 120.503 -1.373 . . . . 1.0 109.717 170.134 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 51.2 tt0 -74.22 -25.93 59.95 Favored 'General case' 0 N--CA 1.429 -1.484 0 N-CA-C 116.863 2.171 . . . . 1.0 116.863 -164.101 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 157.7 -34.99 0.54 Allowed Glycine 0 N--CA 1.43 -1.728 0 O-C-N 119.585 -1.947 . . . . 1.0 115.65 175.501 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 68' ' ' GLY . . . . . 0.406 ' HA2' ' HA ' ' A' ' 63' ' ' ALA . . . 117.17 115.05 2.76 Favored Glycine 0 N--CA 1.429 -1.775 0 C-N-CA 125.625 1.583 . . . . 1.0 112.806 -179.19 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -104.34 142.81 33.9 Favored 'General case' 0 N--CA 1.43 -1.445 0 C-N-CA 125.498 1.519 . . . . 1.0 106.963 175.444 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 15.3 p80 -109.25 152.79 24.74 Favored 'General case' 0 N--CA 1.43 -1.438 0 O-C-N 119.082 -2.262 . . . . 1.0 110.545 165.68 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 48.8 p90 -129.77 131.37 46.21 Favored 'General case' 0 N--CA 1.43 -1.472 0 N-CA-C 113.975 1.102 . . . . 1.0 113.975 -166.068 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 32.7 m-20 -110.01 169.7 8.55 Favored 'General case' 0 N--CA 1.429 -1.49 0 C-N-CA 126.356 1.863 . . . . 1.0 109.21 -176.197 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 50.9 tp -115.97 114.22 24.32 Favored 'General case' 0 N--CA 1.43 -1.447 0 O-C-N 119.984 -1.698 . . . . 1.0 110.584 -178.164 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 18.5 mttm -71.05 -60.21 2.36 Favored 'General case' 0 N--CA 1.431 -1.408 0 O-C-N 120.124 -1.61 . . . . 1.0 112.984 164.729 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -171.56 -73.65 0.04 OUTLIER Glycine 0 N--CA 1.429 -1.775 0 O-C-N 120.622 -1.299 . . . . 1.0 113.518 -179.38 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 4.2 t70 -107.34 26.98 9.54 Favored 'General case' 0 N--CA 1.43 -1.45 0 CA-C-O 123.141 1.448 . . . . 1.0 107.831 174.615 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 1.7 pm0 -161.19 116.71 2.14 Favored 'General case' 0 N--CA 1.43 -1.427 0 N-CA-C 105.205 -2.146 . . . . 1.0 105.205 -168.949 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 78' ' ' TRP . . . . . . . . . . . . . 97.0 m95 -80.95 130.51 35.06 Favored 'General case' 0 N--CA 1.429 -1.505 0 N-CA-C 105.011 -2.218 . . . . 1.0 105.011 162.206 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -126.36 135.32 64.14 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.482 0 O-C-N 119.529 -1.982 . . . . 1.0 108.041 -171.325 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 30.1 m -84.38 122.14 28.52 Favored 'General case' 0 N--CA 1.43 -1.46 0 O-C-N 120.05 -1.656 . . . . 1.0 114.553 -171.275 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 13.2 t70 -84.86 55.21 3.36 Favored 'General case' 0 N--CA 1.429 -1.489 0 O-C-N 119.757 -1.84 . . . . 1.0 112.608 -177.228 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 1.1 tmt_? -148.38 81.7 1.47 Allowed 'General case' 0 N--CA 1.43 -1.428 0 O-C-N 120.36 -1.463 . . . . 1.0 107.347 179.884 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 83' ' ' SER . . . . . . . . . . . . 0.268 16.3 m 79.23 -44.69 0.34 Allowed 'General case' 0 N--CA 1.429 -1.488 0 C-N-CA 127.397 2.279 . . . . 1.0 116.754 175.117 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -159.48 103.19 0.22 Allowed Glycine 0 N--CA 1.431 -1.693 0 N-CA-C 109.128 -1.589 . . . . 1.0 109.128 -167.063 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 1.8 pm0 -87.43 105.97 17.65 Favored 'General case' 0 N--CA 1.429 -1.521 0 N-CA-C 119.424 3.12 . . . . 1.0 119.424 -153.421 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 7.3 m -160.74 122.53 3.08 Favored 'General case' 0 N--CA 1.43 -1.434 0 O-C-N 118.8 -2.438 . . . . 1.0 112.34 174.823 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 41.5 t80 -63.35 -80.17 0.03 OUTLIER 'General case' 0 N--CA 1.43 -1.46 0 N-CA-C 117.254 2.316 . . . . 1.0 117.254 -176.614 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 88' ' ' TRP . . . . . . . . . . . . . 72.6 m95 -63.21 -24.46 67.89 Favored 'General case' 0 N--CA 1.43 -1.432 0 O-C-N 120.442 -1.411 . . . . 1.0 113.892 -169.809 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 1.3 t70 -79.37 -42.76 24.86 Favored 'General case' 0 N--CA 1.428 -1.531 0 C-N-CA 125.87 1.668 . . . . 1.0 113.049 178.568 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 38.5 tp -69.49 -40.2 77.19 Favored 'General case' 0 N--CA 1.431 -1.417 0 O-C-N 119.137 -2.227 . . . . 1.0 111.135 175.514 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 21.4 tp -51.37 -41.4 60.62 Favored 'General case' 0 N--CA 1.43 -1.434 0 C-N-CA 126.926 2.09 . . . . 1.0 114.85 168.049 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 2.0 tm-20 -61.33 -46.42 90.32 Favored 'General case' 0 N--CA 1.43 -1.426 0 C-N-CA 125.627 1.571 . . . . 1.0 113.31 171.085 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 15.4 tt0 -60.96 -46.04 92.31 Favored 'General case' 0 N--CA 1.429 -1.477 0 O-C-N 120.785 -1.197 . . . . 1.0 113.09 176.209 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -58.16 -36.99 73.82 Favored 'General case' 0 N--CA 1.43 -1.425 0 C-N-CA 127.001 2.12 . . . . 1.0 114.703 172.101 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 95' ' ' ALA . . . . . 0.585 ' HB1' ' HB ' ' A' ' 103' ' ' VAL . . . -75.31 -41.34 57.14 Favored 'General case' 0 N--CA 1.428 -1.542 0 O-C-N 119.787 -1.821 . . . . 1.0 113.09 178.42 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 29.8 m -58.23 -28.5 64.92 Favored 'General case' 0 N--CA 1.429 -1.509 0 C-N-CA 126.809 2.044 . . . . 1.0 112.954 169.912 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -69.94 -55.93 8.37 Favored 'General case' 0 N--CA 1.431 -1.413 0 C-N-CA 127.706 2.402 . . . . 1.0 111.891 171.672 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 47.5 mt-30 -75.14 -40.47 59.64 Favored 'General case' 0 N--CA 1.43 -1.453 0 N-CA-C 115.829 1.788 . . . . 1.0 115.829 -175.868 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -81.24 -36.02 30.48 Favored 'General case' 0 N--CA 1.431 -1.402 0 O-C-N 120.376 -1.453 . . . . 1.0 112.619 -179.241 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . 79.44 36.0 27.89 Favored Glycine 0 N--CA 1.429 -1.824 0 O-C-N 120.972 -1.08 . . . . 1.0 111.782 -173.551 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 19.4 tt0 -170.79 145.98 2.52 Favored 'General case' 0 N--CA 1.429 -1.496 0 N-CA-C 103.93 -2.619 . . . . 1.0 103.93 -168.911 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 57.4 m -72.25 97.12 1.93 Allowed 'General case' 0 N--CA 1.429 -1.476 0 CA-C-N 120.851 1.66 . . . . 1.0 111.883 178.957 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 103' ' ' VAL . . . . . 0.585 ' HB ' ' HB1' ' A' ' 95' ' ' ALA . 85.6 t -95.91 106.7 18.65 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.434 0 N-CA-C 106.314 -1.735 . . . . 1.0 106.314 171.802 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 35.6 p -132.24 136.89 47.3 Favored 'General case' 0 N--CA 1.429 -1.497 0 C-N-CA 124.171 0.988 . . . . 1.0 109.995 -171.862 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 37.2 m-85 -93.68 -10.35 34.75 Favored 'General case' 0 N--CA 1.43 -1.429 0 C-N-CA 124.265 1.026 . . . . 1.0 112.129 178.904 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 9.7 mmm180 . . . . . 0 C--O 1.26 1.63 0 C-N-CA 124.489 1.116 . . . . 1.0 109.332 177.582 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 7.1 p30 . . . . . 0 N--CA 1.43 -1.458 0 N-CA-C 113.842 1.053 . . . . 1.0 113.842 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 35.3 t70 -55.92 -40.08 72.59 Favored 'General case' 0 N--CA 1.429 -1.479 0 C-N-CA 127.125 2.17 . . . . 1.0 113.46 -178.543 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 5.2 p -68.49 -37.94 80.55 Favored 'General case' 0 N--CA 1.43 -1.467 0 C-N-CA 126.274 1.83 . . . . 1.0 114.359 174.972 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 5' ' ' GLU . . . . . 0.452 ' HG2' ' HE1' ' A' ' 58' ' ' HIS . 14.2 tp10 -67.74 -53.06 30.44 Favored 'General case' 0 N--CA 1.43 -1.435 0 C-N-CA 125.226 1.41 . . . . 1.0 110.115 177.925 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 16.3 t80 -47.25 -50.94 20.17 Favored 'General case' 0 N--CA 1.431 -1.425 0 C-N-CA 127.425 2.29 . . . . 1.0 114.821 169.657 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 35.2 m-70 -63.97 -41.43 97.56 Favored 'General case' 0 N--CA 1.43 -1.452 0 N-CA-C 114.907 1.447 . . . . 1.0 114.907 177.989 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -70.76 -37.19 73.38 Favored 'General case' 0 N--CA 1.43 -1.435 0 O-C-N 120.366 -1.459 . . . . 1.0 114.074 178.887 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 79.7 mt -59.58 -51.55 69.37 Favored 'General case' 0 N--CA 1.43 -1.444 0 C-N-CA 124.99 1.316 . . . . 1.0 111.747 168.239 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -54.06 -50.34 66.95 Favored 'General case' 0 N--CA 1.431 -1.416 0 C-N-CA 125.011 1.324 . . . . 1.0 113.458 176.991 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -51.58 -49.71 61.57 Favored 'General case' 0 N--CA 1.43 -1.425 0 N-CA-C 114.783 1.401 . . . . 1.0 114.783 173.136 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 12.2 pt20 -68.9 -33.27 73.49 Favored 'General case' 0 N--CA 1.43 -1.433 0 N-CA-C 115.583 1.697 . . . . 1.0 115.583 179.764 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 84.8 mt -66.74 -59.07 3.89 Favored 'General case' 0 N--CA 1.431 -1.419 0 O-C-N 120.087 -1.633 . . . . 1.0 111.02 174.753 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 1.2 m-90 -50.3 -50.11 51.58 Favored 'General case' 0 N--CA 1.429 -1.487 0 C-N-CA 125.65 1.58 . . . . 1.0 113.27 -179.565 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 41.0 tp -61.85 -59.05 5.71 Favored 'General case' 0 N--CA 1.43 -1.447 0 N-CA-C 113.626 0.973 . . . . 1.0 113.626 175.775 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 59.6 m -64.88 -37.42 87.58 Favored 'General case' 0 N--CA 1.431 -1.4 0 N-CA-C 114.252 1.204 . . . . 1.0 114.252 -173.621 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 93.5 mt -64.63 -54.24 32.7 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.458 0 C-N-CA 124.923 1.289 . . . . 1.0 111.686 174.83 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 1.7 tt0 -55.48 -49.66 71.94 Favored 'General case' 0 N--CA 1.43 -1.473 0 C-N-CA 123.984 0.914 . . . . 1.0 113.386 178.565 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 44.4 tt0 -54.65 -49.1 71.38 Favored 'General case' 0 N--CA 1.429 -1.493 0 C-N-CA 125.966 1.706 . . . . 1.0 114.025 174.173 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 7.4 tpm_? -58.95 -45.92 89.29 Favored 'General case' 0 N--CA 1.431 -1.406 0 O-C-N 120.726 -1.234 . . . . 1.0 114.291 179.818 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 3.8 pp -83.51 -26.97 29.71 Favored 'General case' 0 N--CA 1.431 -1.384 0 N-CA-C 115.097 1.517 . . . . 1.0 115.097 -177.387 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 8.7 t70 -62.71 -34.09 76.44 Favored 'General case' 0 CA--C 1.488 -1.405 0 O-C-N 120.336 -1.478 . . . . 1.0 113.342 163.591 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 19.2 t70 -70.59 -55.08 9.65 Favored 'General case' 0 N--CA 1.43 -1.472 0 C-N-CA 126.201 1.8 . . . . 1.0 114.559 178.405 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 24' ' ' TRP . . . . . . . . . . . . . 32.4 t-105 -73.03 138.68 46.11 Favored 'General case' 0 N--CA 1.43 -1.456 0 O-C-N 120.703 -1.248 . . . . 1.0 113.104 -172.643 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 63.3 m-20 -84.16 -141.33 0.07 Allowed 'General case' 0 N--CA 1.431 -1.408 0 O-C-N 120.327 -1.483 . . . . 1.0 112.054 177.519 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 164.3 -164.8 36.9 Favored Glycine 0 N--CA 1.431 -1.664 0 O-C-N 118.592 -2.568 . . . . 1.0 114.181 -175.221 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 37.4 t70 -86.84 -53.43 4.92 Favored 'General case' 0 N--CA 1.43 -1.463 0 C-N-CA 125.238 1.415 . . . . 1.0 107.911 169.242 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 4.5 t -82.7 -176.48 6.3 Favored 'General case' 0 N--CA 1.431 -1.414 0 C-N-CA 125.728 1.611 . . . . 1.0 109.691 178.94 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 32.9 t0 -99.85 178.63 4.76 Favored 'General case' 0 N--CA 1.43 -1.449 0 O-C-N 120.26 -1.525 . . . . 1.0 108.142 175.218 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 9.3 tp -152.26 126.58 1.41 Allowed 'Isoleucine or valine' 0 N--CA 1.43 -1.431 0 N-CA-C 106.936 -1.505 . . . . 1.0 106.936 -173.974 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 28.4 t70 -131.73 119.07 20.82 Favored 'General case' 0 N--CA 1.43 -1.439 0 CA-C-O 122.956 1.36 . . . . 1.0 109.13 163.299 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 17.3 p -86.21 131.17 34.3 Favored 'General case' 0 N--CA 1.43 -1.445 0 O-C-N 120.088 -1.632 . . . . 1.0 111.228 174.349 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 41.0 mm-40 -100.06 137.5 38.42 Favored 'General case' 0 N--CA 1.429 -1.488 0 C-N-CA 124.708 1.203 . . . . 1.0 108.916 174.651 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 3.5 tp -127.42 114.1 34.79 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.407 0 CA-C-O 124.046 1.879 . . . . 1.0 106.245 178.81 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 1.6 t-20 -125.81 179.98 4.93 Favored 'General case' 0 N--CA 1.43 -1.427 0 C-N-CA 124.805 1.242 . . . . 1.0 107.828 176.663 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -71.36 87.36 0.41 Allowed Glycine 0 N--CA 1.431 -1.653 0 O-C-N 120.566 -1.334 . . . . 1.0 115.898 -168.657 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 82.2 23.57 56.67 Favored Glycine 0 N--CA 1.429 -1.792 0 C-N-CA 125.379 1.466 . . . . 1.0 112.526 -171.889 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 61.8 t -138.84 135.05 42.92 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.475 0 CA-C-N 118.307 1.053 . . . . 1.0 109.109 -173.253 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 31.1 mt -118.07 142.01 47.86 Favored 'General case' 0 N--CA 1.43 -1.427 0 CA-C-O 122.919 1.343 . . . . 1.0 108.799 166.273 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -138.49 111.3 7.71 Favored 'General case' 0 N--CA 1.43 -1.426 0 O-C-N 120.422 -1.424 . . . . 1.0 108.436 178.032 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 70.3 mt -96.83 105.41 17.07 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.467 0 N-CA-C 107.362 -1.347 . . . . 1.0 107.362 -165.859 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 14.0 m -118.44 131.2 56.28 Favored 'General case' 0 N--CA 1.43 -1.457 0 CA-C-N 118.896 0.771 . . . . 1.0 112.994 -163.053 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 43' ' ' PHE . . . . . . . . . . . . . 1.4 m-85 -99.56 173.68 6.61 Favored 'General case' 0 N--CA 1.43 -1.431 0 O-C-N 120.608 -1.308 . . . . 1.0 111.193 -179.381 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -71.77 -19.03 62.08 Favored 'General case' 0 N--CA 1.429 -1.481 0 O-C-N 119.219 -2.175 . . . . 1.0 113.476 -179.466 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 29.0 t-20 -67.21 -17.97 65.05 Favored 'General case' 0 N--CA 1.429 -1.502 0 C-N-CA 126.811 2.044 . . . . 1.0 113.512 170.731 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 92.34 -14.9 63.5 Favored Glycine 0 N--CA 1.43 -1.74 0 O-C-N 119.962 -1.712 . . . . 1.0 113.683 179.666 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 13.8 m -77.8 167.86 20.86 Favored 'General case' 0 N--CA 1.431 -1.425 0 O-C-N 121.082 -1.246 . . . . 1.0 111.077 172.943 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 12.9 ptpt -169.93 157.68 6.82 Favored 'General case' 0 N--CA 1.43 -1.439 0 O-C-N 121.156 -0.965 . . . . 1.0 113.07 -162.668 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 5.3 mm -101.54 137.11 30.39 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.438 0 C-N-CA 125.791 1.636 . . . . 1.0 107.389 171.823 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 16.1 mm -111.17 116.85 53.61 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.437 0 C-N-CA 125.032 1.333 . . . . 1.0 109.382 -178.013 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 3.0 mt -125.43 124.76 67.68 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.506 0 O-C-N 120.717 -1.239 . . . . 1.0 110.695 179.297 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 52' ' ' ASN . . . . . 0.481 ' H ' ' HD1' ' A' ' 61' ' ' TRP . 26.6 t30 -162.52 172.93 14.7 Favored 'General case' 0 N--CA 1.43 -1.471 0 N-CA-C 103.142 -2.91 . . . . 1.0 103.142 -172.815 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 1.9 ptm180 -139.76 150.57 44.93 Favored 'General case' 0 N--CA 1.429 -1.524 0 CA-C-O 122.546 1.165 . . . . 1.0 112.337 -158.913 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 15.8 mm-40 -107.16 -108.42 0.31 Allowed 'General case' 0 N--CA 1.43 -1.448 0 C-N-CA 124.653 1.181 . . . . 1.0 109.562 -167.173 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 33.2 mm-40 -79.23 135.75 57.6 Favored Pre-proline 0 N--CA 1.43 -1.446 0 CA-C-O 117.718 -1.134 . . . . 1.0 112.799 -172.041 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 98.5 Cg_endo -73.45 62.69 4.46 Favored 'Trans proline' 0 N--CA 1.434 -1.999 0 C-N-CA 123.277 2.651 . . . . 1.0 112.319 162.997 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 73.1 mt -120.32 -103.0 0.41 Allowed 'General case' 0 N--CA 1.429 -1.493 0 N-CA-C 102.841 -3.022 . . . . 1.0 102.841 164.483 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 58' ' ' HIS . . . . . 0.452 ' HE1' ' HG2' ' A' ' 5' ' ' GLU . 1.8 m-70 -132.47 92.02 3.01 Favored 'General case' 0 N--CA 1.429 -1.489 0 N-CA-C 106.622 -1.622 . . . . 1.0 106.622 159.412 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 22.1 tt0 -158.68 122.05 3.84 Favored 'General case' 0 N--CA 1.429 -1.516 0 CA-C-N 121.687 2.04 . . . . 1.0 114.161 173.005 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 86.4 t -133.36 157.57 42.63 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.451 0 C-N-CA 127.031 2.132 . . . . 1.0 109.437 -179.013 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 61' ' ' TRP . . . . . 0.481 ' HD1' ' H ' ' A' ' 52' ' ' ASN . 0.0 OUTLIER -111.36 156.06 22.16 Favored 'General case' 0 N--CA 1.429 -1.505 0 C-N-CA 127.867 2.467 . . . . 1.0 109.755 -174.169 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . 0.277 2.3 pt? -150.91 134.01 16.03 Favored 'General case' 0 N--CA 1.432 -1.364 0 CA-C-N 120.686 1.584 . . . . 1.0 113.916 150.939 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -120.08 147.29 45.03 Favored 'General case' 0 N--CA 1.429 -1.514 0 C-N-CA 125.367 1.467 . . . . 1.0 114.429 -179.557 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 64' ' ' THR . . . . . . . . . . . . . 12.5 t -153.96 -149.52 0.29 Allowed 'General case' 0 N--CA 1.429 -1.509 0 C-N-CA 126.745 2.018 . . . . 1.0 112.388 -172.694 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 5.6 tmtm? -63.56 -53.57 49.64 Favored 'General case' 0 N--CA 1.43 -1.456 0 C-N-CA 130.116 3.366 . . . . 1.0 114.362 -174.404 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 31.3 tt0 -82.24 2.19 33.02 Favored 'General case' 0 N--CA 1.429 -1.492 0 CA-C-O 122.581 1.181 . . . . 1.0 111.602 -177.008 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 117.5 -72.92 0.29 Allowed Glycine 0 N--CA 1.43 -1.732 0 N-CA-C 107.343 -2.303 . . . . 1.0 107.343 -177.4 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 106.06 -173.43 19.85 Favored Glycine 0 N--CA 1.43 -1.733 0 C-N-CA 124.229 0.918 . . . . 1.0 112.486 -176.382 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -162.05 169.83 20.29 Favored 'General case' 0 N--CA 1.431 -1.423 0 N-CA-C 107.284 -1.376 . . . . 1.0 107.284 -173.008 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 19.8 p80 -79.87 159.9 26.25 Favored 'General case' 0 N--CA 1.431 -1.422 0 O-C-N 119.775 -1.828 . . . . 1.0 114.653 174.504 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 71' ' ' PHE . . . . . . . . . . . . 0.3 72.3 t80 -112.21 113.77 26.2 Favored 'General case' 0 N--CA 1.431 -1.402 0 C-N-CA 127.744 2.418 . . . . 1.0 107.019 -158.565 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 5.7 m-20 -134.12 155.1 50.66 Favored 'General case' 0 N--CA 1.43 -1.459 0 CA-C-O 121.851 0.834 . . . . 1.0 110.546 -173.99 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 8.0 tt -97.37 133.53 41.84 Favored 'General case' 0 N--CA 1.431 -1.42 0 O-C-N 119.68 -1.888 . . . . 1.0 111.869 -166.677 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 53.5 tttm -101.81 -56.39 2.29 Favored 'General case' 0 N--CA 1.43 -1.471 0 O-C-N 120.823 -1.173 . . . . 1.0 109.556 174.539 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -157.03 -96.91 0.12 Allowed Glycine 0 N--CA 1.431 -1.677 0 O-C-N 121.035 -1.041 . . . . 1.0 111.346 175.863 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 27.9 m-20 -89.72 16.31 8.17 Favored 'General case' 0 N--CA 1.429 -1.479 0 O-C-N 121.047 -1.266 . . . . 1.0 111.405 179.94 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 32.9 tt0 -166.02 132.83 2.66 Favored 'General case' 0 N--CA 1.43 -1.427 0 N-CA-C 102.046 -3.316 . . . . 1.0 102.046 -161.484 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 78' ' ' TRP . . . . . . . . . . . . . 50.2 m95 -87.75 144.88 26.39 Favored 'General case' 0 N--CA 1.432 -1.37 0 N-CA-C 106.322 -1.732 . . . . 1.0 106.322 175.186 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 9.4 pt -102.35 167.54 2.33 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.485 0 N-CA-C 106.618 -1.623 . . . . 1.0 106.618 174.083 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 1.4 m -89.79 135.65 33.5 Favored 'General case' 0 N--CA 1.429 -1.484 0 O-C-N 120.195 -1.565 . . . . 1.0 107.193 155.29 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 36.8 t70 -59.94 -38.87 83.66 Favored 'General case' 0 N--CA 1.43 -1.447 0 CA-C-N 120.689 1.586 . . . . 1.0 115.069 -174.238 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -9.85 -84.34 0.0 OUTLIER 'General case' 0 N--CA 1.43 -1.467 0 C-N-CA 131.628 3.971 . . . . 1.0 118.457 176.634 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 58.8 m -111.19 -12.79 14.09 Favored 'General case' 0 CA--C 1.489 -1.371 0 O-C-N 120.485 -1.384 . . . . 1.0 109.588 158.126 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 115.85 76.41 0.63 Allowed Glycine 0 N--CA 1.43 -1.763 0 N-CA-C 108.041 -2.023 . . . . 1.0 108.041 -173.509 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 5.2 mm-40 -100.74 -136.4 0.31 Allowed 'General case' 0 N--CA 1.431 -1.419 0 N-CA-C 109.141 -0.688 . . . . 1.0 109.141 -175.583 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 95.5 m -154.2 133.95 12.94 Favored 'General case' 0 N--CA 1.43 -1.445 0 O-C-N 120.156 -1.59 . . . . 1.0 110.402 -171.317 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 1.1 t80 -38.02 -92.13 0.0 OUTLIER 'General case' 0 CA--C 1.489 -1.375 0 C-N-CA 128.432 2.693 . . . . 1.0 115.842 168.895 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 88' ' ' TRP . . . . . . . . . . . . . 50.7 m95 -63.16 -32.69 74.14 Favored 'General case' 0 N--CA 1.431 -1.419 0 C-N-CA 125.649 1.58 . . . . 1.0 113.454 -167.195 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 35.7 t70 -77.96 -42.94 31.24 Favored 'General case' 0 N--CA 1.43 -1.456 0 C-N-CA 125.088 1.355 . . . . 1.0 113.027 -175.898 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 35.0 tp -75.3 -38.9 60.08 Favored 'General case' 0 N--CA 1.43 -1.46 0 O-C-N 119.427 -2.045 . . . . 1.0 111.332 179.335 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 41.9 tp -54.78 -38.64 67.51 Favored 'General case' 0 N--CA 1.43 -1.427 0 C-N-CA 126.33 1.852 . . . . 1.0 113.626 168.106 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 3.4 tm-20 -56.85 -59.9 4.35 Favored 'General case' 0 N--CA 1.429 -1.506 0 C-N-CA 124.611 1.164 . . . . 1.0 112.043 165.875 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 35.9 mt-30 -51.92 -41.81 62.29 Favored 'General case' 0 N--CA 1.43 -1.425 0 N-CA-C 116.28 1.956 . . . . 1.0 116.28 177.394 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -59.19 -58.39 8.84 Favored 'General case' 0 N--CA 1.43 -1.473 0 C-N-CA 126.523 1.929 . . . . 1.0 113.906 172.424 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -62.77 -49.11 76.3 Favored 'General case' 0 N--CA 1.429 -1.507 0 O-C-N 120.41 -1.431 . . . . 1.0 113.446 179.783 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 66.1 m -48.18 -47.55 35.11 Favored 'General case' 0 N--CA 1.43 -1.437 0 C-N-CA 127.859 2.464 . . . . 1.0 114.913 170.501 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 6.6 pt20 -73.4 -30.93 63.59 Favored 'General case' 0 N--CA 1.43 -1.441 0 O-C-N 120.306 -1.496 . . . . 1.0 114.428 -179.222 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 49.7 mt-30 -81.03 -37.93 28.3 Favored 'General case' 0 N--CA 1.431 -1.379 0 O-C-N 120.323 -1.486 . . . . 1.0 113.868 174.715 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -79.42 -42.76 24.73 Favored 'General case' 0 N--CA 1.43 -1.456 0 O-C-N 120.32 -1.488 . . . . 1.0 114.98 -179.686 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . 106.98 17.75 11.35 Favored Glycine 0 N--CA 1.431 -1.695 0 O-C-N 120.683 -1.261 . . . . 1.0 115.762 175.408 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 4.9 tt0 -162.41 152.78 16.81 Favored 'General case' 0 N--CA 1.43 -1.455 0 N-CA-C 104.946 -2.242 . . . . 1.0 104.946 179.527 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 35.1 m -53.48 108.31 0.33 Allowed 'General case' 0 N--CA 1.43 -1.463 0 C-N-CA 125.238 1.415 . . . . 1.0 114.571 175.317 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 49.0 t -89.43 110.49 21.69 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.414 0 CA-C-O 123.258 1.504 . . . . 1.0 108.244 176.892 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 61.5 m -94.19 98.98 11.33 Favored 'General case' 0 N--CA 1.43 -1.46 0 N-CA-C 113.615 0.968 . . . . 1.0 113.615 -162.525 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 88.5 m-85 -89.17 -32.91 17.24 Favored 'General case' 0 N--CA 1.429 -1.485 0 O-C-N 120.961 -1.087 . . . . 1.0 112.884 176.738 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 30.7 mmt180 . . . . . 0 C--O 1.26 1.647 0 N-CA-C 107.3 -1.37 . . . . 1.0 107.3 172.78 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 62.2 t30 . . . . . 0 N--CA 1.43 -1.438 0 CA-C-O 121.068 0.461 . . . . 0.0 109.979 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 31.1 t70 -64.61 -54.92 24.39 Favored 'General case' 0 N--CA 1.429 -1.48 0 C-N-CA 126.701 2.0 . . . . 0.0 113.678 -175.513 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 9.5 t -65.71 -35.25 80.21 Favored 'General case' 0 N--CA 1.429 -1.479 0 O-C-N 120.066 -1.646 . . . . 0.0 112.696 178.392 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 6.6 tp10 -60.51 -54.93 39.61 Favored 'General case' 0 N--CA 1.431 -1.424 0 C-N-CA 125.433 1.493 . . . . 0.0 112.446 175.616 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 23.2 t80 -46.12 -50.46 15.4 Favored 'General case' 0 N--CA 1.428 -1.54 0 C-N-CA 126.504 1.922 . . . . 0.0 115.2 168.89 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 8.4 t-80 -67.56 -46.01 73.96 Favored 'General case' 0 N--CA 1.429 -1.5 0 O-C-N 121.189 -0.944 . . . . 0.0 113.125 179.775 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 51.1 ttt180 -63.04 -45.82 90.43 Favored 'General case' 0 N--CA 1.431 -1.384 0 O-C-N 120.872 -1.142 . . . . 0.0 113.268 -178.224 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 76.8 mt -58.66 -48.08 82.29 Favored 'General case' 0 N--CA 1.429 -1.476 0 C-N-CA 124.818 1.247 . . . . 0.0 112.774 172.959 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -58.94 -48.75 80.38 Favored 'General case' 0 N--CA 1.432 -1.368 0 C-N-CA 124.549 1.14 . . . . 0.0 113.712 178.402 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -62.7 -36.45 82.97 Favored 'General case' 0 N--CA 1.431 -1.4 0 C-N-CA 124.776 1.23 . . . . 0.0 114.148 175.967 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 27.1 mm-40 -64.72 -47.93 76.49 Favored 'General case' 0 N--CA 1.43 -1.45 0 O-C-N 120.491 -1.381 . . . . 0.0 114.435 174.218 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 2.9 pp -69.1 -40.34 78.44 Favored 'General case' 0 N--CA 1.43 -1.458 0 O-C-N 120.12 -1.613 . . . . 0.0 113.884 175.969 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 0.3 OUTLIER -40.76 -58.87 1.54 Allowed 'General case' 0 N--CA 1.43 -1.442 0 C-N-CA 127.445 2.298 . . . . 0.0 113.8 164.584 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 41.4 tp -63.89 -43.05 97.16 Favored 'General case' 0 N--CA 1.43 -1.468 0 C-N-CA 126.137 1.775 . . . . 0.0 113.515 -178.462 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 58.5 m -61.03 -49.7 76.32 Favored 'General case' 0 N--CA 1.431 -1.408 0 C-N-CA 125.043 1.337 . . . . 0.0 113.269 175.192 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 93.8 mt -55.99 -54.02 31.79 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.447 0 C-N-CA 126.037 1.735 . . . . 0.0 112.943 173.899 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 2.3 tm-20 -56.5 -55.11 37.82 Favored 'General case' 0 N--CA 1.429 -1.485 0 C-N-CA 124.912 1.285 . . . . 0.0 113.213 -178.042 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 34.3 mt-10 -68.13 -35.2 77.72 Favored 'General case' 0 N--CA 1.43 -1.441 0 N-CA-C 116.099 1.889 . . . . 0.0 116.099 -179.382 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 22.7 tpp180 -65.11 -40.06 93.99 Favored 'General case' 0 N--CA 1.43 -1.45 0 O-C-N 119.839 -1.788 . . . . 0.0 112.503 175.743 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 69.1 mt -74.65 -43.1 57.03 Favored 'General case' 0 N--CA 1.431 -1.397 0 N-CA-C 114.354 1.242 . . . . 0.0 114.354 176.91 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 12.5 t70 -54.42 -31.98 56.37 Favored 'General case' 0 N--CA 1.431 -1.415 0 C-N-CA 125.414 1.485 . . . . 0.0 113.697 171.792 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 32.9 t70 -78.51 -15.08 59.0 Favored 'General case' 0 N--CA 1.431 -1.401 0 O-C-N 119.642 -1.911 . . . . 0.0 116.085 174.33 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 24' ' ' TRP . . . . . . . . . . . . . 14.5 t-105 -90.77 121.42 32.63 Favored 'General case' 0 N--CA 1.43 -1.446 0 O-C-N 118.962 -2.336 . . . . 0.0 112.872 -170.347 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 6.5 t70 -120.76 171.77 8.36 Favored 'General case' 0 N--CA 1.43 -1.454 0 O-C-N 119.987 -1.696 . . . . 0.0 110.744 -175.099 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 171.89 -135.42 3.4 Favored Glycine 0 N--CA 1.43 -1.751 0 O-C-N 119.987 -1.695 . . . . 0.0 114.123 -174.971 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 31.5 t0 -84.39 -39.25 19.27 Favored 'General case' 0 N--CA 1.431 -1.39 0 C-N-CA 125.576 1.55 . . . . 0.0 108.667 177.741 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 68.3 m -101.88 143.39 31.83 Favored 'General case' 0 N--CA 1.431 -1.405 0 C-N-CA 124.714 1.206 . . . . 0.0 111.568 -178.363 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 31.2 t0 -86.03 160.12 19.4 Favored 'General case' 0 N--CA 1.43 -1.445 0 O-C-N 121.295 -0.878 . . . . 0.0 109.428 174.554 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -157.35 114.92 0.22 Allowed 'Isoleucine or valine' 0 N--CA 1.43 -1.46 0 CA-C-O 123.067 1.413 . . . . 0.0 107.932 -168.048 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 11.4 m-20 -123.17 131.41 53.67 Favored 'General case' 0 N--CA 1.429 -1.501 0 N-CA-C 107.042 -1.466 . . . . 0.0 107.042 171.334 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 71.3 m -92.64 148.48 22.03 Favored 'General case' 0 N--CA 1.429 -1.503 0 O-C-N 119.471 -2.018 . . . . 0.0 110.431 171.053 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 50.6 mt-10 -102.5 138.12 39.83 Favored 'General case' 0 N--CA 1.43 -1.455 0 C-N-CA 125.54 1.536 . . . . 0.0 109.329 -176.753 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 3.7 mp -124.8 109.08 21.44 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.416 0 CA-C-O 123.745 1.736 . . . . 0.0 107.472 -176.644 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 47.5 t30 -130.73 71.14 1.46 Allowed 'General case' 0 N--CA 1.43 -1.439 0 C-N-CA 125.812 1.645 . . . . 0.0 110.486 179.981 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . 72.27 -101.42 1.05 Allowed Glycine 0 N--CA 1.43 -1.733 0 O-C-N 119.784 -1.822 . . . . 0.0 114.572 174.571 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -105.9 24.55 26.47 Favored Glycine 0 N--CA 1.43 -1.75 0 O-C-N 121.607 -0.937 . . . . 0.0 111.366 173.489 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 95.9 t -122.04 124.71 71.85 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.43 0 C-N-CA 125.539 1.536 . . . . 0.0 107.775 174.532 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 58.3 mt -111.62 140.75 45.98 Favored 'General case' 0 N--CA 1.429 -1.503 0 N-CA-C 107.604 -1.258 . . . . 0.0 107.604 161.83 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 1.2 m -134.57 125.07 26.52 Favored 'General case' 0 N--CA 1.431 -1.38 0 O-C-N 120.292 -1.505 . . . . 0.0 107.979 175.883 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 36.4 mt -96.32 116.62 38.74 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.437 0 N-CA-C 107.236 -1.394 . . . . 0.0 107.236 -175.601 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 86.4 m -127.6 111.61 13.94 Favored 'General case' 0 N--CA 1.43 -1.434 0 CA-C-O 123.713 1.721 . . . . 0.0 113.107 -169.292 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 43' ' ' PHE . . . . . . . . . . . . . 7.5 p90 -120.31 160.14 23.61 Favored 'General case' 0 N--CA 1.43 -1.461 0 C-N-CA 126.546 1.938 . . . . 0.0 112.209 178.938 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 25.8 mt-10 -52.88 -25.55 12.03 Favored 'General case' 0 N--CA 1.431 -1.421 0 N-CA-C 119.402 3.112 . . . . 0.0 119.402 -165.605 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 2.2 t-20 -66.77 -9.19 34.31 Favored 'General case' 0 N--CA 1.429 -1.495 0 C-N-CA 124.625 1.17 . . . . 0.0 113.998 177.686 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 94.56 25.2 16.21 Favored Glycine 0 N--CA 1.43 -1.747 0 O-C-N 120.506 -1.371 . . . . 0.0 110.712 177.107 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 18.3 m -89.52 163.88 15.03 Favored 'General case' 0 N--CA 1.429 -1.479 0 C-N-CA 125.523 1.529 . . . . 0.0 113.298 -170.528 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 36.5 ttmt -151.58 99.37 2.6 Favored 'General case' 0 N--CA 1.431 -1.401 0 O-C-N 121.549 -0.719 . . . . 0.0 111.237 -170.697 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 4.1 mm -101.58 107.91 22.5 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.457 0 N-CA-C 105.028 -2.212 . . . . 0.0 105.028 174.737 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 50' ' ' ILE . . . . . 0.42 HG23 ' HB3' ' A' ' 63' ' ' ALA . 3.4 tp -111.49 120.88 62.99 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.478 0 CA-C-O 123.438 1.59 . . . . 0.0 109.246 -169.824 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 2.4 mt -124.26 120.98 60.71 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.474 0 C-N-CA 125.653 1.581 . . . . 0.0 109.766 -173.994 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 7.5 t-20 -158.42 158.8 34.87 Favored 'General case' 0 N--CA 1.431 -1.389 0 CA-C-O 123.681 1.705 . . . . 0.0 106.843 -172.184 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 37.2 ptt180 -133.25 138.25 46.4 Favored 'General case' 0 N--CA 1.43 -1.454 0 C-N-CA 126.546 1.938 . . . . 0.0 111.077 -163.813 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 13.7 pt20 -100.36 137.58 38.59 Favored 'General case' 0 N--CA 1.43 -1.429 0 CA-C-O 122.496 1.141 . . . . 0.0 108.528 176.977 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 15.5 mm-40 -59.72 -49.02 93.87 Favored Pre-proline 0 N--CA 1.428 -1.531 0 CA-C-O 116.166 -1.874 . . . . 0.0 115.916 174.618 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 88.4 Cg_endo -75.21 139.78 24.16 Favored 'Trans proline' 0 C--N 1.301 -1.972 0 CA-C-N 126.04 3.193 . . . . 0.0 112.056 165.058 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . 0.368 5.5 mp 74.65 127.38 0.04 OUTLIER 'General case' 0 N--CA 1.431 -1.387 0 CA-C-O 124.354 2.026 . . . . 0.0 115.927 -176.22 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 24.1 m80 -76.94 40.24 0.25 Allowed 'General case' 0 N--CA 1.43 -1.438 0 C-N-CA 126.712 2.005 . . . . 0.0 115.016 -177.756 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 7.1 mp0 -127.61 132.18 49.82 Favored 'General case' 0 N--CA 1.43 -1.466 0 C-N-CA 128.591 2.756 . . . . 0.0 107.851 -171.567 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 60' ' ' VAL . . . . . 0.438 ' HB ' ' CE1' ' A' ' 71' ' ' PHE . 29.4 t -113.58 154.49 14.96 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.4 0 O-C-N 119.941 -1.724 . . . . 0.0 108.368 177.745 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 61' ' ' TRP . . . . . 0.436 ' HA ' ' HA ' ' A' ' 70' ' ' HIS 0.28 0.0 OUTLIER -89.3 154.0 20.44 Favored 'General case' 0 N--CA 1.429 -1.477 0 N-CA-C 115.045 1.498 . . . . 0.0 115.045 -178.67 . . . . . . . . 4 4 . 1 . 009 nuclear build core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -117.77 92.31 3.8 Favored 'General case' 0 N--CA 1.43 -1.46 0 N-CA-C 104.916 -2.253 . . . . 0.0 104.916 165.842 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 63' ' ' ALA . . . . . 0.42 ' HB3' HG23 ' A' ' 50' ' ' ILE . . . -104.22 100.89 10.63 Favored 'General case' 0 N--CA 1.431 -1.389 0 CA-C-O 123.689 1.709 . . . . 0.0 110.972 177.534 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 64' ' ' THR . . . . . . . . . . . . . 9.2 t -149.74 172.67 14.72 Favored 'General case' 0 N--CA 1.431 -1.4 0 C-N-CA 126.259 1.824 . . . . 0.0 106.893 -171.234 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 42.4 tptt -78.88 53.36 1.37 Allowed 'General case' 0 N--CA 1.43 -1.468 0 C-N-CA 126.579 1.952 . . . . 0.0 114.77 -166.439 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 38.4 tp60 -130.33 -24.33 2.56 Favored 'General case' 0 N--CA 1.43 -1.434 0 O-C-N 119.992 -1.693 . . . . 0.0 109.363 163.5 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 132.21 112.9 1.44 Allowed Glycine 0 N--CA 1.43 -1.71 0 N-CA-C 107.227 -2.349 . . . . 0.0 107.227 -167.199 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . -71.21 120.48 8.5 Favored Glycine 0 N--CA 1.429 -1.789 0 O-C-N 120.695 -1.473 . . . . 0.0 116.105 -177.195 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 18.6 m-30 -118.11 170.79 8.57 Favored 'General case' 0 N--CA 1.43 -1.459 0 C-N-CA 126.265 1.826 . . . . 0.0 108.7 -175.993 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 70' ' ' HIS . . . . . 0.436 ' HA ' ' HA ' ' A' ' 61' ' ' TRP . 1.5 p-80 -120.74 159.25 25.78 Favored 'General case' 0 N--CA 1.43 -1.465 0 O-C-N 119.226 -2.171 . . . . 0.0 110.93 165.318 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 71' ' ' PHE . . . . . 0.438 ' CE1' ' HB ' ' A' ' 60' ' ' VAL . 0.0 OUTLIER -117.66 153.66 32.94 Favored 'General case' 0 N--CA 1.429 -1.491 0 N-CA-C 117.471 2.397 . . . . 0.0 117.471 -165.43 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 -127.98 145.47 50.96 Favored 'General case' 0 N--CA 1.43 -1.433 0 C-N-CA 124.659 1.184 . . . . 0.0 110.286 178.126 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 60.0 tp -96.1 114.26 25.94 Favored 'General case' 0 N--CA 1.429 -1.477 0 O-C-N 119.883 -1.761 . . . . 0.0 111.609 -178.108 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 74.1 mmtt -82.95 -11.79 57.86 Favored 'General case' 0 N--CA 1.43 -1.451 0 C-N-CA 124.875 1.27 . . . . 0.0 113.185 174.037 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . 121.96 -61.28 0.55 Allowed Glycine 0 N--CA 1.429 -1.768 0 N-CA-C 109.137 -1.585 . . . . 0.0 109.137 178.486 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 6.2 p-10 -89.51 -20.32 23.97 Favored 'General case' 0 N--CA 1.431 -1.392 0 C-N-CA 124.909 1.284 . . . . 0.0 113.162 179.039 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 6.5 tp10 -147.76 136.48 21.86 Favored 'General case' 0 N--CA 1.43 -1.458 0 N-CA-C 107.115 -1.439 . . . . 0.0 107.115 -174.422 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 78' ' ' TRP . . . . . . . . . . . . . 95.7 m95 -80.94 111.22 17.22 Favored 'General case' 0 N--CA 1.431 -1.405 0 N-CA-C 105.927 -1.879 . . . . 0.0 105.927 159.94 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -106.08 155.7 6.96 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.473 0 N-CA-C 105.657 -1.979 . . . . 0.0 105.657 179.658 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 66.4 m -85.4 146.87 26.78 Favored 'General case' 0 N--CA 1.43 -1.457 0 O-C-N 119.597 -1.939 . . . . 0.0 111.946 -175.987 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 51.6 t0 -66.68 -52.07 48.87 Favored 'General case' 0 N--CA 1.43 -1.46 0 C-N-CA 126.011 1.724 . . . . 0.0 112.301 179.261 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 4.4 mmp_? -67.65 129.38 39.73 Favored 'General case' 0 N--CA 1.43 -1.456 0 C-N-CA 124.812 1.245 . . . . 0.0 110.916 173.756 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 71.2 m 70.94 -59.48 0.54 Allowed 'General case' 0 N--CA 1.43 -1.458 0 C-N-CA 126.84 2.056 . . . . 0.0 115.054 -179.175 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 119.99 63.39 0.26 Allowed Glycine 0 N--CA 1.431 -1.665 0 C-N-CA 126.286 1.898 . . . . 0.0 108.751 -172.589 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 15.2 mm-40 -108.64 -152.83 0.5 Allowed 'General case' 0 N--CA 1.43 -1.448 0 N-CA-C 108.092 -1.077 . . . . 0.0 108.092 -170.994 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 8.9 m -150.33 129.83 13.02 Favored 'General case' 0 N--CA 1.431 -1.413 0 O-C-N 119.428 -2.045 . . . . 0.0 109.861 -158.397 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 4.0 t80 -53.12 -81.85 0.01 OUTLIER 'General case' 0 N--CA 1.431 -1.409 0 N-CA-C 119.12 3.008 . . . . 0.0 119.12 -175.945 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 88' ' ' TRP . . . . . . . . . . . . . 84.9 m95 -67.25 -26.43 66.57 Favored 'General case' 0 N--CA 1.43 -1.429 0 O-C-N 119.841 -1.787 . . . . 0.0 113.423 -167.751 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 17.4 t70 -77.94 -36.97 48.65 Favored 'General case' 0 N--CA 1.432 -1.358 0 C-N-CA 126.171 1.788 . . . . 0.0 113.034 179.428 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 42.2 tp -70.76 -44.41 66.79 Favored 'General case' 0 N--CA 1.43 -1.449 0 O-C-N 119.862 -1.774 . . . . 0.0 111.241 173.046 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 9.0 tt -51.03 -48.17 61.53 Favored 'General case' 0 N--CA 1.431 -1.391 0 C-N-CA 127.238 2.215 . . . . 0.0 112.721 171.622 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 23.8 tt0 -53.08 -55.77 21.34 Favored 'General case' 0 N--CA 1.43 -1.438 0 C-N-CA 126.109 1.764 . . . . 0.0 113.468 168.739 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 66.2 tt0 -52.42 -52.91 51.35 Favored 'General case' 0 N--CA 1.428 -1.551 0 C-N-CA 125.424 1.49 . . . . 0.0 113.958 -178.419 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -66.62 -42.45 86.78 Favored 'General case' 0 N--CA 1.43 -1.466 0 N-CA-C 113.926 1.084 . . . . 0.0 113.926 -178.979 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -67.56 -35.82 79.77 Favored 'General case' 0 N--CA 1.43 -1.446 0 O-C-N 120.674 -1.266 . . . . 0.0 113.294 176.516 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 78.9 m -61.05 -47.07 88.07 Favored 'General case' 0 N--CA 1.431 -1.388 0 C-N-CA 125.835 1.654 . . . . 0.0 112.248 174.268 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 16.3 pt20 -78.29 -10.67 59.77 Favored 'General case' 0 N--CA 1.43 -1.456 0 N-CA-C 114.783 1.401 . . . . 0.0 114.783 177.688 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 4.0 mm-40 -76.79 -50.38 13.64 Favored 'General case' 0 N--CA 1.429 -1.495 0 O-C-N 120.261 -1.524 . . . . 0.0 112.913 163.299 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -80.15 -42.97 22.45 Favored 'General case' 0 N--CA 1.43 -1.469 0 N-CA-C 115.493 1.664 . . . . 0.0 115.493 -174.795 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . 95.51 21.43 24.33 Favored Glycine 0 N--CA 1.43 -1.753 0 C-N-CA 124.567 1.08 . . . . 0.0 112.957 -173.713 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 16.4 pt-20 -157.56 164.18 37.59 Favored 'General case' 0 N--CA 1.43 -1.438 0 N-CA-C 105.914 -1.884 . . . . 0.0 105.914 173.399 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 49.1 m -72.43 102.93 3.31 Favored 'General case' 0 N--CA 1.431 -1.4 0 CA-C-N 119.936 1.243 . . . . 0.0 113.053 -173.0 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 4.3 t -98.49 85.68 1.32 Allowed 'Isoleucine or valine' 0 N--CA 1.429 -1.475 0 CA-C-O 123.359 1.552 . . . . 0.0 109.84 -179.024 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 27.9 p -115.84 156.75 25.53 Favored 'General case' 0 N--CA 1.43 -1.454 0 C-N-CA 125.669 1.587 . . . . 0.0 114.064 -170.322 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 29.6 m-85 -102.96 -34.61 8.87 Favored 'General case' 0 N--CA 1.429 -1.493 0 C-N-CA 125.834 1.654 . . . . 0.0 110.011 165.949 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 30.7 mmt180 . . . . . 0 C--O 1.26 1.65 0 O-C-N 121.513 -0.742 . . . . 0.0 109.539 -177.643 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 33.9 p-10 . . . . . 0 N--CA 1.43 -1.465 0 N-CA-C 113.458 0.91 . . . . 1.0 113.458 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 11.2 t70 -56.15 -54.36 46.03 Favored 'General case' 0 N--CA 1.43 -1.458 0 C-N-CA 127.554 2.342 . . . . 1.0 112.862 179.297 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 62.5 m -52.92 -53.64 46.39 Favored 'General case' 0 N--CA 1.43 -1.462 0 C-N-CA 126.516 1.926 . . . . 1.0 113.994 176.237 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 5.8 mm-40 -65.17 -49.04 71.36 Favored 'General case' 0 N--CA 1.43 -1.445 0 C-N-CA 125.616 1.566 . . . . 1.0 113.601 -178.034 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 12.9 t80 -61.96 -38.25 87.81 Favored 'General case' 0 N--CA 1.43 -1.43 0 N-CA-C 114.272 1.212 . . . . 1.0 114.272 173.373 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 23.6 t60 -65.56 -37.53 86.96 Favored 'General case' 0 N--CA 1.43 -1.445 0 O-C-N 119.882 -1.761 . . . . 1.0 113.2 176.422 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 1.7 tpm_? -59.12 -54.5 46.27 Favored 'General case' 0 N--CA 1.431 -1.422 0 C-N-CA 125.565 1.546 . . . . 1.0 112.353 171.796 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 81.5 mt -57.03 -49.13 76.74 Favored 'General case' 0 N--CA 1.429 -1.506 0 C-N-CA 125.043 1.337 . . . . 1.0 113.806 174.629 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -56.67 -48.34 77.82 Favored 'General case' 0 N--CA 1.431 -1.384 0 C-N-CA 127.087 2.155 . . . . 1.0 114.511 -178.283 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -59.78 -52.57 64.89 Favored 'General case' 0 N--CA 1.429 -1.502 0 O-C-N 121.29 -0.881 . . . . 1.0 112.498 171.639 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 39.6 mt-30 -55.2 -45.9 75.86 Favored 'General case' 0 N--CA 1.43 -1.458 0 N-CA-C 117.839 2.533 . . . . 1.0 117.839 177.637 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 4.0 pp -65.67 -38.51 89.52 Favored 'General case' 0 N--CA 1.43 -1.474 0 O-C-N 120.707 -1.246 . . . . 1.0 113.669 175.679 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 0.1 OUTLIER -49.84 -56.52 10.09 Favored 'General case' 0 N--CA 1.429 -1.506 0 N-CA-C 113.988 1.107 . . . . 1.0 113.988 167.894 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 38.1 mt -56.46 -44.21 80.31 Favored 'General case' 0 N--CA 1.43 -1.431 0 CA-C-O 122.183 0.992 . . . . 1.0 113.313 178.743 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 14.9 m -57.56 -54.21 49.44 Favored 'General case' 0 N--CA 1.431 -1.411 0 C-N-CA 125.047 1.339 . . . . 1.0 113.323 178.981 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 80.9 mt -59.62 -46.86 92.79 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.416 0 C-N-CA 126.879 2.072 . . . . 1.0 113.541 177.213 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 26.1 mt-10 -52.67 -57.61 9.52 Favored 'General case' 0 N--CA 1.43 -1.469 0 C-N-CA 126.225 1.81 . . . . 1.0 112.248 176.526 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -53.45 -54.93 29.86 Favored 'General case' 0 CA--C 1.489 -1.391 0 C-N-CA 125.174 1.39 . . . . 1.0 113.545 174.421 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 3.4 tpt180 -57.9 -49.05 78.05 Favored 'General case' 0 N--CA 1.431 -1.42 0 N-CA-C 114.992 1.479 . . . . 1.0 114.992 -171.508 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -80.9 -32.82 34.63 Favored 'General case' 0 N--CA 1.43 -1.458 0 N-CA-C 114.255 1.206 . . . . 1.0 114.255 177.84 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 15.0 t70 -56.02 -49.32 74.0 Favored 'General case' 0 N--CA 1.428 -1.532 0 O-C-N 119.738 -1.851 . . . . 1.0 114.064 172.448 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 13.6 t70 -52.83 -45.41 67.31 Favored 'General case' 0 N--CA 1.43 -1.427 0 C-N-CA 128.081 2.553 . . . . 1.0 117.206 -175.356 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 24' ' ' TRP . . . . . . . . . . . . . 76.9 t-105 -43.9 -65.12 0.54 Allowed 'General case' 0 N--CA 1.43 -1.472 0 C-N-CA 127.677 2.391 . . . . 1.0 116.57 -169.594 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 40.4 t0 59.34 70.03 0.67 Allowed 'General case' 0 N--CA 1.43 -1.46 0 C-N-CA 126.653 1.981 . . . . 1.0 114.161 173.231 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -99.65 -134.29 8.44 Favored Glycine 0 N--CA 1.429 -1.818 0 CA-C-O 122.823 1.235 . . . . 1.0 113.386 -175.45 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -72.69 -34.52 67.22 Favored 'General case' 0 N--CA 1.43 -1.447 0 C-N-CA 125.024 1.329 . . . . 1.0 109.64 174.547 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 36.1 m -89.3 148.84 23.33 Favored 'General case' 0 N--CA 1.43 -1.429 0 CA-C-O 122.899 1.333 . . . . 1.0 113.033 -179.926 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 22.5 t0 -76.84 172.84 12.47 Favored 'General case' 0 N--CA 1.431 -1.381 0 C-N-CA 125.187 1.395 . . . . 1.0 110.135 170.432 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 5.4 tp -157.04 114.78 0.23 Allowed 'Isoleucine or valine' 0 N--CA 1.43 -1.464 0 CA-C-O 123.477 1.608 . . . . 1.0 108.253 -164.78 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 7.5 t0 -131.68 102.31 5.84 Favored 'General case' 0 N--CA 1.431 -1.388 0 O-C-N 120.507 -1.371 . . . . 1.0 108.806 170.767 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 27.3 p -89.58 124.45 34.56 Favored 'General case' 0 N--CA 1.431 -1.424 0 O-C-N 120.241 -1.537 . . . . 1.0 111.669 -178.697 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 5.2 mm-40 -94.34 135.13 36.09 Favored 'General case' 0 N--CA 1.429 -1.478 0 O-C-N 120.087 -1.633 . . . . 1.0 110.623 -177.191 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 1.6 tp -131.42 115.89 30.31 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.422 0 C-N-CA 126.758 2.023 . . . . 1.0 107.357 -176.929 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 4.9 t-20 -147.66 81.42 1.51 Allowed 'General case' 0 N--CA 1.431 -1.423 0 O-C-N 121.62 -0.675 . . . . 1.0 111.374 172.281 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . 68.27 -70.49 0.34 Allowed Glycine 0 N--CA 1.429 -1.808 0 C-N-CA 126.777 2.132 . . . . 1.0 118.221 167.815 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -119.5 -3.07 12.93 Favored Glycine 0 N--CA 1.43 -1.762 0 C-N-CA 126.125 1.821 . . . . 1.0 112.24 179.693 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 21.5 t -120.99 123.78 70.85 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.457 0 CA-C-N 118.538 1.169 . . . . 1.0 109.689 -177.707 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 42.1 mt -110.23 135.67 50.63 Favored 'General case' 0 N--CA 1.431 -1.408 0 O-C-N 120.286 -1.509 . . . . 1.0 108.707 163.254 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -136.91 107.51 6.54 Favored 'General case' 0 N--CA 1.431 -1.407 0 N-CA-C 107.183 -1.414 . . . . 1.0 107.183 -178.329 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 6.5 mt -100.46 114.62 39.8 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.513 0 O-C-N 119.457 -2.027 . . . . 1.0 108.664 -168.075 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 23.0 m -116.03 131.94 56.8 Favored 'General case' 0 N--CA 1.43 -1.436 0 CA-C-O 121.473 0.654 . . . . 1.0 111.265 -167.102 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 43' ' ' PHE . . . . . . . . . . . . 0.263 0.2 OUTLIER -120.55 173.03 7.42 Favored 'General case' 0 N--CA 1.429 -1.486 0 C-N-CA 124.624 1.17 . . . . 1.0 112.481 177.142 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -57.88 -33.32 68.59 Favored 'General case' 0 N--CA 1.431 -1.418 0 N-CA-C 118.256 2.687 . . . . 1.0 118.256 -160.097 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -69.46 -13.78 62.53 Favored 'General case' 0 N--CA 1.43 -1.459 0 C-N-CA 125.543 1.537 . . . . 1.0 113.283 -179.775 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 82.27 38.32 13.12 Favored Glycine 0 N--CA 1.429 -1.772 0 O-C-N 119.868 -1.77 . . . . 1.0 109.228 -168.793 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 68.8 m -120.86 151.61 39.43 Favored 'General case' 0 CA--C 1.489 -1.4 0 N-CA-C 106.145 -1.798 . . . . 1.0 106.145 179.456 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 47.6 pttt -161.3 165.64 28.82 Favored 'General case' 0 N--CA 1.431 -1.411 0 N-CA-C 113.905 1.076 . . . . 1.0 113.905 -165.54 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 5.7 mm -112.86 135.23 52.95 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.506 0 C-N-CA 127.327 2.251 . . . . 1.0 106.269 175.517 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 3.2 mm -117.88 114.46 45.42 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.466 0 C-N-CA 124.577 1.151 . . . . 1.0 108.737 -179.912 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 4.7 mt -128.08 128.25 68.62 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.5 0 CA-C-O 123.006 1.384 . . . . 1.0 111.617 -176.902 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 52' ' ' ASN . . . . . 0.459 ' H ' ' HD1' ' A' ' 61' ' ' TRP . 14.0 t-20 -160.96 174.41 13.83 Favored 'General case' 0 N--CA 1.43 -1.452 0 N-CA-C 102.809 -3.034 . . . . 1.0 102.809 -178.349 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 12.6 ptt180 -142.46 135.26 28.25 Favored 'General case' 0 CA--C 1.489 -1.374 0 N-CA-C 108.66 -0.867 . . . . 1.0 108.66 -169.263 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 55.2 mm-40 -139.46 67.02 1.39 Allowed 'General case' 0 N--CA 1.431 -1.393 0 N-CA-C 106.892 -1.522 . . . . 1.0 106.892 -171.401 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 55' ' ' GLU . . . . . 0.426 ' H ' ' HG3' ' A' ' 55' ' ' GLU . 1.0 OUTLIER -70.91 126.82 92.17 Favored Pre-proline 0 N--CA 1.43 -1.438 0 N-CA-C 117.24 2.311 . . . . 1.0 117.24 -157.655 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 49.6 Cg_endo -76.63 -55.62 0.06 OUTLIER 'Trans proline' 0 C--N 1.299 -2.069 0 C-N-CA 122.052 1.835 . . . . 1.0 109.812 150.908 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 57' ' ' LEU . . . . . 0.419 ' HB2' ' H ' ' A' ' 58' ' ' HIS . 40.8 mt -115.96 -93.23 0.5 Allowed 'General case' 0 N--CA 1.429 -1.508 0 C-N-CA 124.932 1.293 . . . . 1.0 109.307 -177.692 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 58' ' ' HIS . . . . . 0.419 ' H ' ' HB2' ' A' ' 57' ' ' LEU . 51.4 m170 -132.76 78.96 1.82 Allowed 'General case' 0 N--CA 1.43 -1.436 0 C-N-CA 126.68 1.992 . . . . 1.0 106.604 175.892 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 12.0 tt0 -138.47 140.43 39.23 Favored 'General case' 0 N--CA 1.43 -1.45 0 O-C-N 119.908 -1.745 . . . . 1.0 108.252 -170.389 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 48.9 t -119.85 154.43 22.71 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.381 0 N-CA-C 106.198 -1.778 . . . . 1.0 106.198 -177.611 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 61' ' ' TRP . . . . . 0.459 ' HD1' ' H ' ' A' ' 52' ' ' ASN . 0.0 OUTLIER -99.42 148.44 24.21 Favored 'General case' 0 N--CA 1.43 -1.45 0 O-C-N 120.555 -1.341 . . . . 1.0 110.092 178.228 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -133.55 92.21 2.95 Favored 'General case' 0 N--CA 1.429 -1.477 0 O-C-N 120.38 -1.45 . . . . 1.0 111.829 176.862 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -103.71 149.9 24.54 Favored 'General case' 0 N--CA 1.43 -1.429 0 CA-C-O 123.628 1.68 . . . . 1.0 112.011 173.712 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 64' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -151.15 -82.92 0.09 Allowed 'General case' 0 N--CA 1.43 -1.438 0 N-CA-C 107.197 -1.409 . . . . 1.0 107.197 -171.161 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 42.8 tttp -122.88 -59.03 1.63 Allowed 'General case' 0 N--CA 1.43 -1.431 0 C-N-CA 123.696 0.798 . . . . 1.0 111.881 178.432 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 51.7 tt0 -121.1 -23.35 5.83 Favored 'General case' 0 N--CA 1.431 -1.417 0 N-CA-C 112.969 0.729 . . . . 1.0 112.969 -160.066 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . -90.84 -83.79 1.41 Allowed Glycine 0 N--CA 1.431 -1.668 0 O-C-N 120.627 -1.295 . . . . 1.0 114.762 -175.958 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 74.69 51.1 8.37 Favored Glycine 0 N--CA 1.43 -1.748 0 O-C-N 121.375 -1.074 . . . . 1.0 112.845 -166.425 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 11.0 m-30 -99.44 125.78 45.22 Favored 'General case' 0 N--CA 1.429 -1.475 0 O-C-N 121.257 -1.143 . . . . 1.0 108.648 -169.358 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 18.7 p80 -92.37 156.45 17.22 Favored 'General case' 0 N--CA 1.43 -1.459 0 O-C-N 120.214 -1.554 . . . . 1.0 112.072 179.26 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 50.9 p90 -144.13 142.9 30.85 Favored 'General case' 0 N--CA 1.43 -1.448 0 N-CA-C 115.164 1.542 . . . . 1.0 115.164 -156.381 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -119.54 155.69 31.71 Favored 'General case' 0 N--CA 1.429 -1.476 0 C-N-CA 126.834 2.054 . . . . 1.0 110.866 -172.001 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 58.5 tp -92.35 117.4 29.86 Favored 'General case' 0 N--CA 1.43 -1.426 0 O-C-N 120.318 -1.489 . . . . 1.0 111.427 178.801 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 68.3 mmtt -79.99 -45.74 17.89 Favored 'General case' 0 N--CA 1.43 -1.473 0 O-C-N 120.746 -1.221 . . . . 1.0 113.122 170.034 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -174.92 -76.18 0.05 OUTLIER Glycine 0 N--CA 1.43 -1.73 0 O-C-N 121.001 -1.062 . . . . 1.0 112.453 -179.459 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 4.0 p-10 -101.67 0.33 35.94 Favored 'General case' 0 N--CA 1.429 -1.509 0 C-N-CA 124.876 1.27 . . . . 1.0 112.149 173.675 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 20.6 pt-20 -153.44 148.8 27.08 Favored 'General case' 0 N--CA 1.431 -1.404 0 N-CA-C 106.127 -1.805 . . . . 1.0 106.127 -174.764 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 78' ' ' TRP . . . . . . . . . . . . . 27.4 m95 -97.86 135.36 39.72 Favored 'General case' 0 N--CA 1.43 -1.442 0 N-CA-C 106.982 -1.488 . . . . 1.0 106.982 177.413 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 3.1 mt -104.87 134.38 46.45 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.426 0 C-N-CA 125.502 1.521 . . . . 1.0 107.186 177.832 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 75.4 m -82.58 127.6 33.51 Favored 'General case' 0 N--CA 1.432 -1.368 0 CA-C-N 115.403 -0.817 . . . . 1.0 108.841 -179.376 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 30.1 t70 -70.08 -37.9 75.57 Favored 'General case' 0 N--CA 1.43 -1.438 0 C-N-CA 124.16 0.984 . . . . 1.0 112.827 -166.894 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -75.51 121.0 21.71 Favored 'General case' 0 N--CA 1.43 -1.461 0 O-C-N 121.234 -0.916 . . . . 1.0 110.017 176.743 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 83' ' ' SER . . . . . . . . . . . . 0.378 80.2 p 72.59 -53.2 0.7 Allowed 'General case' 0 N--CA 1.43 -1.449 0 C-N-CA 128.065 2.546 . . . . 1.0 115.954 -173.028 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 116.54 80.12 0.79 Allowed Glycine 0 N--CA 1.43 -1.719 0 N-CA-C 109.123 -1.591 . . . . 1.0 109.123 -176.375 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 4.6 mm-40 -135.11 -156.02 0.69 Allowed 'General case' 0 N--CA 1.43 -1.458 0 N-CA-C 105.467 -2.049 . . . . 1.0 105.467 -172.158 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 18.8 m -145.71 137.64 25.31 Favored 'General case' 0 N--CA 1.431 -1.413 0 O-C-N 119.866 -1.771 . . . . 1.0 109.087 -154.267 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 1.3 t80 -30.72 -91.23 0.0 OUTLIER 'General case' 0 N--CA 1.43 -1.447 0 C-N-CA 128.702 2.801 . . . . 1.0 118.309 176.551 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 88' ' ' TRP . . . . . . . . . . . . . 56.0 m95 -73.72 -28.09 61.53 Favored 'General case' 0 N--CA 1.43 -1.463 0 O-C-N 120.794 -1.191 . . . . 1.0 111.499 -169.653 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 59.3 m-20 -74.75 -38.82 62.13 Favored 'General case' 0 N--CA 1.429 -1.506 0 C-N-CA 124.603 1.161 . . . . 1.0 114.06 -178.636 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 58.2 tp -69.64 -45.5 68.32 Favored 'General case' 0 N--CA 1.43 -1.435 0 O-C-N 119.611 -1.931 . . . . 1.0 109.79 174.338 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 60.9 tp -50.93 -44.84 60.36 Favored 'General case' 0 N--CA 1.43 -1.469 0 C-N-CA 125.678 1.591 . . . . 1.0 114.35 170.278 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 2.9 tm-20 -55.78 -49.04 74.24 Favored 'General case' 0 N--CA 1.431 -1.384 0 C-N-CA 126.495 1.918 . . . . 1.0 113.505 172.193 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 1.8 tm0? -61.27 -50.92 71.08 Favored 'General case' 0 N--CA 1.429 -1.499 0 N-CA-C 114.253 1.205 . . . . 1.0 114.253 176.288 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -54.43 -44.26 72.29 Favored 'General case' 0 N--CA 1.431 -1.41 0 C-N-CA 128.019 2.528 . . . . 1.0 115.256 174.544 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -72.97 -45.82 55.82 Favored 'General case' 0 N--CA 1.431 -1.418 0 O-C-N 120.299 -1.5 . . . . 1.0 113.868 178.203 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 91.9 m -50.52 -45.77 56.85 Favored 'General case' 0 N--CA 1.428 -1.549 0 C-N-CA 127.125 2.17 . . . . 1.0 112.891 168.997 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 2.7 tp60 -57.28 -54.75 43.29 Favored 'General case' 0 N--CA 1.432 -1.371 0 C-N-CA 126.31 1.844 . . . . 1.0 113.188 172.795 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 10.1 mm100 -58.41 -45.18 88.91 Favored 'General case' 0 N--CA 1.43 -1.449 0 N-CA-C 116.345 1.98 . . . . 1.0 116.345 176.648 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -78.51 -43.21 27.43 Favored 'General case' 0 N--CA 1.429 -1.481 0 O-C-N 120.302 -1.499 . . . . 1.0 113.402 -178.926 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . 97.27 13.69 44.45 Favored Glycine 0 N--CA 1.431 -1.699 0 C-N-CA 125.085 1.326 . . . . 1.0 111.7 -172.98 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 8.0 tt0 -157.13 144.99 19.12 Favored 'General case' 0 N--CA 1.43 -1.455 0 N-CA-C 106.226 -1.768 . . . . 1.0 106.226 -174.665 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 57.0 m -58.86 119.2 6.74 Favored 'General case' 0 N--CA 1.429 -1.515 0 C-N-CA 125.078 1.351 . . . . 1.0 114.51 -178.726 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 92.2 t -96.19 130.42 44.88 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.45 0 C-N-CA 125.53 1.532 . . . . 1.0 108.816 -179.025 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 7.5 t -93.2 96.76 10.21 Favored 'General case' 0 N--CA 1.429 -1.487 0 C-N-CA 125.449 1.5 . . . . 1.0 114.448 -170.346 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 14.9 m-85 -118.23 -18.97 9.16 Favored 'General case' 0 N--CA 1.431 -1.421 0 C-N-CA 124.87 1.268 . . . . 1.0 111.278 172.17 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.26 1.658 0 O-C-N 120.965 -1.085 . . . . 1.0 113.849 -168.911 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 2' ' ' ASN . . . . . 0.448 ' N ' ' HE2' ' A' ' 58' ' ' HIS . 80.6 m-20 . . . . . 0 N--CA 1.431 -1.413 0 CA-C-O 121.814 0.816 . . . . 1.0 111.081 . . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 9.0 t70 -68.5 -42.31 78.79 Favored 'General case' 0 N--CA 1.429 -1.52 0 C-N-CA 124.635 1.174 . . . . 1.0 114.08 -172.328 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 15.9 t -64.17 -43.63 94.53 Favored 'General case' 0 N--CA 1.429 -1.478 0 O-C-N 120.473 -1.392 . . . . 1.0 112.904 175.846 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 9.4 mm-40 -55.02 -58.32 8.12 Favored 'General case' 0 N--CA 1.43 -1.433 0 C-N-CA 124.893 1.277 . . . . 1.0 113.168 172.908 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 31.3 t80 -50.59 -57.65 7.68 Favored 'General case' 0 N--CA 1.43 -1.426 0 N-CA-C 114.625 1.343 . . . . 1.0 114.625 172.873 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 37.4 m80 -65.07 -38.98 92.54 Favored 'General case' 0 N--CA 1.43 -1.436 0 N-CA-C 115.759 1.763 . . . . 1.0 115.759 -175.588 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 47.6 mtt-85 -62.79 -53.5 53.29 Favored 'General case' 0 N--CA 1.43 -1.432 0 CA-C-N 120.239 1.381 . . . . 1.0 112.972 172.14 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 98.2 mt -62.11 -42.86 99.65 Favored 'General case' 0 N--CA 1.43 -1.465 0 O-C-N 120.752 -1.217 . . . . 1.0 113.571 -178.394 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -62.78 -36.27 82.54 Favored 'General case' 0 N--CA 1.431 -1.424 0 N-CA-C 114.424 1.268 . . . . 1.0 114.424 174.965 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 10.8 t70 -61.17 -45.18 95.66 Favored 'General case' 0 N--CA 1.429 -1.491 0 O-C-N 120.569 -1.332 . . . . 1.0 111.762 172.741 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 29.4 mm100 -57.19 -39.85 76.2 Favored 'General case' 0 N--CA 1.429 -1.49 0 N-CA-C 115.019 1.488 . . . . 1.0 115.019 173.759 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 28.5 mt -59.78 -52.49 65.24 Favored 'General case' 0 N--CA 1.43 -1.452 0 O-C-N 120.312 -1.493 . . . . 1.0 112.942 171.436 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 0.7 OUTLIER -42.67 -56.11 3.28 Favored 'General case' 0 N--CA 1.43 -1.466 0 C-N-CA 127.028 2.131 . . . . 1.0 114.305 174.606 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 44.1 mt -60.32 -48.8 80.19 Favored 'General case' 0 N--CA 1.429 -1.51 0 C-N-CA 124.437 1.095 . . . . 1.0 113.701 176.279 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 24.1 m -64.67 -45.88 84.84 Favored 'General case' 0 N--CA 1.43 -1.43 0 C-N-CA 124.831 1.253 . . . . 1.0 113.539 -175.132 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 65.7 mt -59.53 -51.23 75.17 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.499 0 C-N-CA 126.018 1.727 . . . . 1.0 111.024 175.821 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 4.8 tt0 -55.62 -51.2 67.99 Favored 'General case' 0 N--CA 1.43 -1.438 0 N-CA-C 112.972 0.731 . . . . 1.0 112.972 176.064 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 13.0 tt0 -60.49 -44.75 95.61 Favored 'General case' 0 N--CA 1.429 -1.522 0 N-CA-C 115.3 1.592 . . . . 1.0 115.3 -178.493 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -67.54 -39.14 85.01 Favored 'General case' 0 N--CA 1.431 -1.42 0 O-C-N 119.925 -1.734 . . . . 1.0 112.465 178.113 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 15.2 mt -62.1 -57.11 12.78 Favored 'General case' 0 N--CA 1.431 -1.393 0 N-CA-C 114.628 1.344 . . . . 1.0 114.628 170.724 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 7.6 t70 -52.92 -37.99 61.35 Favored 'General case' 0 N--CA 1.432 -1.368 0 C-N-CA 127.092 2.157 . . . . 1.0 114.962 179.441 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 29.0 t70 -74.96 -0.42 18.66 Favored 'General case' 0 N--CA 1.429 -1.485 0 O-C-N 120.102 -1.624 . . . . 1.0 115.109 179.81 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 24' ' ' TRP . . . . . . . . . . . . . 68.4 t-105 -75.27 129.38 37.34 Favored 'General case' 0 N--CA 1.431 -1.385 0 O-C-N 118.433 -2.667 . . . . 1.0 112.496 172.237 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 34.3 m-20 -117.74 136.5 53.33 Favored 'General case' 0 N--CA 1.43 -1.465 0 N-CA-C 106.788 -1.56 . . . . 1.0 106.788 167.814 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -172.31 -149.01 6.46 Favored Glycine 0 N--CA 1.431 -1.672 0 N-CA-C 110.043 -1.223 . . . . 1.0 110.043 178.724 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 1.5 t70 -79.36 -28.8 41.98 Favored 'General case' 0 N--CA 1.43 -1.462 0 CA-C-O 122.293 1.044 . . . . 1.0 110.694 179.867 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 96.1 p -86.31 -164.41 1.04 Allowed 'General case' 0 N--CA 1.43 -1.465 0 C-N-CA 127.873 2.469 . . . . 1.0 113.749 -179.677 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 3.4 t70 -142.29 179.09 7.13 Favored 'General case' 0 N--CA 1.43 -1.444 0 O-C-N 120.313 -1.492 . . . . 1.0 109.851 176.21 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 7.4 tp -162.77 113.82 0.09 OUTLIER 'Isoleucine or valine' 0 N--CA 1.431 -1.411 0 CA-C-O 123.247 1.498 . . . . 1.0 110.626 -175.149 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -121.36 107.27 12.3 Favored 'General case' 0 N--CA 1.43 -1.458 0 O-C-N 120.363 -1.46 . . . . 1.0 108.991 169.593 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 91.2 m -87.03 139.02 30.99 Favored 'General case' 0 N--CA 1.43 -1.425 0 O-C-N 119.588 -1.945 . . . . 1.0 109.224 164.752 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -105.93 140.13 39.41 Favored 'General case' 0 N--CA 1.43 -1.429 0 C-N-CA 126.083 1.753 . . . . 1.0 110.85 -171.249 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 5.0 mm -115.32 106.85 21.35 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.453 0 C-N-CA 125.333 1.453 . . . . 1.0 107.796 -170.758 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 69.2 m-80 -128.36 -179.37 4.99 Favored 'General case' 0 N--CA 1.429 -1.481 0 O-C-N 120.465 -1.397 . . . . 1.0 110.636 176.069 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -73.22 94.86 0.73 Allowed Glycine 0 N--CA 1.431 -1.666 0 O-C-N 120.112 -1.618 . . . . 1.0 114.326 -167.174 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 78.19 25.33 61.89 Favored Glycine 0 N--CA 1.43 -1.741 0 C-N-CA 125.855 1.693 . . . . 1.0 112.675 -173.067 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 54.8 t -139.82 129.37 28.95 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.454 0 C-N-CA 124.176 0.99 . . . . 1.0 110.45 -167.139 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 14.4 mt -111.69 132.41 54.63 Favored 'General case' 0 N--CA 1.43 -1.445 0 N-CA-C 108.159 -1.052 . . . . 1.0 108.159 154.814 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 2.7 m -124.99 119.89 30.02 Favored 'General case' 0 N--CA 1.429 -1.481 0 N-CA-C 106.989 -1.486 . . . . 1.0 106.989 178.644 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 73.7 mt -93.92 120.53 43.47 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.437 0 O-C-N 120.767 -1.208 . . . . 1.0 108.206 -168.919 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 43.4 p -126.64 129.11 47.85 Favored 'General case' 0 N--CA 1.43 -1.438 0 CA-C-O 122.183 0.992 . . . . 1.0 111.619 178.577 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 43' ' ' PHE . . . . . . . . . . . . . 7.2 p90 -120.28 168.41 11.29 Favored 'General case' 0 N--CA 1.431 -1.424 0 O-C-N 120.372 -1.455 . . . . 1.0 109.57 172.563 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -64.52 -28.88 69.95 Favored 'General case' 0 N--CA 1.431 -1.423 0 N-CA-C 116.16 1.911 . . . . 1.0 116.16 -166.981 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 15.8 m-80 -66.82 -4.94 10.4 Favored 'General case' 0 N--CA 1.43 -1.461 0 C-N-CA 126.068 1.747 . . . . 1.0 114.824 173.181 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 103.23 15.74 22.69 Favored Glycine 0 N--CA 1.43 -1.717 0 O-C-N 120.063 -1.648 . . . . 1.0 116.894 158.874 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 3.2 t -91.86 -175.77 4.23 Favored 'General case' 0 N--CA 1.431 -1.404 0 CA-C-N 118.54 1.17 . . . . 1.0 113.639 -178.072 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -160.81 99.44 1.24 Allowed 'General case' 0 N--CA 1.43 -1.461 0 CA-C-O 122.967 1.365 . . . . 1.0 110.938 -174.401 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -107.58 119.95 58.08 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.443 0 N-CA-C 105.798 -1.927 . . . . 1.0 105.798 -174.468 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 3.7 tp -112.95 128.65 69.58 Favored 'Isoleucine or valine' 0 CA--C 1.488 -1.408 0 O-C-N 119.611 -1.931 . . . . 1.0 111.789 -165.897 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 4.1 mt -124.99 127.59 72.5 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.489 0 C-N-CA 126.749 2.02 . . . . 1.0 110.558 -179.173 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 52' ' ' ASN . . . . . 0.487 ' H ' ' HD1' ' A' ' 61' ' ' TRP . 6.8 t-20 -162.47 169.71 19.92 Favored 'General case' 0 N--CA 1.431 -1.416 0 N-CA-C 105.347 -2.094 . . . . 1.0 105.347 -165.706 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 34.4 ttp180 -155.03 136.17 13.91 Favored 'General case' 0 N--CA 1.431 -1.418 0 O-C-N 120.761 -1.212 . . . . 1.0 110.754 -156.651 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 4.7 mm100 -97.26 127.59 43.35 Favored 'General case' 0 N--CA 1.429 -1.512 0 N-CA-C 107.115 -1.439 . . . . 1.0 107.115 177.673 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 87.4 mt-10 -58.58 -37.62 56.32 Favored Pre-proline 0 N--CA 1.429 -1.502 0 CA-C-O 114.812 -2.518 . . . . 1.0 117.004 167.132 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 68.5 Cg_endo -79.33 155.85 25.34 Favored 'Trans proline' 0 N--CA 1.434 -2.025 0 CA-C-N 127.694 3.783 . . . . 1.0 111.793 161.379 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . 0.361 5.5 mp 67.06 134.94 0.02 OUTLIER 'General case' 0 N--CA 1.431 -1.411 0 CA-C-O 124.553 2.12 . . . . 1.0 115.95 -174.213 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 58' ' ' HIS . . . . . 0.448 ' HE2' ' N ' ' A' ' 2' ' ' ASN . 22.0 m170 -76.15 41.72 0.24 Allowed 'General case' 0 N--CA 1.429 -1.51 0 C-N-CA 126.416 1.886 . . . . 1.0 114.869 -176.23 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 2.1 pt20 -146.91 158.34 43.89 Favored 'General case' 0 N--CA 1.431 -1.379 0 O-C-N 119.402 -2.061 . . . . 1.0 110.073 -171.657 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 93.0 t -118.28 162.28 16.48 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.402 0 N-CA-C 107.03 -1.47 . . . . 1.0 107.03 -177.305 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 61' ' ' TRP . . . . . 0.487 ' HD1' ' H ' ' A' ' 52' ' ' ASN . 0.0 OUTLIER -104.17 153.24 21.19 Favored 'General case' 0 N--CA 1.43 -1.453 0 O-C-N 119.654 -1.904 . . . . 1.0 109.907 178.963 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 2.0 pt? -143.68 126.39 16.08 Favored 'General case' 0 N--CA 1.431 -1.408 0 O-C-N 120.24 -1.538 . . . . 1.0 108.564 158.897 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -120.18 146.79 45.67 Favored 'General case' 0 N--CA 1.429 -1.499 0 CA-C-O 122.46 1.124 . . . . 1.0 112.486 176.09 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 64' ' ' THR . . . . . . . . . . . . . 72.0 p -136.52 -148.99 0.3 Allowed 'General case' 0 N--CA 1.429 -1.513 0 C-N-CA 125.702 1.601 . . . . 1.0 110.503 -152.206 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 12.2 tmtt? -60.7 -67.5 0.39 Allowed 'General case' 0 N--CA 1.429 -1.498 0 C-N-CA 126.654 1.982 . . . . 1.0 112.675 173.817 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 13.1 tt0 -131.0 -22.04 2.62 Favored 'General case' 0 N--CA 1.43 -1.433 0 O-C-N 121.098 -1.001 . . . . 1.0 113.458 176.97 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . -82.98 -99.29 0.52 Allowed Glycine 0 N--CA 1.43 -1.719 0 O-C-N 119.838 -1.789 . . . . 1.0 114.033 -176.397 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 69.3 149.01 0.29 Allowed Glycine 0 N--CA 1.43 -1.72 0 N-CA-C 116.261 1.264 . . . . 1.0 116.261 -171.951 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 1.4 t80 -166.44 169.19 14.16 Favored 'General case' 0 N--CA 1.43 -1.448 0 N-CA-C 107.408 -1.33 . . . . 1.0 107.408 168.262 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 3.7 p-80 -95.23 159.29 15.08 Favored 'General case' 0 N--CA 1.429 -1.492 0 O-C-N 120.17 -1.582 . . . . 1.0 111.811 172.817 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 43.5 p90 -138.48 133.49 32.78 Favored 'General case' 0 N--CA 1.43 -1.471 0 N-CA-C 114.817 1.414 . . . . 1.0 114.817 -158.825 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 43.0 m-20 -105.43 176.28 5.22 Favored 'General case' 0 N--CA 1.431 -1.422 0 C-N-CA 126.361 1.865 . . . . 1.0 109.445 -176.403 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 45.8 tp -110.6 125.46 53.43 Favored 'General case' 0 N--CA 1.431 -1.397 0 O-C-N 119.588 -1.945 . . . . 1.0 110.551 177.974 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 94.5 mttt -73.91 -99.13 0.01 OUTLIER 'General case' 0 N--CA 1.43 -1.472 0 O-C-N 120.645 -1.285 . . . . 1.0 112.238 154.3 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -131.46 -57.51 0.09 OUTLIER Glycine 0 N--CA 1.43 -1.74 0 O-C-N 120.165 -1.584 . . . . 1.0 113.544 -174.547 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 48.6 m-20 -111.34 3.63 18.41 Favored 'General case' 0 N--CA 1.43 -1.469 0 C-N-CA 125.724 1.609 . . . . 1.0 109.99 178.535 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -147.91 120.89 8.79 Favored 'General case' 0 N--CA 1.429 -1.522 0 N-CA-C 105.484 -2.043 . . . . 1.0 105.484 -162.038 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 78' ' ' TRP . . . . . . . . . . . . . 71.5 m95 -84.41 124.39 31.27 Favored 'General case' 0 N--CA 1.431 -1.406 0 N-CA-C 104.099 -2.556 . . . . 1.0 104.099 168.435 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 79' ' ' ILE . . . . . 0.404 ' HB ' ' HB2' ' A' ' 85' ' ' GLU . 0.1 OUTLIER -126.01 139.17 52.29 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.474 0 O-C-N 119.92 -1.738 . . . . 1.0 110.304 -166.589 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 79.9 m -78.09 134.79 37.67 Favored 'General case' 0 N--CA 1.429 -1.488 0 O-C-N 119.837 -1.789 . . . . 1.0 113.306 -174.767 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 25.7 t0 -81.86 55.07 2.62 Favored 'General case' 0 N--CA 1.431 -1.413 0 O-C-N 120.145 -1.597 . . . . 1.0 113.532 -174.401 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -149.82 -152.1 0.42 Allowed 'General case' 0 N--CA 1.43 -1.466 0 O-C-N 120.126 -1.609 . . . . 1.0 108.381 -175.7 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 58.2 p -72.62 -19.74 61.4 Favored 'General case' 0 N--CA 1.43 -1.451 0 O-C-N 119.909 -1.745 . . . . 1.0 114.582 -175.216 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -132.36 78.98 0.35 Allowed Glycine 0 N--CA 1.432 -1.628 0 N-CA-C 109.189 -1.564 . . . . 1.0 109.189 -173.93 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 85' ' ' GLU . . . . . 0.404 ' HB2' ' HB ' ' A' ' 79' ' ' ILE . 11.8 pt-20 -73.42 88.38 1.59 Allowed 'General case' 0 N--CA 1.431 -1.411 0 N-CA-C 116.334 1.976 . . . . 1.0 116.334 -174.566 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 24.8 m -166.63 124.52 1.37 Allowed 'General case' 0 N--CA 1.429 -1.498 0 C-N-CA 125.245 1.418 . . . . 1.0 111.485 172.942 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 3.0 t80 -53.63 -81.97 0.01 OUTLIER 'General case' 0 N--CA 1.43 -1.449 0 C-N-CA 127.031 2.133 . . . . 1.0 116.129 176.617 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 88' ' ' TRP . . . . . . . . . . . . . 0.3 OUTLIER -64.38 -35.11 79.83 Favored 'General case' 0 N--CA 1.43 -1.458 0 O-C-N 120.343 -1.473 . . . . 1.0 114.095 -170.344 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -68.01 -33.1 73.96 Favored 'General case' 0 N--CA 1.429 -1.476 0 C-N-CA 125.136 1.374 . . . . 1.0 114.64 175.577 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 52.8 tp -71.78 -44.44 63.99 Favored 'General case' 0 N--CA 1.429 -1.478 0 O-C-N 119.387 -2.071 . . . . 1.0 110.791 173.204 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 8.1 tt -52.54 -43.12 64.98 Favored 'General case' 0 N--CA 1.43 -1.474 0 C-N-CA 126.571 1.948 . . . . 1.0 113.575 170.985 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 4.9 tt0 -53.09 -60.31 3.45 Favored 'General case' 0 N--CA 1.429 -1.488 0 C-N-CA 126.503 1.921 . . . . 1.0 112.548 168.216 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 20.1 tt0 -52.28 -48.26 65.39 Favored 'General case' 0 N--CA 1.431 -1.414 0 C-N-CA 125.032 1.333 . . . . 1.0 114.314 -177.51 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -55.92 -57.53 11.69 Favored 'General case' 0 N--CA 1.429 -1.519 0 C-N-CA 127.961 2.504 . . . . 1.0 116.16 171.246 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -73.79 -37.0 65.1 Favored 'General case' 0 N--CA 1.43 -1.44 0 O-C-N 118.945 -2.347 . . . . 1.0 112.891 -173.964 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 3.1 m -62.35 -40.12 95.36 Favored 'General case' 0 N--CA 1.43 -1.465 0 C-N-CA 125.141 1.376 . . . . 1.0 112.533 170.8 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 3.0 pt20 -67.59 -30.85 70.56 Favored 'General case' 0 N--CA 1.429 -1.502 0 O-C-N 120.424 -1.422 . . . . 1.0 113.989 178.05 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 15.9 mm-40 -74.07 -47.43 36.62 Favored 'General case' 0 N--CA 1.43 -1.469 0 N-CA-C 114.816 1.413 . . . . 1.0 114.816 168.729 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -72.19 -42.45 65.8 Favored 'General case' 0 N--CA 1.429 -1.502 0 N-CA-C 115.933 1.827 . . . . 1.0 115.933 -176.502 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . 92.31 29.07 11.7 Favored Glycine 0 N--CA 1.43 -1.766 0 C-N-CA 125.078 1.323 . . . . 1.0 113.159 -177.442 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 11.9 pt-20 -167.95 171.65 9.58 Favored 'General case' 0 N--CA 1.43 -1.432 0 O-C-N 121.514 -0.992 . . . . 1.0 110.372 -170.256 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 16.5 m -67.48 121.46 15.86 Favored 'General case' 0 N--CA 1.43 -1.433 0 O-C-N 120.827 -1.171 . . . . 1.0 111.144 176.531 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 9.8 p -98.39 160.42 3.15 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.492 0 C-N-CA 125.107 1.363 . . . . 1.0 107.984 -178.799 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 11.5 t -109.08 107.51 17.85 Favored 'General case' 0 N--CA 1.429 -1.513 0 O-C-N 121.025 -1.047 . . . . 1.0 112.875 -165.706 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 34.5 p90 -138.95 -37.54 0.52 Allowed 'General case' 0 N--CA 1.431 -1.398 0 O-C-N 120.515 -1.365 . . . . 1.0 113.056 -172.232 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 4.9 mtm180 . . . . . 0 C--O 1.259 1.595 0 C-N-CA 124.857 1.263 . . . . 1.0 110.034 177.484 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 48.8 m-80 . . . . . 0 N--CA 1.43 -1.46 0 N-CA-C 117.309 2.337 . . . . 1.0 117.309 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 30.4 t70 -56.26 -49.4 74.3 Favored 'General case' 0 N--CA 1.43 -1.433 0 C-N-CA 125.978 1.711 . . . . 1.0 113.189 -178.225 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 12.9 m -58.95 -38.15 78.38 Favored 'General case' 0 N--CA 1.43 -1.462 0 N-CA-C 114.598 1.333 . . . . 1.0 114.598 -179.812 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 29.0 tt0 -67.67 -54.44 19.52 Favored 'General case' 0 N--CA 1.431 -1.411 0 C-N-CA 125.04 1.336 . . . . 1.0 111.907 176.051 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 1.1 t80 -49.23 -47.79 46.09 Favored 'General case' 0 N--CA 1.431 -1.4 0 C-N-CA 125.93 1.692 . . . . 1.0 113.94 170.182 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 1.0 OUTLIER -57.12 -50.17 73.62 Favored 'General case' 0 N--CA 1.431 -1.392 0 O-C-N 120.239 -1.538 . . . . 1.0 114.231 173.905 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 26.3 ttm-85 -62.24 -47.67 83.38 Favored 'General case' 0 N--CA 1.431 -1.407 0 CA-C-N 119.463 1.028 . . . . 1.0 112.406 -179.376 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 90.6 mt -55.17 -57.53 11.37 Favored 'General case' 0 N--CA 1.429 -1.481 0 C-N-CA 126.534 1.933 . . . . 1.0 112.167 173.172 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -53.52 -47.36 69.99 Favored 'General case' 0 N--CA 1.429 -1.516 0 O-C-N 120.563 -1.335 . . . . 1.0 114.024 178.863 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -61.85 -40.69 96.22 Favored 'General case' 0 N--CA 1.43 -1.437 0 N-CA-C 113.942 1.089 . . . . 1.0 113.942 178.643 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . 0.25 11.6 pt20 -71.87 -38.41 70.04 Favored 'General case' 0 N--CA 1.43 -1.467 0 N-CA-C 114.833 1.42 . . . . 1.0 114.833 175.452 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 82.8 mt -62.13 -50.5 71.66 Favored 'General case' 0 N--CA 1.43 -1.452 0 O-C-N 120.186 -1.572 . . . . 1.0 111.171 174.67 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 0.1 OUTLIER -52.25 -49.97 62.99 Favored 'General case' 0 N--CA 1.43 -1.445 0 C-N-CA 126.079 1.752 . . . . 1.0 111.903 177.264 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 55.2 tp -58.79 -54.01 51.95 Favored 'General case' 0 N--CA 1.431 -1.395 0 C-N-CA 125.441 1.496 . . . . 1.0 113.554 174.413 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 75.0 m -58.68 -57.16 14.22 Favored 'General case' 0 N--CA 1.431 -1.404 0 C-N-CA 124.716 1.207 . . . . 1.0 113.296 178.442 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 29.8 mt -50.74 -52.9 15.25 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.402 0 C-N-CA 125.711 1.604 . . . . 1.0 114.32 176.072 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 29.9 tt0 -57.96 -54.09 50.9 Favored 'General case' 0 N--CA 1.43 -1.429 0 O-C-N 120.709 -1.244 . . . . 1.0 113.639 178.169 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 7.0 tp10 -75.42 -32.45 60.72 Favored 'General case' 0 N--CA 1.431 -1.415 0 N-CA-C 114.838 1.422 . . . . 1.0 114.838 -172.142 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 20.0 tpt180 -75.87 -33.48 59.99 Favored 'General case' 0 N--CA 1.43 -1.434 0 O-C-N 119.943 -1.723 . . . . 1.0 112.981 175.686 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -76.66 -31.83 57.58 Favored 'General case' 0 N--CA 1.43 -1.428 0 O-C-N 120.269 -1.519 . . . . 1.0 110.927 175.659 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 19.7 t70 -58.86 -65.39 0.67 Allowed 'General case' 0 N--CA 1.43 -1.434 0 C-N-CA 125.959 1.704 . . . . 1.0 113.976 168.38 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 32.3 t70 -84.92 112.31 20.45 Favored 'General case' 0 N--CA 1.43 -1.433 0 CA-C-O 123.11 1.433 . . . . 1.0 111.426 178.826 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 24' ' ' TRP . . . . . . . . . . . . . 51.8 t-105 -132.95 -166.1 1.71 Allowed 'General case' 0 N--CA 1.431 -1.412 0 C-N-CA 125.429 1.492 . . . . 1.0 108.108 -174.167 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 5.7 t0 -138.86 85.59 2.09 Favored 'General case' 0 N--CA 1.429 -1.481 0 N-CA-C 106.006 -1.85 . . . . 1.0 106.006 172.211 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -161.12 -159.83 10.29 Favored Glycine 0 N--CA 1.43 -1.74 0 O-C-N 120.428 -1.42 . . . . 1.0 112.916 -173.315 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 9.1 t0 -113.1 -34.59 5.65 Favored 'General case' 0 N--CA 1.431 -1.397 0 C-N-CA 125.387 1.475 . . . . 1.0 111.096 -177.705 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 49.3 m -60.28 149.82 32.26 Favored 'General case' 0 N--CA 1.43 -1.43 0 C-N-CA 125.79 1.636 . . . . 1.0 113.602 178.032 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 2.4 t70 -110.11 151.54 27.11 Favored 'General case' 0 N--CA 1.431 -1.407 0 O-C-N 120.966 -1.084 . . . . 1.0 109.356 174.277 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 50.8 mm -139.83 115.68 8.49 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.426 0 C-N-CA 126.811 2.044 . . . . 1.0 105.487 -161.245 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 41.8 m-20 -119.55 100.65 7.41 Favored 'General case' 0 N--CA 1.432 -1.373 0 CA-C-O 122.126 0.965 . . . . 1.0 109.27 167.51 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 24.7 t -73.95 137.73 43.75 Favored 'General case' 0 N--CA 1.43 -1.446 0 O-C-N 119.372 -2.08 . . . . 1.0 111.363 162.585 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -94.66 149.51 21.17 Favored 'General case' 0 N--CA 1.429 -1.507 0 C-N-CA 126.625 1.97 . . . . 1.0 108.679 179.81 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 3.3 mp -135.51 106.6 6.5 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.439 0 CA-C-O 123.787 1.756 . . . . 1.0 109.278 -171.345 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 4.7 m120 -113.09 172.34 7.0 Favored 'General case' 0 N--CA 1.431 -1.418 0 N-CA-C 106.829 -1.545 . . . . 1.0 106.829 167.109 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -69.75 85.09 0.28 Allowed Glycine 0 N--CA 1.43 -1.729 0 N-CA-C 117.019 1.568 . . . . 1.0 117.019 -168.745 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 94.87 12.47 55.42 Favored Glycine 0 N--CA 1.431 -1.698 0 C-N-CA 126.19 1.853 . . . . 1.0 112.882 -177.27 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 44.9 t -132.28 131.88 60.72 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.452 0 N-CA-C 107.083 -1.451 . . . . 1.0 107.083 -175.6 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 68.5 mt -121.77 137.94 54.56 Favored 'General case' 0 N--CA 1.43 -1.436 0 O-C-N 120.698 -1.251 . . . . 1.0 109.558 174.187 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -128.68 107.18 9.47 Favored 'General case' 0 N--CA 1.432 -1.372 0 N-CA-C 107.193 -1.41 . . . . 1.0 107.193 -174.654 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 42.6 mt -89.55 122.67 41.15 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.451 0 O-C-N 119.456 -2.027 . . . . 1.0 109.355 -167.397 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 27.2 p -123.9 135.01 53.43 Favored 'General case' 0 N--CA 1.43 -1.465 0 CA-C-O 122.114 0.959 . . . . 1.0 113.389 -179.741 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 43' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -121.41 171.74 8.55 Favored 'General case' 0 N--CA 1.43 -1.459 0 O-C-N 120.444 -1.41 . . . . 1.0 111.534 173.406 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 14.7 mm-40 -52.12 -32.69 36.51 Favored 'General case' 0 N--CA 1.43 -1.446 0 N-CA-C 118.495 2.776 . . . . 1.0 118.495 -169.694 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 31.5 t30 -66.05 -12.41 55.11 Favored 'General case' 0 N--CA 1.432 -1.367 0 N-CA-C 114.783 1.401 . . . . 1.0 114.783 175.712 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 90.04 17.27 54.18 Favored Glycine 0 N--CA 1.43 -1.718 0 O-C-N 120.14 -1.6 . . . . 1.0 111.528 -179.485 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 73.4 m -91.72 157.8 16.72 Favored 'General case' 0 N--CA 1.429 -1.486 0 C-N-CA 126.019 1.728 . . . . 1.0 110.907 -174.074 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 5.2 ptmm? -149.21 121.47 8.39 Favored 'General case' 0 N--CA 1.431 -1.381 0 N-CA-C 114.089 1.144 . . . . 1.0 114.089 -151.211 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 1.7 mm -116.1 134.91 57.98 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.491 0 N-CA-C 107.012 -1.477 . . . . 1.0 107.012 176.415 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 3.5 tp -125.13 119.67 56.3 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.504 0 CA-C-N 121.887 2.13 . . . . 1.0 110.543 -179.969 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 3.9 mt -130.57 125.83 59.61 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.394 0 CA-C-O 123.588 1.661 . . . . 1.0 113.098 -167.728 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 8.4 t30 -161.8 175.73 11.62 Favored 'General case' 0 N--CA 1.43 -1.445 0 N-CA-C 105.661 -1.977 . . . . 1.0 105.661 -171.302 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 1.4 ptp85 -108.86 153.97 22.77 Favored 'General case' 0 N--CA 1.43 -1.471 0 O-C-N 120.04 -1.663 . . . . 1.0 111.966 -173.444 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 15.7 mm100 -103.92 86.05 2.52 Favored 'General case' 0 N--CA 1.43 -1.429 0 C-N-CA 125.0 1.32 . . . . 1.0 108.187 173.209 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . 0.281 28.6 tt0 -61.43 -39.34 61.38 Favored Pre-proline 0 N--CA 1.43 -1.46 0 N-CA-C 118.923 2.934 . . . . 1.0 118.923 -161.682 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 77.0 Cg_exo -64.62 -7.71 15.33 Favored 'Trans proline' 0 C--N 1.298 -2.086 0 CA-C-N 126.474 3.348 . . . . 1.0 117.198 -178.447 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 57' ' ' LEU . . . . . 0.503 HD12 HE22 ' A' ' 59' ' ' GLN . 61.4 mt -117.75 -113.08 0.34 Allowed 'General case' 0 N--CA 1.43 -1.437 0 CA-C-N 120.115 1.325 . . . . 1.0 110.395 173.972 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 3.3 t-80 -146.53 -30.23 0.37 Allowed 'General case' 0 N--CA 1.431 -1.411 0 C-N-CA 124.784 1.234 . . . . 1.0 111.484 -168.221 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 59' ' ' GLN . . . . . 0.503 HE22 HD12 ' A' ' 57' ' ' LEU . 16.5 pm0 -80.88 152.58 28.06 Favored 'General case' 0 N--CA 1.431 -1.409 0 CA-C-O 124.977 2.323 . . . . 1.0 116.845 -169.967 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 59.5 t -91.29 147.29 5.35 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.469 0 CA-C-N 113.008 -1.905 . . . . 1.0 108.096 171.615 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 61' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -106.8 148.06 28.94 Favored 'General case' 0 N--CA 1.43 -1.462 0 O-C-N 120.139 -1.601 . . . . 1.0 107.972 175.681 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 2.4 pt? -146.49 115.93 7.11 Favored 'General case' 0 N--CA 1.428 -1.536 0 CA-C-O 123.248 1.499 . . . . 1.0 111.122 166.019 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 63' ' ' ALA . . . . . 0.415 ' HA ' ' HA2' ' A' ' 68' ' ' GLY . . . -100.29 140.27 34.78 Favored 'General case' 0 N--CA 1.431 -1.39 0 CA-C-O 123.255 1.502 . . . . 1.0 113.779 172.644 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 64' ' ' THR . . . . . . . . . . . . . 9.0 t -151.86 -167.15 2.7 Favored 'General case' 0 N--CA 1.431 -1.421 0 C-N-CA 126.364 1.866 . . . . 1.0 107.318 -169.137 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 33.1 tptt -69.49 -29.96 67.73 Favored 'General case' 0 N--CA 1.43 -1.466 0 N-CA-C 116.286 1.958 . . . . 1.0 116.286 -165.847 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 11.1 tt0 -77.7 -13.3 59.94 Favored 'General case' 0 N--CA 1.429 -1.485 0 O-C-N 120.208 -1.557 . . . . 1.0 113.874 176.079 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 146.67 -56.42 0.51 Allowed Glycine 0 N--CA 1.43 -1.748 0 O-C-N 119.529 -1.982 . . . . 1.0 112.133 174.123 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 68' ' ' GLY . . . . . 0.415 ' HA2' ' HA ' ' A' ' 63' ' ' ALA . . . 123.67 124.44 2.9 Favored Glycine 0 N--CA 1.43 -1.714 0 O-C-N 121.723 -0.869 . . . . 1.0 115.002 -176.704 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 19.6 m-30 -120.56 170.16 9.67 Favored 'General case' 0 N--CA 1.43 -1.442 0 C-N-CA 125.727 1.611 . . . . 1.0 107.392 -177.227 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 28.4 p80 -114.54 159.34 20.51 Favored 'General case' 0 N--CA 1.43 -1.434 0 O-C-N 119.796 -1.815 . . . . 1.0 111.905 170.221 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 71' ' ' PHE . . . . . . . . . . . . 0.259 20.0 t80 -118.48 113.27 21.08 Favored 'General case' 0 N--CA 1.432 -1.361 0 C-N-CA 127.291 2.236 . . . . 1.0 108.587 -160.607 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -128.58 166.45 18.83 Favored 'General case' 0 N--CA 1.429 -1.49 0 C-N-CA 124.713 1.205 . . . . 1.0 108.689 -170.371 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -112.35 121.31 44.5 Favored 'General case' 0 N--CA 1.43 -1.447 0 O-C-N 119.02 -2.3 . . . . 1.0 112.865 -163.633 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 12.1 mmtm -110.97 79.64 1.22 Allowed 'General case' 0 N--CA 1.431 -1.399 0 O-C-N 120.057 -1.652 . . . . 1.0 110.143 167.572 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . 72.36 -79.92 0.64 Allowed Glycine 0 N--CA 1.431 -1.675 0 C-N-CA 125.668 1.604 . . . . 1.0 115.93 173.452 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -116.75 -7.49 11.49 Favored 'General case' 0 N--CA 1.429 -1.504 0 C-N-CA 125.233 1.413 . . . . 1.0 110.862 -178.739 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 53.9 mt-10 -131.16 125.47 33.11 Favored 'General case' 0 N--CA 1.43 -1.469 0 N-CA-C 105.537 -2.023 . . . . 1.0 105.537 -171.687 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 78' ' ' TRP . . . . . 0.411 ' HB2' ' HB3' ' A' ' 87' ' ' PHE . 71.3 m95 -82.82 111.51 18.8 Favored 'General case' 0 N--CA 1.43 -1.428 0 N-CA-C 107.391 -1.337 . . . . 1.0 107.391 174.472 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 8.6 mt -90.21 124.85 43.04 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.433 0 CA-C-O 124.032 1.872 . . . . 1.0 107.437 178.373 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 80' ' ' CYS . . . . . 0.409 ' HB2' ' HB2' ' A' ' 85' ' ' GLU . 38.5 m -76.96 121.36 23.36 Favored 'General case' 0 N--CA 1.429 -1.496 0 CA-C-N 113.971 -1.468 . . . . 1.0 108.7 177.935 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 11.8 t70 -71.75 -41.62 68.23 Favored 'General case' 0 N--CA 1.429 -1.51 0 N-CA-C 114.634 1.346 . . . . 1.0 114.634 -154.223 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 24.1 mmt85 -70.94 129.63 39.52 Favored 'General case' 0 N--CA 1.43 -1.46 0 O-C-N 121.195 -0.941 . . . . 1.0 109.057 173.545 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 83' ' ' SER . . . . . . . . . . . . 0.257 29.6 t 69.8 -71.09 0.13 Allowed 'General case' 0 N--CA 1.43 -1.446 0 C-N-CA 125.91 1.684 . . . . 1.0 112.21 -159.482 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 120.85 68.09 0.27 Allowed Glycine 0 N--CA 1.431 -1.663 0 N-CA-C 108.066 -2.013 . . . . 1.0 108.066 -168.467 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 85' ' ' GLU . . . . . 0.409 ' HB2' ' HB2' ' A' ' 80' ' ' CYS . 60.1 mm-40 -113.83 -145.48 0.4 Allowed 'General case' 0 N--CA 1.429 -1.477 0 C-N-CA 124.737 1.215 . . . . 1.0 108.306 -171.252 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 93.2 m -150.57 133.99 16.38 Favored 'General case' 0 N--CA 1.43 -1.474 0 O-C-N 119.561 -1.962 . . . . 1.0 108.945 -160.685 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 87' ' ' PHE . . . . . 0.411 ' HB3' ' HB2' ' A' ' 78' ' ' TRP 0.278 0.0 OUTLIER -39.91 -85.95 0.0 OUTLIER 'General case' 0 N--CA 1.43 -1.447 0 N-CA-C 120.373 3.471 . . . . 1.0 120.373 179.923 . . . . . . . . 4 4 . 1 . 012 nuclear build core ' A' A ' 88' ' ' TRP . . . . . . . . . . . . . 65.9 m95 -68.85 -29.62 67.97 Favored 'General case' 0 N--CA 1.43 -1.433 0 O-C-N 120.682 -1.261 . . . . 1.0 113.321 -172.956 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 24.0 m-20 -71.31 -38.81 71.73 Favored 'General case' 0 N--CA 1.429 -1.485 0 O-C-N 120.987 -1.071 . . . . 1.0 113.607 175.87 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 45.3 tp -69.06 -44.07 73.35 Favored 'General case' 0 N--CA 1.43 -1.447 0 O-C-N 119.817 -1.802 . . . . 1.0 110.658 175.987 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 10.2 tt -49.14 -50.55 37.0 Favored 'General case' 0 N--CA 1.43 -1.429 0 C-N-CA 126.494 1.917 . . . . 1.0 113.371 172.272 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 37.4 tt0 -54.97 -57.93 9.68 Favored 'General case' 0 N--CA 1.431 -1.41 0 C-N-CA 126.706 2.002 . . . . 1.0 113.133 171.694 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 30.4 tt0 -50.58 -48.27 57.65 Favored 'General case' 0 CA--C 1.488 -1.414 0 C-N-CA 127.337 2.255 . . . . 1.0 114.595 178.364 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -65.85 -45.96 80.25 Favored 'General case' 0 N--CA 1.431 -1.421 0 C-N-CA 127.39 2.276 . . . . 1.0 114.377 174.919 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -63.19 -43.87 96.98 Favored 'General case' 0 N--CA 1.43 -1.46 0 O-C-N 120.03 -1.669 . . . . 1.0 112.97 177.453 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 15.5 m -55.46 -43.41 75.43 Favored 'General case' 0 N--CA 1.43 -1.472 0 C-N-CA 126.17 1.788 . . . . 1.0 114.087 170.017 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 2.2 pt20 -72.41 -28.55 63.05 Favored 'General case' 0 N--CA 1.43 -1.439 0 N-CA-C 114.893 1.442 . . . . 1.0 114.893 177.154 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 14.3 mm-40 -66.91 -57.37 7.09 Favored 'General case' 0 N--CA 1.43 -1.47 0 O-C-N 120.906 -1.122 . . . . 1.0 111.992 171.235 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -80.02 -46.21 17.01 Favored 'General case' 0 N--CA 1.43 -1.448 0 N-CA-C 115.723 1.749 . . . . 1.0 115.723 -172.323 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . 87.6 49.52 3.86 Favored Glycine 0 N--CA 1.43 -1.721 0 O-C-N 120.935 -1.103 . . . . 1.0 112.048 -168.37 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 19.3 tt0 -164.81 159.53 18.59 Favored 'General case' 0 N--CA 1.429 -1.513 0 N-CA-C 106.252 -1.759 . . . . 1.0 106.252 -176.268 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 45.9 m -72.16 99.09 2.26 Favored 'General case' 0 N--CA 1.431 -1.406 0 O-C-N 119.554 -1.966 . . . . 1.0 110.681 166.227 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 46.2 t -110.51 112.7 41.71 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.433 0 N-CA-C 105.643 -1.984 . . . . 1.0 105.643 178.066 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 7.5 t -141.42 176.44 8.86 Favored 'General case' 0 N--CA 1.431 -1.413 0 O-C-N 121.328 -0.857 . . . . 1.0 109.591 -171.043 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 5.7 m-85 -111.69 -14.99 13.53 Favored 'General case' 0 N--CA 1.43 -1.439 0 C-N-CA 125.147 1.379 . . . . 1.0 110.288 174.418 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 37.1 mmt180 . . . . . 0 C--O 1.26 1.649 0 O-C-N 120.619 -1.301 . . . . 1.0 111.554 -176.87 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 1.4 t-20 . . . . . 0 N--CA 1.43 -1.426 0 N-CA-C 113.251 0.834 . . . . 1.0 113.251 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 3' ' ' ASP . . . . . . . . . . . . 0.266 1.3 p-10 -61.54 -48.9 78.93 Favored 'General case' 0 N--CA 1.431 -1.395 0 N-CA-C 116.153 1.908 . . . . 1.0 116.153 -164.752 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 63.2 p -61.97 -37.53 85.11 Favored 'General case' 0 N--CA 1.43 -1.44 0 C-N-CA 124.855 1.262 . . . . 1.0 113.04 179.146 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 28.9 mt-10 -69.85 -49.61 50.72 Favored 'General case' 0 N--CA 1.43 -1.435 0 C-N-CA 126.501 1.92 . . . . 1.0 112.102 179.725 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 2.3 m-85 -60.14 -38.6 83.6 Favored 'General case' 0 N--CA 1.431 -1.392 0 C-N-CA 124.177 0.991 . . . . 1.0 112.93 172.815 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 25.2 t60 -65.76 -48.38 72.02 Favored 'General case' 0 N--CA 1.43 -1.459 0 C-N-CA 125.744 1.618 . . . . 1.0 111.792 177.684 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 41.8 ttp-105 -56.03 -57.04 13.81 Favored 'General case' 0 N--CA 1.431 -1.425 0 C-N-CA 124.808 1.243 . . . . 1.0 112.888 177.708 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 36.9 mt -57.74 -42.06 83.12 Favored 'General case' 0 N--CA 1.431 -1.412 0 C-N-CA 124.212 1.005 . . . . 1.0 113.235 178.147 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -57.23 -57.96 10.32 Favored 'General case' 0 N--CA 1.431 -1.376 0 C-N-CA 124.3 1.04 . . . . 1.0 113.123 173.006 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 14.6 t70 -54.43 -45.75 73.07 Favored 'General case' 0 CA--C 1.489 -1.396 0 C-N-CA 125.613 1.565 . . . . 1.0 113.877 -177.005 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 18.4 mt-30 -57.23 -55.2 37.88 Favored 'General case' 0 N--CA 1.431 -1.424 0 N-CA-C 115.194 1.553 . . . . 1.0 115.194 170.694 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 3.1 pp -70.9 -37.04 72.96 Favored 'General case' 0 N--CA 1.43 -1.463 0 O-C-N 119.738 -1.851 . . . . 1.0 115.789 -178.113 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 0.8 OUTLIER -43.91 -60.15 1.96 Allowed 'General case' 0 N--CA 1.429 -1.489 0 C-N-CA 128.155 2.582 . . . . 1.0 112.425 165.859 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 50.7 tp -62.01 -42.72 99.46 Favored 'General case' 0 N--CA 1.429 -1.478 0 C-N-CA 124.299 1.04 . . . . 1.0 113.611 178.396 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 87.4 m -55.44 -52.07 64.8 Favored 'General case' 0 N--CA 1.431 -1.41 0 C-N-CA 125.609 1.564 . . . . 1.0 112.986 176.61 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 78.0 mt -58.78 -52.26 62.26 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.462 0 C-N-CA 125.825 1.65 . . . . 1.0 112.27 175.71 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 2.1 tt0 -56.2 -49.93 72.66 Favored 'General case' 0 N--CA 1.43 -1.432 0 N-CA-C 114.194 1.183 . . . . 1.0 114.194 -177.729 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 34.1 tt0 -65.32 -48.54 72.72 Favored 'General case' 0 N--CA 1.43 -1.436 0 O-C-N 120.928 -1.108 . . . . 1.0 113.637 178.361 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 7.9 tpt180 -61.8 -49.83 74.76 Favored 'General case' 0 N--CA 1.43 -1.454 0 C-N-CA 124.045 0.938 . . . . 1.0 112.647 -176.843 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 11.2 mp -72.62 -30.2 64.13 Favored 'General case' 0 N--CA 1.43 -1.45 0 C-N-CA 124.494 1.118 . . . . 1.0 113.733 -177.756 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 7.9 t70 -66.48 -51.97 51.08 Favored 'General case' 0 N--CA 1.429 -1.509 0 O-C-N 120.371 -1.455 . . . . 1.0 113.506 171.356 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 2.0 t70 -69.82 -24.35 63.45 Favored 'General case' 0 N--CA 1.429 -1.494 0 O-C-N 120.15 -1.594 . . . . 1.0 113.597 -176.525 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 24' ' ' TRP . . . . . . . . . . . . . 59.3 t-105 -45.9 -54.01 8.9 Favored 'General case' 0 N--CA 1.429 -1.492 0 C-N-CA 128.201 2.6 . . . . 1.0 116.989 178.366 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 28.6 t0 66.27 173.6 0.24 Allowed 'General case' 0 N--CA 1.429 -1.492 0 C-N-CA 127.033 2.133 . . . . 1.0 112.884 -175.406 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -168.3 -151.83 7.31 Favored Glycine 0 N--CA 1.429 -1.801 0 O-C-N 119.053 -2.279 . . . . 1.0 112.574 -172.599 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 36.7 t70 -83.45 -47.23 11.61 Favored 'General case' 0 N--CA 1.43 -1.427 0 N-CA-C 107.697 -1.223 . . . . 1.0 107.697 161.736 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 83.2 p -87.62 167.61 13.75 Favored 'General case' 0 N--CA 1.429 -1.506 0 C-N-CA 124.807 1.243 . . . . 1.0 110.988 173.566 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 29' ' ' ASP . . . . . 0.457 ' H ' ' HG2' ' A' ' 44' ' ' GLU . 2.9 t70 -110.09 179.21 4.17 Favored 'General case' 0 N--CA 1.43 -1.453 0 O-C-N 120.763 -1.211 . . . . 1.0 109.583 -173.016 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -157.61 129.24 0.95 Allowed 'Isoleucine or valine' 0 N--CA 1.43 -1.46 0 CA-C-O 123.117 1.437 . . . . 1.0 108.933 -161.874 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 26.7 m-20 -132.72 105.31 7.1 Favored 'General case' 0 N--CA 1.429 -1.489 0 C-N-CA 126.707 2.003 . . . . 1.0 110.343 170.041 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 10.4 t -85.23 142.44 29.41 Favored 'General case' 0 N--CA 1.43 -1.469 0 O-C-N 118.92 -2.362 . . . . 1.0 110.809 170.811 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 2.2 tp10 -113.5 137.88 50.92 Favored 'General case' 0 N--CA 1.428 -1.546 0 C-N-CA 124.13 0.972 . . . . 1.0 109.9 178.708 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 5.1 tp -117.44 121.03 66.63 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.428 0 C-N-CA 126.516 1.926 . . . . 1.0 107.079 178.759 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 32.0 m120 -124.77 -176.33 3.51 Favored 'General case' 0 N--CA 1.43 -1.45 0 C-N-CA 126.1 1.76 . . . . 1.0 108.52 168.31 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -65.52 91.08 0.13 Allowed Glycine 0 N--CA 1.43 -1.703 0 O-C-N 120.105 -1.622 . . . . 1.0 116.047 -171.0 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 85.65 2.93 86.62 Favored Glycine 0 N--CA 1.429 -1.815 0 C-N-CA 125.115 1.341 . . . . 1.0 113.898 -176.258 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 33.4 t -124.53 125.38 70.07 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.449 0 C-N-CA 124.045 0.938 . . . . 1.0 109.983 -168.88 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 27.7 mt -115.73 130.63 56.92 Favored 'General case' 0 N--CA 1.43 -1.462 0 CA-C-O 122.623 1.202 . . . . 1.0 108.239 165.242 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 5.2 p -120.87 119.44 32.67 Favored 'General case' 0 N--CA 1.429 -1.482 0 N-CA-C 106.995 -1.483 . . . . 1.0 106.995 170.773 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 33.5 mt -92.82 113.09 27.19 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.455 0 N-CA-C 106.8 -1.556 . . . . 1.0 106.8 -177.203 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -99.35 128.04 45.43 Favored 'General case' 0 N--CA 1.43 -1.464 0 N-CA-C 108.434 -0.95 . . . . 1.0 108.434 -175.979 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 43' ' ' PHE . . . . . . . . . . . . . 5.4 p90 -116.14 151.06 36.38 Favored 'General case' 0 N--CA 1.43 -1.435 0 N-CA-C 107.394 -1.336 . . . . 1.0 107.394 171.386 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 44' ' ' GLU . . . . . 0.457 ' HG2' ' H ' ' A' ' 29' ' ' ASP . 0.2 OUTLIER -71.18 -13.42 61.92 Favored 'General case' 0 N--CA 1.43 -1.444 0 N-CA-C 116.334 1.976 . . . . 1.0 116.334 -153.986 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 19.7 t-20 -64.95 -19.56 66.02 Favored 'General case' 0 N--CA 1.43 -1.447 0 C-N-CA 127.457 2.303 . . . . 1.0 113.219 172.909 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 102.32 13.81 29.85 Favored Glycine 0 N--CA 1.429 -1.796 0 O-C-N 120.37 -1.456 . . . . 1.0 114.186 170.145 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 3.5 m -112.3 174.02 6.08 Favored 'General case' 0 N--CA 1.43 -1.458 0 C-N-CA 124.473 1.109 . . . . 1.0 109.036 172.083 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 20.9 pttm -156.9 148.92 22.85 Favored 'General case' 0 N--CA 1.431 -1.393 0 O-C-N 120.938 -1.101 . . . . 1.0 113.378 -160.863 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 49' ' ' ILE . . . . . 0.415 HD13 HG23 ' A' ' 64' ' ' THR . 7.5 mm -97.13 138.44 22.07 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.454 0 N-CA-C 106.355 -1.72 . . . . 1.0 106.355 171.171 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 4.1 mm -122.77 115.89 47.21 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.473 0 CA-C-N 119.598 1.09 . . . . 1.0 110.233 -175.953 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 2.1 mt -129.4 126.22 63.19 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.501 0 O-C-N 120.536 -1.352 . . . . 1.0 110.61 176.868 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 52' ' ' ASN . . . . . 0.55 ' H ' ' HD1' ' A' ' 61' ' ' TRP . 15.1 p30 -151.2 165.47 33.82 Favored 'General case' 0 N--CA 1.429 -1.509 0 CA-C-O 122.971 1.367 . . . . 1.0 108.592 176.923 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 40.1 ptt85 -148.78 152.44 36.55 Favored 'General case' 0 N--CA 1.431 -1.41 0 CA-C-N 114.474 -1.239 . . . . 1.0 108.877 -172.67 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 68.8 mm-40 -116.4 107.99 15.48 Favored 'General case' 0 N--CA 1.429 -1.478 0 N-CA-C 107.026 -1.472 . . . . 1.0 107.026 171.46 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 15.5 tt0 -58.95 -41.61 89.45 Favored Pre-proline 0 N--CA 1.43 -1.435 0 N-CA-C 116.112 1.893 . . . . 1.0 116.112 -172.504 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 83.7 Cg_exo -69.25 -18.49 39.39 Favored 'Trans proline' 0 N--CA 1.433 -2.052 0 CA-C-N 126.173 3.24 . . . . 1.0 117.79 178.185 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . 0.381 3.9 pp -96.72 -14.41 22.05 Favored 'General case' 0 N--CA 1.431 -1.414 0 N-CA-C 116.744 2.127 . . . . 1.0 116.744 -170.766 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 5.9 m170 73.23 52.96 0.13 Allowed 'General case' 0 N--CA 1.43 -1.436 0 C-N-CA 125.003 1.321 . . . . 1.0 114.536 174.095 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 34.0 tt0 -162.05 158.26 24.66 Favored 'General case' 0 N--CA 1.43 -1.438 0 C-N-CA 124.515 1.126 . . . . 1.0 108.079 172.45 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 55.0 t -119.38 152.76 21.87 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.48 0 C-N-CA 126.106 1.762 . . . . 1.0 110.408 178.997 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 61' ' ' TRP . . . . . 0.55 ' HD1' ' H ' ' A' ' 52' ' ' ASN . 0.0 OUTLIER -104.84 152.59 22.42 Favored 'General case' 0 N--CA 1.43 -1.448 0 C-N-CA 125.463 1.505 . . . . 1.0 109.471 176.026 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -145.12 97.02 2.94 Favored 'General case' 0 N--CA 1.431 -1.401 0 O-C-N 120.804 -1.185 . . . . 1.0 110.548 -176.874 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -122.6 149.18 44.33 Favored 'General case' 0 N--CA 1.431 -1.416 0 O-C-N 119.708 -1.87 . . . . 1.0 115.993 179.508 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 64' ' ' THR . . . . . 0.415 HG23 HD13 ' A' ' 49' ' ' ILE . 5.9 m -151.24 -94.69 0.06 Allowed 'General case' 0 N--CA 1.429 -1.482 0 C-N-CA 125.504 1.522 . . . . 1.0 111.269 175.041 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 10.7 tmtt? -99.59 -44.26 6.2 Favored 'General case' 0 N--CA 1.43 -1.448 0 C-N-CA 125.217 1.407 . . . . 1.0 110.387 -172.555 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 33.3 mm-40 -70.33 -23.57 62.85 Favored 'General case' 0 N--CA 1.43 -1.469 0 N-CA-C 113.831 1.048 . . . . 1.0 113.831 -174.403 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 136.75 -39.62 1.62 Allowed Glycine 0 N--CA 1.43 -1.757 0 O-C-N 121.398 -0.814 . . . . 1.0 111.9 166.774 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 140.95 123.86 1.99 Allowed Glycine 0 N--CA 1.43 -1.718 0 CA-C-O 122.279 0.933 . . . . 1.0 113.434 -179.842 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 21.5 m-30 -115.55 170.09 8.68 Favored 'General case' 0 N--CA 1.431 -1.424 0 C-N-CA 126.383 1.873 . . . . 1.0 107.189 176.744 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -115.29 161.02 19.07 Favored 'General case' 0 N--CA 1.43 -1.451 0 O-C-N 120.366 -1.459 . . . . 1.0 110.032 168.2 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 71' ' ' PHE . . . . . . . . . . . . 0.279 28.7 t80 -140.1 126.16 19.75 Favored 'General case' 0 N--CA 1.431 -1.413 0 C-N-CA 123.836 0.854 . . . . 1.0 109.889 -151.437 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 35.0 m-20 -136.73 156.51 48.42 Favored 'General case' 0 N--CA 1.43 -1.453 0 CA-C-O 121.994 0.902 . . . . 1.0 111.48 179.401 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 67.9 tp -84.69 136.72 33.61 Favored 'General case' 0 N--CA 1.43 -1.454 0 O-C-N 120.411 -1.431 . . . . 1.0 111.757 173.007 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 72.4 mmtt -89.19 -86.17 0.19 Allowed 'General case' 0 N--CA 1.43 -1.455 0 C-N-CA 124.868 1.267 . . . . 1.0 110.282 161.907 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -138.09 -55.31 0.05 OUTLIER Glycine 0 N--CA 1.428 -1.856 0 O-C-N 120.723 -1.235 . . . . 1.0 112.732 175.451 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 78.7 m-20 -97.2 -20.15 18.12 Favored 'General case' 0 N--CA 1.43 -1.467 0 C-N-CA 124.663 1.185 . . . . 1.0 110.755 173.742 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 26.6 tt0 -133.98 121.33 21.47 Favored 'General case' 0 N--CA 1.43 -1.441 0 N-CA-C 107.168 -1.419 . . . . 1.0 107.168 -151.673 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 78' ' ' TRP . . . . . . . . . . . . . 48.7 m95 -83.72 107.14 15.96 Favored 'General case' 0 N--CA 1.431 -1.403 0 N-CA-C 106.626 -1.62 . . . . 1.0 106.626 167.251 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER -93.2 154.28 3.25 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.467 0 CA-C-O 123.425 1.583 . . . . 1.0 107.142 178.885 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 59.2 m -84.08 125.59 32.26 Favored 'General case' 0 N--CA 1.431 -1.422 0 O-C-N 120.65 -1.281 . . . . 1.0 108.153 173.191 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 38.5 t70 -69.57 -53.77 17.29 Favored 'General case' 0 N--CA 1.43 -1.46 0 C-N-CA 126.38 1.872 . . . . 1.0 110.621 -173.551 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -76.46 137.23 39.56 Favored 'General case' 0 N--CA 1.428 -1.535 0 C-N-CA 125.961 1.704 . . . . 1.0 108.515 177.655 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 48.9 m 73.11 -59.63 0.56 Allowed 'General case' 0 N--CA 1.429 -1.52 0 C-N-CA 125.966 1.707 . . . . 1.0 113.161 -170.846 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 112.09 92.28 2.05 Favored Glycine 0 N--CA 1.429 -1.767 0 N-CA-C 109.008 -1.637 . . . . 1.0 109.008 -177.522 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -153.22 -154.04 0.51 Allowed 'General case' 0 N--CA 1.429 -1.485 0 CA-C-N 118.67 1.235 . . . . 1.0 109.513 -170.409 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 51.7 m -150.38 131.57 14.48 Favored 'General case' 0 N--CA 1.429 -1.489 0 O-C-N 120.671 -1.268 . . . . 1.0 109.501 -157.451 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . 0.26 0.0 OUTLIER -36.53 -91.63 0.0 OUTLIER 'General case' 0 N--CA 1.43 -1.462 0 N-CA-C 121.45 3.87 . . . . 1.0 121.45 178.827 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 88' ' ' TRP . . . . . . . . . . . . . 91.6 m95 -63.68 -27.87 69.52 Favored 'General case' 0 N--CA 1.429 -1.509 0 O-C-N 120.009 -1.682 . . . . 1.0 113.146 -173.198 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 3.2 t70 -68.9 -44.25 73.59 Favored 'General case' 0 N--CA 1.431 -1.41 0 C-N-CA 126.125 1.77 . . . . 1.0 112.601 175.857 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 45.1 tp -66.05 -45.15 82.42 Favored 'General case' 0 N--CA 1.43 -1.469 0 O-C-N 120.44 -1.413 . . . . 1.0 111.037 177.57 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 26.3 tp -55.92 -43.14 77.07 Favored 'General case' 0 N--CA 1.43 -1.475 0 C-N-CA 124.528 1.131 . . . . 1.0 113.472 175.868 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 34.6 tt0 -60.53 -47.49 85.93 Favored 'General case' 0 N--CA 1.431 -1.412 0 C-N-CA 126.254 1.821 . . . . 1.0 112.889 173.036 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 24.0 tt0 -59.18 -54.32 48.23 Favored 'General case' 0 N--CA 1.429 -1.48 0 C-N-CA 126.652 1.981 . . . . 1.0 113.45 177.538 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -54.05 -41.89 68.61 Favored 'General case' 0 N--CA 1.429 -1.48 0 C-N-CA 127.972 2.509 . . . . 1.0 114.264 175.328 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -73.94 -51.72 15.17 Favored 'General case' 0 N--CA 1.43 -1.436 0 N-CA-C 114.781 1.4 . . . . 1.0 114.781 178.546 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 1.6 t -61.16 -26.35 67.64 Favored 'General case' 0 N--CA 1.43 -1.464 0 O-C-N 119.236 -2.165 . . . . 1.0 114.1 175.809 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 7.5 tp-100 -62.65 -70.0 0.23 Allowed 'General case' 0 N--CA 1.43 -1.453 0 C-N-CA 126.31 1.844 . . . . 1.0 112.431 168.139 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 18.4 mt-30 -76.98 -48.31 18.37 Favored 'General case' 0 N--CA 1.43 -1.434 0 N-CA-C 116.411 2.004 . . . . 1.0 116.411 -175.369 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -73.5 -36.5 65.77 Favored 'General case' 0 N--CA 1.431 -1.414 0 O-C-N 120.059 -1.651 . . . . 1.0 112.067 -177.464 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . 93.1 28.3 12.08 Favored Glycine 0 N--CA 1.43 -1.719 0 C-N-CA 123.927 0.775 . . . . 1.0 113.956 171.981 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 27.7 mt-10 -145.91 168.92 19.67 Favored 'General case' 0 N--CA 1.431 -1.421 0 O-C-N 121.821 -0.811 . . . . 1.0 111.401 -172.749 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 6.8 m -78.91 78.92 5.33 Favored 'General case' 0 N--CA 1.431 -1.399 0 CA-C-O 122.792 1.282 . . . . 1.0 110.61 173.554 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 47.4 t -93.05 93.36 4.13 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.436 0 C-N-CA 126.687 1.995 . . . . 1.0 106.73 174.571 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 7.9 t -140.47 166.37 24.89 Favored 'General case' 0 N--CA 1.429 -1.48 0 CA-C-N 115.324 -0.853 . . . . 1.0 110.609 -175.367 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -120.3 -12.79 8.97 Favored 'General case' 0 N--CA 1.43 -1.444 0 C-N-CA 125.061 1.345 . . . . 1.0 109.714 175.935 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 75.6 mtm180 . . . . . 0 C--O 1.26 1.617 0 O-C-N 120.519 -1.363 . . . . 1.0 111.839 -174.174 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 7.3 m120 . . . . . 0 N--CA 1.429 -1.481 0 N-CA-C 114.117 1.154 . . . . 1.0 114.117 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 3.1 m-20 -59.33 -54.42 47.0 Favored 'General case' 0 N--CA 1.431 -1.391 0 C-N-CA 125.612 1.565 . . . . 1.0 111.656 176.581 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 23.1 t -57.7 -45.21 85.99 Favored 'General case' 0 N--CA 1.431 -1.411 0 C-N-CA 126.344 1.857 . . . . 1.0 113.558 177.01 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 88.0 tt0 -54.74 -60.51 3.26 Favored 'General case' 0 N--CA 1.431 -1.402 0 C-N-CA 126.08 1.752 . . . . 1.0 113.723 176.051 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 1.1 t80 -67.31 -25.21 65.91 Favored 'General case' 0 N--CA 1.43 -1.444 0 N-CA-C 115.4 1.63 . . . . 1.0 115.4 179.934 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 16.7 t60 -64.75 -46.01 84.03 Favored 'General case' 0 N--CA 1.43 -1.444 0 C-N-CA 125.935 1.694 . . . . 1.0 113.42 171.355 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 18.4 mmm180 -61.59 -48.89 78.88 Favored 'General case' 0 N--CA 1.431 -1.425 0 C-N-CA 124.958 1.303 . . . . 1.0 112.576 174.625 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 90.6 mt -57.07 -41.02 78.0 Favored 'General case' 0 N--CA 1.43 -1.431 0 C-N-CA 124.379 1.072 . . . . 1.0 113.133 174.449 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -58.88 -53.33 59.58 Favored 'General case' 0 N--CA 1.431 -1.413 0 C-N-CA 125.948 1.699 . . . . 1.0 113.349 176.304 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -56.04 -41.81 75.57 Favored 'General case' 0 N--CA 1.431 -1.399 0 N-CA-C 114.003 1.112 . . . . 1.0 114.003 176.432 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 97.1 mm-40 -63.0 -51.07 68.25 Favored 'General case' 0 N--CA 1.431 -1.415 0 N-CA-C 114.614 1.338 . . . . 1.0 114.614 174.961 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 3.6 pp -70.57 -39.72 73.74 Favored 'General case' 0 N--CA 1.429 -1.5 0 O-C-N 120.135 -1.603 . . . . 1.0 114.517 -179.925 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 0.2 OUTLIER -50.83 -49.89 57.78 Favored 'General case' 0 N--CA 1.43 -1.472 0 C-N-CA 125.789 1.636 . . . . 1.0 113.682 168.78 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 45.2 tp -62.51 -47.45 83.89 Favored 'General case' 0 N--CA 1.43 -1.461 0 O-C-N 121.402 -0.811 . . . . 1.0 112.673 177.167 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 20.2 m -64.75 -50.31 67.36 Favored 'General case' 0 N--CA 1.43 -1.43 0 C-N-CA 124.544 1.138 . . . . 1.0 114.069 -177.376 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 79.9 mt -54.62 -49.37 67.79 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.474 0 O-C-N 119.781 -1.825 . . . . 1.0 114.593 169.447 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 22.8 tt0 -59.35 -47.28 86.02 Favored 'General case' 0 N--CA 1.429 -1.495 0 O-C-N 120.555 -1.341 . . . . 1.0 112.175 177.006 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 3.5 tt0 -56.53 -40.63 75.4 Favored 'General case' 0 N--CA 1.43 -1.453 0 C-N-CA 125.053 1.341 . . . . 1.0 113.801 175.012 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 49.8 tpt85 -57.92 -51.05 71.23 Favored 'General case' 0 N--CA 1.429 -1.476 0 O-C-N 119.309 -2.119 . . . . 1.0 113.255 172.06 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 4.6 mm? -72.71 -47.15 49.5 Favored 'General case' 0 N--CA 1.431 -1.387 0 N-CA-C 114.329 1.233 . . . . 1.0 114.329 -176.924 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 19.0 t70 -74.4 -49.15 23.73 Favored 'General case' 0 N--CA 1.43 -1.448 0 C-N-CA 125.605 1.562 . . . . 1.0 114.092 -175.012 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 13.6 t70 -84.45 -39.75 18.56 Favored 'General case' 0 N--CA 1.43 -1.452 0 O-C-N 120.446 -1.408 . . . . 1.0 113.124 -170.944 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 24' ' ' TRP . . . . . . . . . . . . . 4.5 t90 -85.67 106.48 16.98 Favored 'General case' 0 N--CA 1.43 -1.44 0 O-C-N 119.803 -1.811 . . . . 1.0 108.982 172.38 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 1.4 t70 -80.95 -172.05 3.51 Favored 'General case' 0 N--CA 1.431 -1.418 0 CA-C-O 123.179 1.466 . . . . 1.0 113.645 -165.018 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -166.39 -171.05 32.09 Favored Glycine 0 N--CA 1.43 -1.745 0 O-C-N 119.815 -1.803 . . . . 1.0 111.637 -172.191 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 1.7 t70 -83.28 -39.12 21.24 Favored 'General case' 0 N--CA 1.43 -1.461 0 O-C-N 121.429 -1.042 . . . . 1.0 110.789 178.501 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 22.6 m -81.92 160.33 23.42 Favored 'General case' 0 N--CA 1.429 -1.482 0 CA-C-O 122.279 1.038 . . . . 1.0 111.709 174.36 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 1.8 t70 -76.59 175.85 8.89 Favored 'General case' 0 N--CA 1.43 -1.434 0 C-N-CA 125.205 1.402 . . . . 1.0 111.057 176.094 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 10.2 tp -159.74 115.22 0.16 Allowed 'Isoleucine or valine' 0 N--CA 1.43 -1.44 0 CA-C-O 123.54 1.638 . . . . 1.0 111.005 -167.254 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 36.9 m-20 -125.26 102.68 7.56 Favored 'General case' 0 N--CA 1.43 -1.459 0 O-C-N 120.648 -1.282 . . . . 1.0 109.696 169.129 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 36.7 m -94.14 125.14 38.59 Favored 'General case' 0 N--CA 1.429 -1.482 0 O-C-N 119.18 -2.2 . . . . 1.0 111.093 166.289 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -90.36 131.93 35.87 Favored 'General case' 0 N--CA 1.429 -1.493 0 C-N-CA 125.074 1.35 . . . . 1.0 110.906 -176.298 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 3.3 mm -105.56 105.77 19.29 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.489 0 C-N-CA 126.479 1.912 . . . . 1.0 106.238 -178.836 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -132.89 63.81 1.63 Allowed 'General case' 0 N--CA 1.429 -1.475 0 O-C-N 121.392 -0.818 . . . . 1.0 111.613 -176.129 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . 33.46 67.4 0.22 Allowed Glycine 0 N--CA 1.43 -1.748 0 C-N-CA 128.671 3.034 . . . . 1.0 119.559 169.467 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 114.89 -22.67 12.4 Favored Glycine 0 N--CA 1.431 -1.645 0 N-CA-C 111.031 -0.827 . . . . 1.0 111.031 -173.933 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 72.8 t -109.63 137.22 42.81 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.424 0 C-N-CA 124.676 1.19 . . . . 1.0 108.269 173.889 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 42.8 mt -119.57 129.75 54.8 Favored 'General case' 0 N--CA 1.43 -1.464 0 O-C-N 120.812 -1.18 . . . . 1.0 108.923 154.557 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -122.95 118.14 27.15 Favored 'General case' 0 N--CA 1.429 -1.48 0 CA-C-O 122.91 1.338 . . . . 1.0 108.237 177.103 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 81.7 mt -97.3 128.38 48.62 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.439 0 O-C-N 120.638 -1.289 . . . . 1.0 108.398 -172.763 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 69.5 p -129.62 122.19 28.58 Favored 'General case' 0 N--CA 1.429 -1.517 0 CA-C-O 122.018 0.913 . . . . 1.0 113.205 175.271 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 43' ' ' PHE . . . . . . . . . . . . . 5.2 p90 -120.49 167.73 12.07 Favored 'General case' 0 N--CA 1.431 -1.412 0 C-N-CA 125.003 1.321 . . . . 1.0 109.544 166.138 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 40.4 mt-10 -52.4 -36.1 53.37 Favored 'General case' 0 N--CA 1.431 -1.418 0 N-CA-C 118.63 2.826 . . . . 1.0 118.63 -171.308 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 74.1 m-20 -67.47 -4.22 10.75 Favored 'General case' 0 N--CA 1.429 -1.516 0 O-C-N 120.229 -1.545 . . . . 1.0 115.095 177.495 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 75.54 22.46 75.29 Favored Glycine 0 N--CA 1.432 -1.597 0 O-C-N 120.073 -1.642 . . . . 1.0 115.536 160.881 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 53.5 m -73.65 -47.06 42.77 Favored 'General case' 0 N--CA 1.43 -1.447 0 C-N-CA 124.622 1.169 . . . . 1.0 112.956 -175.175 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 86.0 mttt 75.54 107.55 0.08 Allowed 'General case' 0 N--CA 1.429 -1.479 0 C-N-CA 126.889 2.076 . . . . 1.0 114.768 170.697 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 2.7 mm -102.18 136.23 35.35 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.429 0 N-CA-C 107.367 -1.346 . . . . 1.0 107.367 -177.095 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 9.3 mm -126.18 105.25 14.18 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.437 0 C-N-CA 124.075 0.95 . . . . 1.0 109.359 -169.587 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 3.5 mt -126.88 128.25 70.63 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.416 0 O-C-N 120.249 -1.532 . . . . 1.0 109.936 -170.823 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 51.8 t-20 -161.87 170.84 18.74 Favored 'General case' 0 N--CA 1.43 -1.469 0 N-CA-C 105.197 -2.149 . . . . 1.0 105.197 -167.856 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -156.61 138.03 13.93 Favored 'General case' 0 N--CA 1.43 -1.465 0 O-C-N 121.185 -0.947 . . . . 1.0 113.194 -163.674 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 86.9 mm-40 -99.33 105.21 17.18 Favored 'General case' 0 N--CA 1.431 -1.416 0 C-N-CA 125.71 1.604 . . . . 1.0 109.096 166.574 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . 0.272 9.7 tt0 -65.64 -52.46 43.3 Favored Pre-proline 0 N--CA 1.431 -1.379 0 N-CA-C 116.891 2.182 . . . . 1.0 116.891 -164.419 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 51.7 Cg_exo -68.57 -21.0 40.33 Favored 'Trans proline' 0 C--N 1.299 -2.071 0 CA-C-N 126.3 3.286 . . . . 1.0 115.342 -177.591 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 32.3 mt -74.96 -25.52 58.92 Favored 'General case' 0 N--CA 1.429 -1.495 0 CA-C-N 119.507 1.048 . . . . 1.0 112.019 -174.955 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 25.5 m170 79.38 30.42 0.3 Allowed 'General case' 0 N--CA 1.431 -1.423 0 C-N-CA 128.056 2.543 . . . . 1.0 113.018 -178.767 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 65.1 mt-30 -120.02 132.63 55.53 Favored 'General case' 0 N--CA 1.43 -1.427 0 O-C-N 120.271 -1.518 . . . . 1.0 110.292 176.283 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 8.0 t -90.44 151.57 3.47 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.404 0 N-CA-C 106.515 -1.661 . . . . 1.0 106.515 163.178 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 61' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -111.38 145.65 38.52 Favored 'General case' 0 N--CA 1.43 -1.439 0 O-C-N 120.28 -1.512 . . . . 1.0 107.769 168.866 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 2.6 pt? -138.12 111.25 7.86 Favored 'General case' 0 N--CA 1.432 -1.361 0 O-C-N 120.966 -1.083 . . . . 1.0 108.299 173.471 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 63' ' ' ALA . . . . . 0.453 ' HA ' ' HA2' ' A' ' 68' ' ' GLY . . . -101.6 144.08 30.78 Favored 'General case' 0 N--CA 1.429 -1.48 0 CA-C-O 123.626 1.679 . . . . 1.0 112.291 169.808 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 64' ' ' THR . . . . . . . . . . . . . 39.1 p -150.61 -165.82 2.37 Favored 'General case' 0 N--CA 1.43 -1.431 0 CA-C-N 113.034 -1.894 . . . . 1.0 107.991 -145.973 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 11.7 mmtt -65.13 -43.37 92.17 Favored 'General case' 0 N--CA 1.43 -1.47 0 N-CA-C 115.025 1.491 . . . . 1.0 115.025 168.583 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 29.6 mp0 -79.12 -25.56 42.94 Favored 'General case' 0 N--CA 1.43 -1.462 0 O-C-N 120.208 -1.558 . . . . 1.0 115.075 -170.208 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 159.69 -48.5 0.4 Allowed Glycine 0 N--CA 1.43 -1.735 0 O-C-N 120.37 -1.456 . . . . 1.0 114.557 176.001 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 68' ' ' GLY . . . . . 0.453 ' HA2' ' HA ' ' A' ' 63' ' ' ALA . . . 120.39 121.36 2.87 Favored Glycine 0 N--CA 1.43 -1.725 0 CA-C-O 122.569 1.094 . . . . 1.0 114.901 -179.575 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 23.0 m-30 -122.37 171.09 9.31 Favored 'General case' 0 N--CA 1.429 -1.493 0 C-N-CA 125.499 1.52 . . . . 1.0 108.879 -177.253 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 3.6 p-80 -122.57 161.73 23.15 Favored 'General case' 0 N--CA 1.43 -1.434 0 O-C-N 120.293 -1.505 . . . . 1.0 109.384 169.102 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 71' ' ' PHE . . . . . . . . . . . . 0.286 37.3 t80 -139.43 122.29 16.59 Favored 'General case' 0 N--CA 1.431 -1.398 0 C-N-CA 124.116 0.967 . . . . 1.0 111.57 -145.953 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 11.9 m-20 -129.16 148.86 51.13 Favored 'General case' 0 N--CA 1.43 -1.426 0 C-N-CA 125.329 1.452 . . . . 1.0 113.044 -177.312 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 3.0 tm? -84.42 114.64 22.05 Favored 'General case' 0 N--CA 1.43 -1.457 0 C-N-CA 127.041 2.136 . . . . 1.0 111.699 -179.592 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 76.7 tttt -89.48 -52.6 4.94 Favored 'General case' 0 N--CA 1.43 -1.47 0 O-C-N 120.959 -1.088 . . . . 1.0 110.931 174.463 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -164.65 -78.79 0.04 OUTLIER Glycine 0 N--CA 1.43 -1.76 0 O-C-N 120.688 -1.258 . . . . 1.0 114.069 177.052 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 50.9 m-20 -96.03 -5.25 41.5 Favored 'General case' 0 N--CA 1.43 -1.45 0 O-C-N 120.366 -1.667 . . . . 1.0 111.357 -176.634 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 5.0 mt-10 -159.05 161.27 36.49 Favored 'General case' 0 CA--C 1.488 -1.404 0 N-CA-C 101.428 -3.545 . . . . 1.0 101.428 -176.286 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 78' ' ' TRP . . . . . . . . . . . . . 23.6 m95 -94.44 142.15 27.76 Favored 'General case' 0 N--CA 1.43 -1.439 0 N-CA-C 104.409 -2.441 . . . . 1.0 104.409 175.066 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 0.6 OUTLIER -93.71 149.93 4.14 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.399 0 N-CA-C 105.374 -2.084 . . . . 1.0 105.374 169.844 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 80' ' ' CYS . . . . . 0.417 ' HB2' ' HB2' ' A' ' 85' ' ' GLU . 90.0 m -88.61 114.39 25.18 Favored 'General case' 0 N--CA 1.43 -1.474 0 N-CA-C 106.383 -1.71 . . . . 1.0 106.383 169.972 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 21.1 t70 -61.54 -55.2 33.58 Favored 'General case' 0 N--CA 1.431 -1.414 0 C-N-CA 127.6 2.36 . . . . 1.0 113.949 -162.536 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -51.07 -61.34 2.29 Favored 'General case' 0 N--CA 1.43 -1.451 0 C-N-CA 126.675 1.99 . . . . 1.0 115.603 -165.878 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 68.4 m -85.01 -31.96 23.19 Favored 'General case' 0 N--CA 1.431 -1.396 0 O-C-N 120.558 -1.339 . . . . 1.0 111.95 174.934 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 97.51 79.93 1.5 Allowed Glycine 0 N--CA 1.43 -1.7 0 N-CA-C 109.699 -1.36 . . . . 1.0 109.699 -169.215 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 85' ' ' GLU . . . . . 0.417 ' HB2' ' HB2' ' A' ' 80' ' ' CYS . 36.8 mm-40 -142.32 -161.14 1.19 Allowed 'General case' 0 N--CA 1.428 -1.554 0 N-CA-C 106.967 -1.494 . . . . 1.0 106.967 -174.439 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 89.5 m -137.96 142.8 40.51 Favored 'General case' 0 N--CA 1.429 -1.495 0 O-C-N 119.727 -1.858 . . . . 1.0 109.863 -161.233 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 1.1 t80 -38.63 -94.37 0.0 OUTLIER 'General case' 0 N--CA 1.43 -1.461 0 C-N-CA 128.005 2.522 . . . . 1.0 117.807 177.055 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 88' ' ' TRP . . . . . 0.446 ' HB2' ' HG2' ' A' ' 106' ' ' ARG . 19.1 m95 -76.12 -26.53 56.45 Favored 'General case' 0 N--CA 1.43 -1.462 0 O-C-N 120.308 -1.495 . . . . 1.0 111.331 -166.968 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -59.85 -50.66 72.91 Favored 'General case' 0 N--CA 1.43 -1.461 0 C-N-CA 125.857 1.663 . . . . 1.0 113.554 172.258 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 46.3 tp -68.5 -43.67 76.36 Favored 'General case' 0 N--CA 1.43 -1.462 0 O-C-N 119.652 -1.905 . . . . 1.0 111.077 179.0 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 10.3 tt -50.53 -49.85 54.74 Favored 'General case' 0 N--CA 1.43 -1.427 0 C-N-CA 125.636 1.574 . . . . 1.0 113.449 172.749 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 16.8 tt0 -55.57 -49.08 73.67 Favored 'General case' 0 N--CA 1.43 -1.465 0 C-N-CA 127.018 2.127 . . . . 1.0 113.281 173.943 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 51.0 mt-30 -60.36 -48.3 82.34 Favored 'General case' 0 N--CA 1.431 -1.393 0 O-C-N 120.766 -1.209 . . . . 1.0 113.743 175.944 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -58.78 -49.33 78.06 Favored 'General case' 0 N--CA 1.43 -1.438 0 C-N-CA 125.378 1.471 . . . . 1.0 113.171 174.277 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -59.94 -45.91 91.1 Favored 'General case' 0 N--CA 1.429 -1.509 0 C-N-CA 126.143 1.777 . . . . 1.0 114.115 177.576 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 96.4 m -60.93 -36.47 79.41 Favored 'General case' 0 N--CA 1.431 -1.399 0 C-N-CA 125.713 1.605 . . . . 1.0 112.526 178.25 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -69.05 -59.62 2.92 Favored 'General case' 0 N--CA 1.428 -1.528 0 C-N-CA 124.388 1.075 . . . . 1.0 113.317 170.243 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 5.4 pt20 -76.54 -19.64 57.71 Favored 'General case' 0 N--CA 1.431 -1.406 0 N-CA-C 116.016 1.858 . . . . 1.0 116.016 -166.134 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -97.92 -35.98 10.31 Favored 'General case' 0 N--CA 1.431 -1.408 0 C-N-CA 124.793 1.237 . . . . 1.0 112.224 169.579 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . 106.95 10.76 27.63 Favored Glycine 0 N--CA 1.429 -1.77 0 N-CA-C 116.222 1.249 . . . . 1.0 116.222 170.048 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 6.7 pt-20 -149.34 160.98 42.95 Favored 'General case' 0 N--CA 1.43 -1.425 0 N-CA-C 105.655 -1.979 . . . . 1.0 105.655 -177.416 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 18.4 m -65.8 111.43 3.25 Favored 'General case' 0 N--CA 1.429 -1.482 0 CA-C-N 120.804 1.638 . . . . 1.0 112.177 -178.595 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 60.7 t -94.86 107.68 19.78 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.415 0 CA-C-O 122.993 1.378 . . . . 1.0 109.394 -178.005 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 70.0 m -80.2 106.15 12.0 Favored 'General case' 0 N--CA 1.43 -1.456 0 C-N-CA 124.622 1.169 . . . . 1.0 111.336 -176.516 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -140.58 -12.02 1.02 Allowed 'General case' 0 N--CA 1.43 -1.458 0 C-N-CA 123.133 0.573 . . . . 1.0 109.875 168.625 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 106' ' ' ARG . . . . . 0.446 ' HG2' ' HB2' ' A' ' 88' ' ' TRP . 0.0 OUTLIER . . . . . 0 C--O 1.261 1.69 0 C-N-CA 126.592 1.957 . . . . 1.0 110.882 179.212 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 17.9 t-20 . . . . . 0 N--CA 1.43 -1.434 0 CA-C-O 122.297 1.046 . . . . 1.0 110.238 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -64.0 -30.79 71.84 Favored 'General case' 0 CA--C 1.489 -1.402 0 C-N-CA 126.095 1.758 . . . . 1.0 114.614 -176.136 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 48.0 p -65.45 -46.87 78.17 Favored 'General case' 0 N--CA 1.43 -1.441 0 O-C-N 120.483 -1.386 . . . . 1.0 113.882 174.971 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 40.2 tt0 -68.03 -44.69 75.9 Favored 'General case' 0 N--CA 1.431 -1.422 0 O-C-N 120.606 -1.308 . . . . 1.0 112.723 176.668 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 28.3 t80 -50.4 -49.38 54.76 Favored 'General case' 0 N--CA 1.43 -1.439 0 N-CA-C 114.123 1.157 . . . . 1.0 114.123 168.856 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 1.2 t60 -61.03 -38.6 86.69 Favored 'General case' 0 N--CA 1.429 -1.498 0 O-C-N 120.649 -1.282 . . . . 1.0 114.382 175.048 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 1.2 mpt_? -56.26 -56.94 14.81 Favored 'General case' 0 N--CA 1.43 -1.426 0 CA-C-N 120.629 1.558 . . . . 1.0 112.185 172.816 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 80.4 mt -63.96 -41.57 97.54 Favored 'General case' 0 N--CA 1.429 -1.492 0 N-CA-C 114.135 1.161 . . . . 1.0 114.135 -179.161 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -67.18 -41.31 86.11 Favored 'General case' 0 N--CA 1.43 -1.474 0 C-N-CA 125.446 1.498 . . . . 1.0 114.774 -179.472 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -66.41 -38.76 88.19 Favored 'General case' 0 N--CA 1.431 -1.409 0 O-C-N 120.305 -1.497 . . . . 1.0 112.025 172.346 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 3.6 mt-30 -56.38 -54.09 49.63 Favored 'General case' 0 N--CA 1.43 -1.442 0 N-CA-C 115.829 1.788 . . . . 1.0 115.829 170.142 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 4.3 pp -63.91 -39.31 93.88 Favored 'General case' 0 N--CA 1.429 -1.479 0 N-CA-C 114.469 1.285 . . . . 1.0 114.469 179.387 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 7.3 m0 -49.71 -49.5 47.55 Favored 'General case' 0 N--CA 1.429 -1.481 0 N-CA-C 114.552 1.315 . . . . 1.0 114.552 168.759 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 41.9 tp -61.54 -51.52 68.23 Favored 'General case' 0 N--CA 1.429 -1.507 0 C-N-CA 124.21 1.004 . . . . 1.0 113.618 176.251 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 17.0 m -57.07 -43.08 81.75 Favored 'General case' 0 N--CA 1.43 -1.464 0 C-N-CA 125.613 1.565 . . . . 1.0 113.978 177.384 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 87.9 mt -59.12 -49.9 81.67 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.504 0 O-C-N 120.573 -1.33 . . . . 1.0 113.162 173.144 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 72.5 tt0 -63.02 -48.58 78.14 Favored 'General case' 0 N--CA 1.43 -1.473 0 O-C-N 120.594 -1.316 . . . . 1.0 112.715 -179.86 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 27.0 mm-40 -48.44 -59.72 3.25 Favored 'General case' 0 N--CA 1.428 -1.537 0 C-N-CA 126.569 1.948 . . . . 1.0 114.316 172.527 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 3.1 tpm_? -62.79 -37.82 88.19 Favored 'General case' 0 N--CA 1.43 -1.451 0 N-CA-C 113.8 1.037 . . . . 1.0 113.8 -176.627 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 4.3 mm? -70.65 -44.63 66.71 Favored 'General case' 0 N--CA 1.43 -1.456 0 O-C-N 120.482 -1.386 . . . . 1.0 113.7 177.084 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 25.5 t70 -68.24 -39.3 82.32 Favored 'General case' 0 N--CA 1.429 -1.475 0 O-C-N 120.775 -1.203 . . . . 1.0 113.542 -178.54 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 35.8 t70 -64.84 -26.59 68.4 Favored 'General case' 0 N--CA 1.43 -1.475 0 C-N-CA 125.841 1.656 . . . . 1.0 113.624 178.681 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 24' ' ' TRP . . . . . . . . . . . . . 0.1 OUTLIER -99.46 -145.84 0.33 Allowed 'General case' 0 N--CA 1.429 -1.48 0 N-CA-C 115.074 1.509 . . . . 1.0 115.074 -167.939 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . 0.306 0.9 OUTLIER 55.35 -157.44 0.23 Allowed 'General case' 0 N--CA 1.43 -1.449 0 C-N-CA 128.819 2.848 . . . . 1.0 116.221 -175.282 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 155.67 -44.85 0.54 Allowed Glycine 0 N--CA 1.432 -1.613 0 O-C-N 120.464 -1.397 . . . . 1.0 112.247 -179.019 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -77.68 -30.87 52.2 Favored 'General case' 0 N--CA 1.432 -1.368 0 CA-C-O 122.165 0.983 . . . . 1.0 111.595 -178.51 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 63.4 m -112.64 166.26 11.51 Favored 'General case' 0 N--CA 1.43 -1.435 0 C-N-CA 124.652 1.181 . . . . 1.0 110.136 174.742 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 29.8 t70 -93.5 141.22 28.71 Favored 'General case' 0 N--CA 1.43 -1.446 0 N-CA-C 106.904 -1.517 . . . . 1.0 106.904 167.421 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 5.8 tp -141.99 124.06 13.56 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.463 0 C-N-CA 126.376 1.871 . . . . 1.0 106.01 -169.558 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 13.7 t70 -140.48 128.55 22.16 Favored 'General case' 0 N--CA 1.43 -1.467 0 O-C-N 120.611 -1.306 . . . . 1.0 110.058 169.044 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 43.3 t -95.1 131.81 40.69 Favored 'General case' 0 N--CA 1.43 -1.43 0 O-C-N 120.018 -1.676 . . . . 1.0 108.074 173.509 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 23.3 mt-10 -107.62 140.27 40.9 Favored 'General case' 0 N--CA 1.429 -1.506 0 O-C-N 120.99 -1.069 . . . . 1.0 108.762 -170.242 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 3.1 tp -114.58 109.38 28.27 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.44 0 N-CA-C 105.617 -1.994 . . . . 1.0 105.617 167.011 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 77.5 m-20 -125.73 126.1 44.06 Favored 'General case' 0 N--CA 1.43 -1.427 0 N-CA-C 106.889 -1.523 . . . . 1.0 106.889 168.522 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . 67.42 -103.68 0.99 Allowed Glycine 0 N--CA 1.43 -1.728 0 C-N-CA 125.039 1.304 . . . . 1.0 112.607 -174.963 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -139.73 25.44 2.7 Favored Glycine 0 N--CA 1.43 -1.738 0 C-N-CA 124.186 0.898 . . . . 1.0 111.408 171.839 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 46.9 t -112.23 130.53 65.75 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.516 0 N-CA-C 106.97 -1.493 . . . . 1.0 106.97 179.063 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 23.9 mt -99.73 120.34 39.57 Favored 'General case' 0 N--CA 1.429 -1.499 0 CA-C-O 123.208 1.48 . . . . 1.0 107.883 172.141 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 1.6 p -113.76 122.33 46.77 Favored 'General case' 0 N--CA 1.43 -1.454 0 N-CA-C 106.995 -1.483 . . . . 1.0 106.995 179.63 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 61.7 mt -93.89 112.62 27.09 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.431 0 N-CA-C 105.787 -1.931 . . . . 1.0 105.787 -177.794 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 27.2 p -121.77 126.41 48.8 Favored 'General case' 0 N--CA 1.43 -1.448 0 CA-C-O 122.441 1.115 . . . . 1.0 113.221 -167.919 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 43' ' ' PHE . . . . . . . . . . . . . 3.0 p90 -120.77 167.76 12.14 Favored 'General case' 0 N--CA 1.43 -1.443 0 CA-C-O 122.749 1.261 . . . . 1.0 111.59 178.675 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -56.61 -33.01 65.85 Favored 'General case' 0 N--CA 1.43 -1.435 0 C-N-CA 127.953 2.501 . . . . 1.0 117.037 -170.077 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 70.9 m-80 -67.09 -15.8 63.94 Favored 'General case' 0 N--CA 1.431 -1.425 0 N-CA-C 115.037 1.495 . . . . 1.0 115.037 175.427 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 88.2 13.13 64.43 Favored Glycine 0 N--CA 1.431 -1.64 0 O-C-N 119.676 -1.89 . . . . 1.0 115.475 167.447 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 56.8 m -98.65 149.89 22.33 Favored 'General case' 0 N--CA 1.429 -1.504 0 N-CA-C 107.336 -1.357 . . . . 1.0 107.336 167.693 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -128.49 150.88 49.97 Favored 'General case' 0 N--CA 1.429 -1.5 0 O-C-N 121.378 -0.826 . . . . 1.0 110.063 -168.236 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 3.1 mm -105.17 133.31 49.77 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.508 0 N-CA-C 105.527 -2.027 . . . . 1.0 105.527 166.546 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 50' ' ' ILE . . . . . 0.478 ' HB ' ' HB3' ' A' ' 63' ' ' ALA . 5.7 mm -116.64 117.74 56.47 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.484 0 CA-C-N 119.733 1.151 . . . . 1.0 109.617 -173.158 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 3.2 mt -126.93 116.27 44.13 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.432 0 CA-C-O 124.047 1.88 . . . . 1.0 112.179 -175.469 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 52' ' ' ASN . . . . . 0.636 ' H ' ' HD1' ' A' ' 61' ' ' TRP . 56.2 t30 -141.82 170.63 15.35 Favored 'General case' 0 N--CA 1.43 -1.449 0 C-N-CA 128.354 2.662 . . . . 1.0 106.27 -179.274 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -154.29 130.89 10.66 Favored 'General case' 0 N--CA 1.431 -1.408 0 CA-C-O 122.834 1.302 . . . . 1.0 109.289 -170.365 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 28.9 mm-40 -89.73 129.87 36.08 Favored 'General case' 0 N--CA 1.429 -1.477 0 N-CA-C 106.531 -1.655 . . . . 1.0 106.531 175.921 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 67.6 mt-10 -63.75 -47.99 80.56 Favored Pre-proline 0 N--CA 1.431 -1.42 0 N-CA-C 116.687 2.106 . . . . 1.0 116.687 -179.606 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 97.3 Cg_endo -74.52 153.39 44.26 Favored 'Trans proline' 0 C--N 1.299 -2.036 0 CA-C-N 126.531 3.368 . . . . 1.0 111.388 163.403 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . 0.388 5.4 mp 72.57 143.05 0.06 Allowed 'General case' 0 N--CA 1.43 -1.457 0 CA-C-O 124.754 2.216 . . . . 1.0 113.445 -168.203 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 21.2 m170 -88.93 44.32 1.2 Allowed 'General case' 0 N--CA 1.43 -1.446 0 C-N-CA 125.318 1.447 . . . . 1.0 112.904 -175.899 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 11.7 pt20 -140.0 145.44 37.81 Favored 'General case' 0 N--CA 1.43 -1.456 0 O-C-N 120.045 -1.66 . . . . 1.0 110.53 -172.077 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 86.7 t -111.88 156.08 13.05 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.457 0 N-CA-C 107.023 -1.473 . . . . 1.0 107.023 -178.679 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 61' ' ' TRP . . . . . 0.636 ' HD1' ' H ' ' A' ' 52' ' ' ASN . 0.0 OUTLIER -102.06 152.35 21.08 Favored 'General case' 0 N--CA 1.43 -1.455 0 O-C-N 120.054 -1.653 . . . . 1.0 113.011 174.784 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 75.6 mt -127.91 107.54 9.94 Favored 'General case' 0 CA--C 1.488 -1.409 0 N-CA-C 106.994 -1.484 . . . . 1.0 106.994 166.175 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 63' ' ' ALA . . . . . 0.478 ' HB3' ' HB ' ' A' ' 50' ' ' ILE . . . -95.19 145.14 25.25 Favored 'General case' 0 N--CA 1.429 -1.476 0 CA-C-O 122.801 1.286 . . . . 1.0 111.16 163.288 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 64' ' ' THR . . . . . . . . . . . . . 69.2 p -150.3 -168.1 3.01 Favored 'General case' 0 N--CA 1.43 -1.462 0 C-N-CA 126.182 1.793 . . . . 1.0 108.617 -150.583 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 7.1 tmtm? -62.12 -46.82 87.33 Favored 'General case' 0 N--CA 1.431 -1.411 0 C-N-CA 125.889 1.676 . . . . 1.0 112.435 174.693 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 48.9 tt0 -78.04 -24.51 47.75 Favored 'General case' 0 N--CA 1.429 -1.519 0 N-CA-C 114.516 1.302 . . . . 1.0 114.516 -170.718 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 151.06 -53.14 0.49 Allowed Glycine 0 N--CA 1.43 -1.725 0 O-C-N 120.893 -1.129 . . . . 1.0 110.89 176.963 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 134.83 162.06 9.67 Favored Glycine 0 N--CA 1.43 -1.736 0 CA-C-O 122.818 1.232 . . . . 1.0 115.839 174.448 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 4.7 m-85 -135.32 161.99 33.85 Favored 'General case' 0 N--CA 1.43 -1.442 0 C-N-CA 126.415 1.886 . . . . 1.0 107.148 -173.318 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 25.0 p80 -114.98 159.72 20.43 Favored 'General case' 0 N--CA 1.43 -1.433 0 O-C-N 119.797 -1.815 . . . . 1.0 108.586 156.025 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 37.3 p90 -136.96 141.47 42.61 Favored 'General case' 0 N--CA 1.43 -1.471 0 N-CA-C 114.694 1.368 . . . . 1.0 114.694 -168.755 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 8.9 m-20 -121.63 175.81 6.03 Favored 'General case' 0 N--CA 1.429 -1.491 0 C-N-CA 126.448 1.899 . . . . 1.0 110.391 -170.495 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 27.1 tp -113.82 110.25 19.84 Favored 'General case' 0 N--CA 1.429 -1.521 0 O-C-N 119.718 -1.864 . . . . 1.0 113.072 -174.616 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 12.2 mmmt -68.41 -42.46 78.96 Favored 'General case' 0 N--CA 1.431 -1.379 0 O-C-N 120.497 -1.377 . . . . 1.0 112.641 168.45 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . 165.08 -86.9 0.1 Allowed Glycine 0 N--CA 1.43 -1.764 0 N-CA-C 110.074 -1.211 . . . . 1.0 110.074 176.997 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 11.6 t0 -91.82 29.65 1.52 Allowed 'General case' 0 N--CA 1.43 -1.46 0 O-C-N 120.988 -1.301 . . . . 1.0 111.96 176.659 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 2.1 pt-20 -169.07 124.61 0.89 Allowed 'General case' 0 N--CA 1.429 -1.484 0 C-N-CA 126.33 1.852 . . . . 1.0 106.523 -173.772 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 78' ' ' TRP . . . . . . . . . . . . . 89.9 m95 -80.46 130.67 35.3 Favored 'General case' 0 N--CA 1.43 -1.462 0 N-CA-C 106.339 -1.726 . . . . 1.0 106.339 162.627 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -124.55 141.12 45.73 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.436 0 O-C-N 119.313 -2.117 . . . . 1.0 109.866 -173.777 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 21.2 m -81.64 121.17 26.01 Favored 'General case' 0 N--CA 1.429 -1.492 0 O-C-N 120.243 -1.535 . . . . 1.0 113.21 -172.572 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 30.0 t70 -83.11 58.33 4.38 Favored 'General case' 0 N--CA 1.43 -1.465 0 O-C-N 119.769 -1.832 . . . . 1.0 112.467 -173.172 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 15.6 tpt85 -170.45 101.29 0.26 Allowed 'General case' 0 N--CA 1.43 -1.437 0 O-C-N 120.433 -1.417 . . . . 1.0 110.053 178.039 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 4.3 t 79.48 -50.28 0.4 Allowed 'General case' 0 N--CA 1.43 -1.463 0 C-N-CA 126.695 1.998 . . . . 1.0 116.121 169.039 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -153.79 96.15 0.16 Allowed Glycine 0 N--CA 1.43 -1.732 0 O-C-N 120.214 -1.554 . . . . 1.0 110.015 -172.593 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 5.5 pt-20 -82.43 102.71 11.48 Favored 'General case' 0 N--CA 1.428 -1.539 0 N-CA-C 117.99 2.589 . . . . 1.0 117.99 -162.834 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 10.4 m -165.66 126.71 1.89 Allowed 'General case' 0 N--CA 1.43 -1.458 0 O-C-N 119.543 -1.973 . . . . 1.0 113.339 172.333 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 3.0 t80 -57.09 -84.34 0.01 OUTLIER 'General case' 0 N--CA 1.43 -1.438 0 N-CA-C 118.018 2.599 . . . . 1.0 118.018 177.192 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 88' ' ' TRP . . . . . . . . . . . . . 46.7 m95 -61.38 -27.81 68.79 Favored 'General case' 0 N--CA 1.431 -1.424 0 C-N-CA 125.876 1.67 . . . . 1.0 113.324 -167.295 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -77.27 -45.03 27.69 Favored 'General case' 0 N--CA 1.429 -1.492 0 C-N-CA 126.685 1.994 . . . . 1.0 112.896 179.558 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 25.6 tp -71.36 -38.89 71.56 Favored 'General case' 0 N--CA 1.429 -1.489 0 O-C-N 118.875 -2.391 . . . . 1.0 112.734 176.951 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 17.7 tp -51.58 -44.98 62.96 Favored 'General case' 0 N--CA 1.431 -1.391 0 C-N-CA 126.608 1.963 . . . . 1.0 114.483 168.027 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 38.5 tt0 -56.66 -47.18 80.37 Favored 'General case' 0 N--CA 1.431 -1.407 0 C-N-CA 126.318 1.847 . . . . 1.0 113.93 170.168 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 38.1 tt0 -57.05 -50.77 71.73 Favored 'General case' 0 N--CA 1.43 -1.448 0 C-N-CA 125.63 1.572 . . . . 1.0 114.427 176.938 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -56.56 -48.49 77.21 Favored 'General case' 0 N--CA 1.429 -1.478 0 C-N-CA 126.148 1.779 . . . . 1.0 114.121 173.969 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -65.69 -48.77 70.91 Favored 'General case' 0 N--CA 1.431 -1.415 0 O-C-N 120.339 -1.476 . . . . 1.0 113.682 179.45 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 94.0 m -47.13 -51.45 18.05 Favored 'General case' 0 N--CA 1.43 -1.465 0 C-N-CA 127.38 2.272 . . . . 1.0 113.97 173.986 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 8.4 pt20 -72.98 -37.02 67.19 Favored 'General case' 0 N--CA 1.431 -1.421 0 N-CA-C 114.692 1.368 . . . . 1.0 114.692 -179.173 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 41.7 mt-30 -71.22 -42.08 69.37 Favored 'General case' 0 N--CA 1.431 -1.411 0 N-CA-C 115.655 1.724 . . . . 1.0 115.655 178.741 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -82.82 -41.21 19.36 Favored 'General case' 0 N--CA 1.431 -1.421 0 N-CA-C 113.622 0.971 . . . . 1.0 113.622 -179.604 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . 89.59 42.69 5.39 Favored Glycine 0 N--CA 1.431 -1.669 0 O-C-N 120.667 -1.271 . . . . 1.0 112.984 -177.991 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 4.3 tp10 -158.92 164.85 35.27 Favored 'General case' 0 N--CA 1.43 -1.468 0 N-CA-C 103.252 -2.869 . . . . 1.0 103.252 -177.291 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 90.4 m -76.88 87.21 3.45 Favored 'General case' 0 N--CA 1.431 -1.383 0 CA-C-N 120.533 1.515 . . . . 1.0 109.339 169.666 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 18.0 t -95.45 84.01 1.53 Allowed 'Isoleucine or valine' 0 N--CA 1.43 -1.426 0 CA-C-O 124.297 1.999 . . . . 1.0 108.73 -179.265 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 71.5 p -96.72 168.07 10.73 Favored 'General case' 0 N--CA 1.431 -1.403 0 C-N-CA 126.783 2.033 . . . . 1.0 111.114 -177.6 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 20.2 m-85 -104.57 -27.05 12.1 Favored 'General case' 0 N--CA 1.429 -1.479 0 O-C-N 120.768 -1.207 . . . . 1.0 109.278 162.134 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 16.5 mmm-85 . . . . . 0 C--O 1.259 1.602 0 C-N-CA 124.354 1.061 . . . . 1.0 111.409 -170.957 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 29.2 m-80 . . . . . 0 N--CA 1.43 -1.468 0 CA-C-O 121.815 0.817 . . . . 1.0 109.782 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 28.3 p-10 -69.71 -56.23 7.77 Favored 'General case' 0 CA--C 1.488 -1.408 0 C-N-CA 125.586 1.554 . . . . 1.0 113.777 -176.357 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 33.4 m -59.46 -45.07 92.67 Favored 'General case' 0 N--CA 1.431 -1.403 0 C-N-CA 124.698 1.199 . . . . 1.0 112.417 174.146 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 8.4 mm-40 -52.5 -63.29 1.19 Allowed 'General case' 0 N--CA 1.429 -1.482 0 C-N-CA 126.491 1.916 . . . . 1.0 113.137 178.297 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 7.6 m-85 -62.12 -27.59 69.04 Favored 'General case' 0 N--CA 1.43 -1.462 0 N-CA-C 115.838 1.792 . . . . 1.0 115.838 177.089 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 0.7 OUTLIER -61.52 -52.6 63.8 Favored 'General case' 0 N--CA 1.429 -1.475 0 N-CA-C 114.441 1.274 . . . . 1.0 114.441 171.792 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 35.4 mtm180 -69.63 -39.14 77.33 Favored 'General case' 0 N--CA 1.431 -1.375 0 O-C-N 120.474 -1.391 . . . . 1.0 113.973 -179.793 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 66.7 mt -58.55 -41.7 86.19 Favored 'General case' 0 N--CA 1.431 -1.42 0 C-N-CA 125.05 1.34 . . . . 1.0 113.223 173.648 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -62.99 -45.91 90.17 Favored 'General case' 0 N--CA 1.429 -1.483 0 C-N-CA 125.312 1.445 . . . . 1.0 112.668 176.293 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 8.2 t70 -53.69 -57.53 10.48 Favored 'General case' 0 N--CA 1.43 -1.463 0 C-N-CA 124.42 1.088 . . . . 1.0 113.242 174.846 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 16.7 pt20 -64.1 -37.49 87.64 Favored 'General case' 0 N--CA 1.429 -1.478 0 N-CA-C 116.267 1.951 . . . . 1.0 116.267 -177.907 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 3.3 pp -65.06 -43.54 91.89 Favored 'General case' 0 N--CA 1.43 -1.44 0 O-C-N 120.174 -1.578 . . . . 1.0 113.376 174.928 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 23.1 m0 -52.62 -50.67 62.65 Favored 'General case' 0 N--CA 1.431 -1.413 0 N-CA-C 115.329 1.603 . . . . 1.0 115.329 173.222 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 25.3 mt -59.06 -48.4 81.75 Favored 'General case' 0 N--CA 1.429 -1.483 0 CA-C-O 121.944 0.878 . . . . 1.0 112.854 176.456 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 47.7 m -66.6 -45.82 77.94 Favored 'General case' 0 N--CA 1.43 -1.436 0 N-CA-C 114.456 1.28 . . . . 1.0 114.456 -175.748 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 96.7 mt -58.03 -45.9 88.07 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.462 0 O-C-N 119.988 -1.695 . . . . 1.0 112.143 172.677 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 8.0 tt0 -58.91 -48.3 81.94 Favored 'General case' 0 N--CA 1.43 -1.442 0 O-C-N 121.626 -0.671 . . . . 1.0 112.59 176.705 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 33.7 tt0 -58.47 -44.87 89.48 Favored 'General case' 0 N--CA 1.431 -1.41 0 C-N-CA 125.161 1.384 . . . . 1.0 114.107 177.92 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -53.52 -52.52 59.37 Favored 'General case' 0 N--CA 1.43 -1.453 0 C-N-CA 124.184 0.994 . . . . 1.0 112.344 174.656 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 35.4 mt -69.99 -51.04 35.71 Favored 'General case' 0 N--CA 1.431 -1.412 0 N-CA-C 113.658 0.985 . . . . 1.0 113.658 -176.429 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 23.0 t70 -62.9 -41.92 99.61 Favored 'General case' 0 N--CA 1.429 -1.495 0 N-CA-C 115.146 1.536 . . . . 1.0 115.146 -178.174 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 23.6 t70 -74.01 -26.1 60.26 Favored 'General case' 0 N--CA 1.43 -1.438 0 O-C-N 120.182 -1.574 . . . . 1.0 113.066 -179.04 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 24' ' ' TRP . . . . . . . . . . . . . 67.7 t-105 -72.26 136.64 46.37 Favored 'General case' 0 N--CA 1.43 -1.471 0 O-C-N 119.742 -1.849 . . . . 1.0 112.63 177.569 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 34.3 t70 -138.95 150.26 45.69 Favored 'General case' 0 N--CA 1.43 -1.445 0 N-CA-C 106.926 -1.509 . . . . 1.0 106.926 179.273 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -163.91 -121.88 0.58 Allowed Glycine 0 N--CA 1.43 -1.757 0 O-C-N 121.29 -0.881 . . . . 1.0 111.599 -174.822 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 4.2 t0 -92.0 -32.25 15.29 Favored 'General case' 0 N--CA 1.43 -1.471 0 C-N-CA 125.357 1.463 . . . . 1.0 108.614 172.293 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 18.3 p -95.14 166.94 11.67 Favored 'General case' 0 N--CA 1.429 -1.482 0 C-N-CA 126.499 1.92 . . . . 1.0 111.591 179.335 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 2.6 t70 -132.03 178.91 6.42 Favored 'General case' 0 N--CA 1.43 -1.453 0 C-N-CA 124.677 1.191 . . . . 1.0 109.272 177.018 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 9.3 tp -157.21 134.02 2.2 Favored 'Isoleucine or valine' 0 N--CA 1.428 -1.542 0 C-N-CA 125.43 1.492 . . . . 1.0 107.072 -154.632 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 2.1 t70 -143.81 106.67 4.48 Favored 'General case' 0 N--CA 1.429 -1.495 0 O-C-N 120.241 -1.537 . . . . 1.0 109.445 162.783 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 71.2 m -90.68 132.62 35.68 Favored 'General case' 0 N--CA 1.431 -1.42 0 O-C-N 120.513 -1.367 . . . . 1.0 111.171 175.571 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 35.2 tt0 -107.27 132.01 53.57 Favored 'General case' 0 N--CA 1.43 -1.474 0 C-N-CA 126.365 1.866 . . . . 1.0 109.769 -168.138 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 2.8 tp -117.2 109.03 26.37 Favored 'Isoleucine or valine' 0 N--CA 1.428 -1.535 0 CA-C-O 124.547 2.118 . . . . 1.0 108.236 -172.314 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 3.5 t-20 -108.29 79.35 1.25 Allowed 'General case' 0 N--CA 1.429 -1.483 0 C-N-CA 125.575 1.55 . . . . 1.0 108.288 173.98 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . 75.52 -80.17 1.04 Allowed Glycine 0 N--CA 1.429 -1.771 0 O-C-N 120.326 -1.484 . . . . 1.0 114.998 173.291 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -142.66 37.35 1.54 Allowed Glycine 0 N--CA 1.43 -1.766 0 N-CA-C 108.987 -1.645 . . . . 1.0 108.987 173.384 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 69.7 t -133.67 117.77 28.02 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.404 0 N-CA-C 104.519 -2.4 . . . . 1.0 104.519 176.383 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -110.08 137.32 48.0 Favored 'General case' 0 N--CA 1.431 -1.42 0 CA-C-O 123.728 1.728 . . . . 1.0 111.781 177.042 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -133.06 125.2 29.1 Favored 'General case' 0 N--CA 1.429 -1.479 0 N-CA-C 106.142 -1.799 . . . . 1.0 106.142 -170.174 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 86.1 mt -99.89 134.07 40.6 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.481 0 N-CA-C 107.534 -1.284 . . . . 1.0 107.534 -169.192 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -131.7 126.67 35.13 Favored 'General case' 0 N--CA 1.431 -1.414 0 N-CA-C 112.643 0.609 . . . . 1.0 112.643 174.944 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 43' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -108.15 167.51 9.95 Favored 'General case' 0 N--CA 1.431 -1.405 0 C-N-CA 125.482 1.513 . . . . 1.0 109.437 174.278 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 70.3 mt-10 -55.86 -26.19 45.79 Favored 'General case' 0 N--CA 1.429 -1.484 0 N-CA-C 117.059 2.244 . . . . 1.0 117.059 179.644 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 27.7 t-20 -63.87 -18.15 63.88 Favored 'General case' 0 N--CA 1.43 -1.442 0 C-N-CA 126.374 1.869 . . . . 1.0 112.828 176.363 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 96.32 -6.32 65.82 Favored Glycine 0 N--CA 1.431 -1.652 0 O-C-N 120.311 -1.493 . . . . 1.0 111.313 176.345 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -79.18 166.36 22.29 Favored 'General case' 0 N--CA 1.431 -1.424 0 C-N-CA 128.033 2.533 . . . . 1.0 111.265 -177.914 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 10.5 ptpt -157.17 148.14 21.67 Favored 'General case' 0 N--CA 1.431 -1.417 0 O-C-N 120.672 -1.267 . . . . 1.0 113.599 -162.434 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 9.2 mm -123.6 142.83 38.89 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.445 0 N-CA-C 105.703 -1.962 . . . . 1.0 105.703 175.672 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 50' ' ' ILE . . . . . 0.551 HG23 ' HB3' ' A' ' 63' ' ' ALA . 4.1 tp -126.5 129.06 71.77 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.509 0 CA-C-N 120.753 1.615 . . . . 1.0 110.076 175.606 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 3.3 mt -124.99 124.84 68.52 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.464 0 C-N-CA 127.689 2.396 . . . . 1.0 111.139 -177.263 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 52' ' ' ASN . . . . . 0.526 ' H ' ' HD1' ' A' ' 61' ' ' TRP . 40.9 t30 -160.04 173.14 16.29 Favored 'General case' 0 N--CA 1.43 -1.456 0 C-N-CA 128.802 2.841 . . . . 1.0 104.564 -173.901 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -153.35 147.99 26.23 Favored 'General case' 0 N--CA 1.429 -1.48 0 O-C-N 119.629 -1.92 . . . . 1.0 113.333 -154.455 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 34.1 mm-40 -121.13 97.63 5.61 Favored 'General case' 0 N--CA 1.43 -1.453 0 C-N-CA 125.361 1.465 . . . . 1.0 112.002 -172.51 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 18.9 tt0 -69.6 -39.89 12.83 Favored Pre-proline 0 N--CA 1.431 -1.416 0 N-CA-C 116.574 2.064 . . . . 1.0 116.574 -174.988 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 52.7 Cg_exo -71.16 -22.62 25.59 Favored 'Trans proline' 0 N--CA 1.433 -2.072 0 CA-C-N 126.228 3.26 . . . . 1.0 114.844 174.794 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 33.2 mt -94.04 -30.92 14.44 Favored 'General case' 0 N--CA 1.431 -1.412 0 C-N-CA 122.895 0.478 . . . . 1.0 111.312 -168.581 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 1.3 m-70 85.67 56.5 0.01 OUTLIER 'General case' 0 N--CA 1.43 -1.425 0 C-N-CA 127.581 2.352 . . . . 1.0 110.102 176.826 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -156.23 157.66 36.22 Favored 'General case' 0 N--CA 1.43 -1.449 0 O-C-N 120.409 -1.432 . . . . 1.0 109.71 -178.468 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 79.2 t -121.06 151.43 24.12 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.511 0 N-CA-C 105.63 -1.989 . . . . 1.0 105.63 173.045 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 61' ' ' TRP . . . . . 0.526 ' HD1' ' H ' ' A' ' 52' ' ' ASN . 0.0 OUTLIER -102.21 151.76 21.83 Favored 'General case' 0 N--CA 1.43 -1.467 0 CA-C-N 121.122 1.783 . . . . 1.0 114.275 177.291 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 61.5 mt -123.28 101.72 7.53 Favored 'General case' 0 N--CA 1.43 -1.428 0 N-CA-C 107.03 -1.47 . . . . 1.0 107.03 166.503 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 63' ' ' ALA . . . . . 0.551 ' HB3' HG23 ' A' ' 50' ' ' ILE . . . -102.05 112.91 25.73 Favored 'General case' 0 N--CA 1.43 -1.435 0 O-C-N 121.05 -1.032 . . . . 1.0 110.517 170.889 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 64' ' ' THR . . . . . . . . . . . . . 77.1 p -119.62 -122.44 0.29 Allowed 'General case' 0 N--CA 1.43 -1.472 0 C-N-CA 126.749 2.02 . . . . 1.0 113.652 -156.782 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 13.7 tmtt? -96.69 -66.33 0.91 Allowed 'General case' 0 N--CA 1.43 -1.426 0 C-N-CA 126.047 1.739 . . . . 1.0 110.726 -170.678 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 20.0 tt0 -77.62 -24.0 49.69 Favored 'General case' 0 N--CA 1.429 -1.487 0 O-C-N 121.26 -0.9 . . . . 1.0 112.694 -176.773 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 172.08 -60.39 0.16 Allowed Glycine 0 N--CA 1.431 -1.68 0 O-C-N 120.398 -1.439 . . . . 1.0 110.18 178.855 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 88.1 170.18 45.74 Favored Glycine 0 N--CA 1.431 -1.678 0 C-N-CA 123.766 0.698 . . . . 1.0 112.521 -177.893 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -166.23 171.79 11.85 Favored 'General case' 0 N--CA 1.429 -1.475 0 C-N-CA 125.986 1.715 . . . . 1.0 110.065 179.398 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 70' ' ' HIS . . . . . 0.445 ' HA ' ' HA ' ' A' ' 61' ' ' TRP . 10.7 p80 -75.68 159.33 31.26 Favored 'General case' 0 N--CA 1.431 -1.393 0 N-CA-C 115.736 1.754 . . . . 1.0 115.736 -178.161 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 47.2 p90 -121.01 137.02 54.85 Favored 'General case' 0 N--CA 1.429 -1.48 0 N-CA-C 114.427 1.269 . . . . 1.0 114.427 -179.912 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 3.3 m-20 -127.56 172.58 10.6 Favored 'General case' 0 N--CA 1.43 -1.462 0 C-N-CA 126.642 1.977 . . . . 1.0 108.364 -174.246 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 19.2 mt -101.01 116.24 32.37 Favored 'General case' 0 N--CA 1.43 -1.442 0 O-C-N 119.837 -1.789 . . . . 1.0 111.893 178.228 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 39.7 mmtm -67.74 -47.71 68.51 Favored 'General case' 0 N--CA 1.429 -1.495 0 O-C-N 120.743 -1.223 . . . . 1.0 111.491 151.889 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . 179.69 -81.81 0.06 OUTLIER Glycine 0 N--CA 1.431 -1.696 0 O-C-N 120.176 -1.578 . . . . 1.0 114.159 176.502 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -89.7 -8.3 52.66 Favored 'General case' 0 N--CA 1.43 -1.474 0 C-N-CA 125.386 1.474 . . . . 1.0 109.173 170.383 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 16.0 mt-10 -124.39 123.01 39.24 Favored 'General case' 0 N--CA 1.429 -1.485 0 N-CA-C 103.797 -2.668 . . . . 1.0 103.797 -172.227 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 78' ' ' TRP . . . . . . . . . . . . . 81.4 m95 -86.31 135.35 33.57 Favored 'General case' 0 N--CA 1.43 -1.464 0 N-CA-C 105.508 -2.034 . . . . 1.0 105.508 164.317 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -129.7 153.17 38.42 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.472 0 O-C-N 119.98 -1.7 . . . . 1.0 107.936 -171.551 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 64.3 m -85.91 147.24 26.35 Favored 'General case' 0 N--CA 1.43 -1.43 0 O-C-N 120.46 -1.4 . . . . 1.0 112.591 -177.48 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 28.3 t70 -63.77 -39.94 95.49 Favored 'General case' 0 N--CA 1.431 -1.404 0 O-C-N 119.7 -1.875 . . . . 1.0 115.679 -174.242 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 12.3 ptm180 -130.5 177.22 7.52 Favored 'General case' 0 N--CA 1.43 -1.436 0 O-C-N 120.699 -1.251 . . . . 1.0 112.016 174.839 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 83' ' ' SER . . . . . . . . . . . . 0.408 9.5 p 72.3 -55.96 0.66 Allowed 'General case' 0 N--CA 1.43 -1.444 0 C-N-CA 128.554 2.742 . . . . 1.0 117.418 171.145 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -168.48 93.95 0.11 Allowed Glycine 0 N--CA 1.431 -1.684 0 N-CA-C 109.712 -1.355 . . . . 1.0 109.712 178.73 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 10.5 pt-20 -72.33 96.69 1.9 Allowed 'General case' 0 N--CA 1.431 -1.407 0 N-CA-C 118.064 2.616 . . . . 1.0 118.064 -166.053 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 57.4 m -167.33 125.92 1.32 Allowed 'General case' 0 N--CA 1.429 -1.49 0 O-C-N 119.347 -2.096 . . . . 1.0 110.836 171.6 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . 0.294 0.1 OUTLIER -51.03 -86.14 0.0 OUTLIER 'General case' 0 N--CA 1.429 -1.475 0 N-CA-C 117.195 2.294 . . . . 1.0 117.195 173.539 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 88' ' ' TRP . . . . . . . . . . . . . 22.3 m95 -58.96 -39.95 83.23 Favored 'General case' 0 N--CA 1.431 -1.422 0 CA-C-N 121.2 1.818 . . . . 1.0 113.584 -173.27 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 9.3 t70 -67.69 -39.96 84.41 Favored 'General case' 0 N--CA 1.43 -1.455 0 N-CA-C 114.388 1.255 . . . . 1.0 114.388 -176.82 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 30.3 tp -76.03 -41.61 50.38 Favored 'General case' 0 N--CA 1.43 -1.438 0 O-C-N 119.098 -2.251 . . . . 1.0 112.483 177.363 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -48.01 -47.38 33.35 Favored 'General case' 0 CA--C 1.489 -1.394 0 C-N-CA 127.495 2.318 . . . . 1.0 113.376 166.835 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 1.3 tp10 -56.52 -51.9 66.77 Favored 'General case' 0 N--CA 1.43 -1.426 0 C-N-CA 127.105 2.162 . . . . 1.0 113.29 170.387 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 7.2 tt0 -52.47 -51.06 61.27 Favored 'General case' 0 N--CA 1.43 -1.464 0 O-C-N 120.668 -1.27 . . . . 1.0 112.866 174.539 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -53.19 -48.73 67.83 Favored 'General case' 0 N--CA 1.43 -1.432 0 N-CA-C 115.034 1.494 . . . . 1.0 115.034 172.706 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -64.45 -53.5 47.3 Favored 'General case' 0 N--CA 1.429 -1.495 0 O-C-N 120.135 -1.603 . . . . 1.0 113.255 178.989 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 96' ' ' THR . . . . . 0.602 HG22 ' H ' ' A' ' 103' ' ' VAL . 47.5 p -59.4 -38.04 79.56 Favored 'General case' 0 CA--C 1.488 -1.431 0 C-N-CA 126.543 1.937 . . . . 1.0 114.051 179.439 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 5.8 pt20 -78.65 -27.19 45.23 Favored 'General case' 0 N--CA 1.429 -1.476 0 N-CA-C 114.871 1.434 . . . . 1.0 114.871 177.944 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 12.4 mm100 -74.67 -38.74 62.35 Favored 'General case' 0 N--CA 1.431 -1.421 0 O-C-N 120.22 -1.55 . . . . 1.0 112.129 170.718 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -79.86 -46.31 17.08 Favored 'General case' 0 N--CA 1.43 -1.45 0 N-CA-C 114.928 1.455 . . . . 1.0 114.928 179.669 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . 122.5 0.1 10.25 Favored Glycine 0 N--CA 1.431 -1.659 0 N-CA-C 116.475 1.35 . . . . 1.0 116.475 174.433 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 11.2 pt-20 -153.56 174.33 14.58 Favored 'General case' 0 N--CA 1.429 -1.499 0 CA-C-N 119.355 1.577 . . . . 1.0 110.223 -178.813 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 16.9 m -74.2 121.62 21.52 Favored 'General case' 0 N--CA 1.43 -1.452 0 O-C-N 120.736 -1.228 . . . . 1.0 112.738 177.928 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 103' ' ' VAL . . . . . 0.602 ' H ' HG22 ' A' ' 96' ' ' THR . 40.5 t -120.87 134.92 62.71 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.458 0 N-CA-C 102.284 -3.228 . . . . 1.0 102.284 -175.195 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 43.7 p -106.73 129.02 54.68 Favored 'General case' 0 N--CA 1.43 -1.457 0 N-CA-C 115.218 1.562 . . . . 1.0 115.218 -166.336 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -139.69 -35.8 0.52 Allowed 'General case' 0 N--CA 1.43 -1.434 0 C-N-CA 127.155 2.182 . . . . 1.0 108.938 167.959 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 2.9 tmm_? . . . . . 0 C--O 1.26 1.609 0 C-N-CA 125.737 1.615 . . . . 1.0 112.859 -167.59 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 43.1 m-80 . . . . . 0 N--CA 1.43 -1.453 0 CA-C-O 121.69 0.757 . . . . 1.0 112.34 . . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -57.04 -48.97 77.25 Favored 'General case' 0 N--CA 1.43 -1.432 0 C-N-CA 126.806 2.042 . . . . 1.0 113.857 172.93 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 27.8 t -50.88 -52.9 37.23 Favored 'General case' 0 N--CA 1.431 -1.401 0 C-N-CA 125.722 1.609 . . . . 1.0 114.099 172.579 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 49.7 tt0 -62.86 -52.42 63.17 Favored 'General case' 0 N--CA 1.431 -1.395 0 C-N-CA 124.765 1.226 . . . . 1.0 113.976 -178.452 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -63.46 -35.31 80.03 Favored 'General case' 0 N--CA 1.43 -1.441 0 O-C-N 120.673 -1.267 . . . . 1.0 114.362 178.626 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 9.0 t-160 -66.49 -37.79 85.86 Favored 'General case' 0 N--CA 1.43 -1.432 0 O-C-N 120.198 -1.564 . . . . 1.0 113.791 172.755 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 1.5 mmm180 -68.56 -43.93 75.56 Favored 'General case' 0 N--CA 1.43 -1.432 0 O-C-N 120.055 -1.653 . . . . 1.0 113.687 175.73 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 67.1 mt -56.52 -46.26 80.67 Favored 'General case' 0 N--CA 1.43 -1.45 0 C-N-CA 124.666 1.186 . . . . 1.0 112.558 172.251 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -54.51 -55.69 26.47 Favored 'General case' 0 N--CA 1.43 -1.442 0 C-N-CA 124.477 1.111 . . . . 1.0 113.498 171.6 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 18.7 t70 -46.16 -48.15 17.51 Favored 'General case' 0 N--CA 1.43 -1.45 0 C-N-CA 126.491 1.917 . . . . 1.0 114.093 178.284 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 12.5 mm100 -55.72 -60.6 3.21 Favored 'General case' 0 N--CA 1.43 -1.456 0 N-CA-C 114.522 1.305 . . . . 1.0 114.522 172.944 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 2.5 pp -74.49 -37.68 63.09 Favored 'General case' 0 N--CA 1.43 -1.459 0 N-CA-C 116.585 2.068 . . . . 1.0 116.585 -175.497 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 11.9 m0 -55.6 -47.06 77.11 Favored 'General case' 0 N--CA 1.431 -1.411 0 C-N-CA 127.753 2.421 . . . . 1.0 112.109 171.663 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 47.8 tp -59.73 -45.25 92.75 Favored 'General case' 0 N--CA 1.43 -1.451 0 O-C-N 121.057 -1.027 . . . . 1.0 113.468 172.142 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 25.5 m -56.28 -46.34 79.78 Favored 'General case' 0 N--CA 1.431 -1.383 0 N-CA-C 114.853 1.427 . . . . 1.0 114.853 175.387 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 67.6 mt -64.75 -46.21 92.82 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.437 0 O-C-N 120.431 -1.418 . . . . 1.0 112.206 178.263 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 58.1 tt0 -53.41 -58.41 7.22 Favored 'General case' 0 N--CA 1.43 -1.443 0 C-N-CA 125.047 1.339 . . . . 1.0 111.939 174.765 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 23.7 mt-10 -55.68 -55.43 32.26 Favored 'General case' 0 N--CA 1.43 -1.446 0 C-N-CA 125.789 1.635 . . . . 1.0 115.138 176.748 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 7.2 tpm_? -52.31 -49.18 64.74 Favored 'General case' 0 N--CA 1.43 -1.445 0 C-N-CA 124.578 1.151 . . . . 1.0 113.056 -177.456 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 21' ' ' LEU . . . . . 0.422 HD23 HG21 ' A' ' 41' ' ' ILE . 12.8 tp -81.51 -36.51 29.15 Favored 'General case' 0 N--CA 1.43 -1.432 0 N-CA-C 113.991 1.108 . . . . 1.0 113.991 -176.335 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 27.4 t70 -64.17 -34.36 77.9 Favored 'General case' 0 N--CA 1.431 -1.42 0 O-C-N 119.994 -1.691 . . . . 1.0 114.51 176.567 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 10.1 t70 -67.87 -26.81 66.21 Favored 'General case' 0 N--CA 1.43 -1.431 0 O-C-N 120.185 -1.572 . . . . 1.0 113.388 172.752 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 24' ' ' TRP . . . . . . . . . . . . . 0.2 OUTLIER -75.92 148.84 37.93 Favored 'General case' 0 N--CA 1.43 -1.426 0 O-C-N 120.154 -1.591 . . . . 1.0 114.003 -167.512 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 2.3 t70 -129.1 133.78 47.8 Favored 'General case' 0 N--CA 1.429 -1.491 0 O-C-N 120.528 -1.358 . . . . 1.0 108.972 -175.099 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -166.64 -149.16 5.85 Favored Glycine 0 N--CA 1.431 -1.652 0 O-C-N 120.536 -1.352 . . . . 1.0 112.521 -171.439 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 10.9 t70 -77.03 -41.65 41.72 Favored 'General case' 0 N--CA 1.431 -1.421 0 N-CA-C 107.88 -1.156 . . . . 1.0 107.88 168.439 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 47.1 m -65.2 141.62 58.6 Favored 'General case' 0 N--CA 1.43 -1.471 0 C-N-CA 125.275 1.43 . . . . 1.0 114.236 174.083 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 20.0 t70 -110.97 147.3 35.0 Favored 'General case' 0 N--CA 1.429 -1.517 0 N-CA-C 105.993 -1.854 . . . . 1.0 105.993 171.5 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 48.6 mm -135.02 115.7 19.07 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.457 0 C-N-CA 125.555 1.542 . . . . 1.0 108.528 -160.895 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -121.83 110.22 15.63 Favored 'General case' 0 N--CA 1.43 -1.472 0 C-N-CA 124.461 1.104 . . . . 1.0 109.188 158.718 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 10.3 t -77.13 143.73 38.94 Favored 'General case' 0 N--CA 1.429 -1.507 0 O-C-N 118.625 -2.547 . . . . 1.0 110.204 164.952 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 52.2 mt-10 -101.74 140.07 36.53 Favored 'General case' 0 N--CA 1.431 -1.415 0 C-N-CA 124.37 1.068 . . . . 1.0 109.302 172.211 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 2.5 tp -122.1 107.33 19.56 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.488 0 CA-C-O 124.327 2.013 . . . . 1.0 108.372 177.293 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 35.1 m120 -117.79 68.57 0.76 Allowed 'General case' 0 N--CA 1.43 -1.434 0 CA-C-N 114.425 -1.261 . . . . 1.0 109.651 176.499 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . 73.17 -86.55 0.58 Allowed Glycine 0 N--CA 1.43 -1.713 0 C-N-CA 125.363 1.459 . . . . 1.0 114.334 173.088 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -120.34 27.31 6.7 Favored Glycine 0 N--CA 1.429 -1.79 0 C-N-CA 125.332 1.444 . . . . 1.0 111.866 175.019 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 66.4 t -128.34 129.11 69.03 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.449 0 N-CA-C 107.661 -1.237 . . . . 1.0 107.661 169.628 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 46.3 mt -113.02 123.97 51.56 Favored 'General case' 0 N--CA 1.429 -1.481 0 CA-C-O 122.846 1.307 . . . . 1.0 108.655 166.754 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -121.84 116.33 24.24 Favored 'General case' 0 N--CA 1.43 -1.455 0 N-CA-C 106.348 -1.723 . . . . 1.0 106.348 179.385 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 41' ' ' ILE . . . . . 0.422 HG21 HD23 ' A' ' 21' ' ' LEU . 49.3 mt -94.04 116.1 34.45 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.411 0 O-C-N 119.625 -1.922 . . . . 1.0 108.644 -172.985 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 47.0 p -109.76 120.06 41.29 Favored 'General case' 0 N--CA 1.43 -1.438 0 N-CA-C 113.237 0.828 . . . . 1.0 113.237 -173.656 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 43' ' ' PHE . . . . . . . . . . . . 0.25 1.2 p90 -118.23 166.34 12.72 Favored 'General case' 0 N--CA 1.429 -1.492 0 CA-C-O 123.322 1.534 . . . . 1.0 114.093 179.487 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 1.1 pp20? -63.13 -31.4 72.54 Favored 'General case' 0 N--CA 1.43 -1.45 0 N-CA-C 117.517 2.414 . . . . 1.0 117.517 -159.179 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 59.5 m-80 -74.81 -0.36 18.08 Favored 'General case' 0 N--CA 1.431 -1.411 0 N-CA-C 114.905 1.446 . . . . 1.0 114.905 176.67 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 99.41 -1.3 57.19 Favored Glycine 0 N--CA 1.432 -1.613 0 O-C-N 120.673 -1.267 . . . . 1.0 113.255 166.849 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 3.4 p -96.52 164.47 12.6 Favored 'General case' 0 N--CA 1.428 -1.548 0 C-N-CA 127.028 2.131 . . . . 1.0 110.255 178.439 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 54.3 pttt -162.35 158.93 24.74 Favored 'General case' 0 N--CA 1.429 -1.479 0 CA-C-O 122.468 1.128 . . . . 1.0 113.655 -171.108 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 17.9 mm -103.7 140.14 22.71 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.412 0 C-N-CA 125.258 1.423 . . . . 1.0 107.232 179.073 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 50' ' ' ILE . . . . . 0.433 ' HB ' ' HB3' ' A' ' 63' ' ' ALA . 1.2 mm -122.39 108.04 20.89 Favored 'Isoleucine or valine' 0 N--CA 1.428 -1.53 0 CA-C-N 119.649 1.113 . . . . 1.0 110.299 -175.34 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 2.7 mt -122.82 98.6 5.82 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.463 0 CA-C-O 123.357 1.551 . . . . 1.0 111.828 179.117 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 2.3 m120 -108.81 148.0 31.23 Favored 'General case' 0 N--CA 1.429 -1.51 0 C-N-CA 127.896 2.478 . . . . 1.0 108.727 174.796 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 39.1 ttp180 -154.29 134.29 13.1 Favored 'General case' 0 N--CA 1.429 -1.496 0 CA-C-N 113.729 -1.578 . . . . 1.0 108.305 -167.055 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 5.0 mm100 -89.55 129.47 36.01 Favored 'General case' 0 N--CA 1.431 -1.391 0 N-CA-C 106.687 -1.598 . . . . 1.0 106.687 163.617 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 37.8 tt0 -63.7 -51.25 67.05 Favored Pre-proline 0 N--CA 1.431 -1.393 0 CA-C-O 116.573 -1.68 . . . . 1.0 113.431 172.581 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 52.6 Cg_exo -67.29 -175.69 0.71 Allowed 'Trans proline' 0 N--CA 1.433 -2.055 0 CA-C-N 125.307 2.931 . . . . 1.0 114.707 162.707 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 15.0 mt 82.38 -30.07 0.1 Allowed 'General case' 0 N--CA 1.43 -1.452 0 C-N-CA 127.657 2.383 . . . . 1.0 114.934 169.439 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER 76.87 47.38 0.07 Allowed 'General case' 0 N--CA 1.432 -1.364 0 C-N-CA 126.247 1.819 . . . . 1.0 114.204 170.433 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 38.2 tt0 -160.36 152.12 19.92 Favored 'General case' 0 N--CA 1.429 -1.48 0 O-C-N 120.693 -1.254 . . . . 1.0 108.27 179.031 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 15.6 t -120.73 156.91 23.91 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.486 0 C-N-CA 124.819 1.248 . . . . 1.0 109.83 179.634 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 61' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -99.35 153.49 18.93 Favored 'General case' 0 N--CA 1.43 -1.427 0 O-C-N 120.567 -1.333 . . . . 1.0 111.419 170.198 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -137.45 90.9 2.55 Favored 'General case' 0 N--CA 1.43 -1.457 0 O-C-N 120.103 -1.623 . . . . 1.0 109.862 179.116 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 63' ' ' ALA . . . . . 0.433 ' HB3' ' HB ' ' A' ' 50' ' ' ILE . . . -104.37 139.92 38.65 Favored 'General case' 0 N--CA 1.429 -1.492 0 O-C-N 119.943 -1.723 . . . . 1.0 111.858 175.647 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 64' ' ' THR . . . . . . . . . . . . . 80.8 p -150.44 -130.28 0.05 OUTLIER 'General case' 0 N--CA 1.43 -1.468 0 C-N-CA 126.633 1.973 . . . . 1.0 105.783 -163.082 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 4.7 tmtt? -84.82 -39.64 18.11 Favored 'General case' 0 N--CA 1.43 -1.434 0 O-C-N 120.254 -1.529 . . . . 1.0 110.913 166.076 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 1.7 tp-100 -78.62 -25.14 45.05 Favored 'General case' 0 N--CA 1.43 -1.453 0 N-CA-C 114.937 1.458 . . . . 1.0 114.937 -150.785 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 169.76 -52.04 0.2 Allowed Glycine 0 N--CA 1.43 -1.729 0 O-C-N 121.076 -1.015 . . . . 1.0 113.16 174.632 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 116.48 93.53 1.79 Allowed Glycine 0 N--CA 1.43 -1.7 0 C-N-CA 125.255 1.407 . . . . 1.0 110.843 -173.691 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 69' ' ' TYR . . . . . 0.486 ' CD1' ' HG2' ' A' ' 82' ' ' ARG . 13.5 m-85 -122.07 143.26 49.63 Favored 'General case' 0 N--CA 1.43 -1.464 0 N-CA-C 107.962 -1.125 . . . . 1.0 107.962 -166.406 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 70' ' ' HIS . . . . . . . . . . . . 0.275 1.3 p80 -89.47 160.92 16.52 Favored 'General case' 0 N--CA 1.429 -1.482 0 O-C-N 119.376 -2.078 . . . . 1.0 113.746 178.636 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 71' ' ' PHE . . . . . . . . . . . . 0.27 11.9 t80 -139.34 125.0 19.45 Favored 'General case' 0 N--CA 1.429 -1.48 0 CA-C-N 115.333 -0.849 . . . . 1.0 111.076 -149.589 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -126.25 161.4 27.83 Favored 'General case' 0 N--CA 1.431 -1.402 0 C-N-CA 123.746 0.818 . . . . 1.0 109.974 178.089 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 57.3 tp -96.11 121.83 38.29 Favored 'General case' 0 N--CA 1.43 -1.434 0 O-C-N 119.599 -1.938 . . . . 1.0 110.403 176.391 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 20.0 mmmt -84.89 -48.56 9.2 Favored 'General case' 0 N--CA 1.43 -1.461 0 O-C-N 120.989 -1.069 . . . . 1.0 112.815 175.74 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -171.85 -69.77 0.04 OUTLIER Glycine 0 N--CA 1.429 -1.77 0 N-CA-C 110.843 -0.903 . . . . 1.0 110.843 179.007 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 20.2 p-10 -90.06 -26.92 20.03 Favored 'General case' 0 N--CA 1.43 -1.469 0 O-C-N 121.07 -1.253 . . . . 1.0 111.09 179.089 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 5.8 mt-10 -152.58 155.75 37.97 Favored 'General case' 0 N--CA 1.429 -1.492 0 N-CA-C 104.161 -2.533 . . . . 1.0 104.161 -164.417 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 78' ' ' TRP . . . . . . . . . . . . . 31.0 m95 -86.69 123.59 32.03 Favored 'General case' 0 N--CA 1.43 -1.456 0 N-CA-C 107.084 -1.45 . . . . 1.0 107.084 -178.311 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 3.3 mt -101.47 137.12 30.26 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.484 0 CA-C-O 123.893 1.806 . . . . 1.0 106.332 176.804 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 74.8 m -77.17 145.95 37.37 Favored 'General case' 0 N--CA 1.428 -1.527 0 CA-C-N 114.411 -1.268 . . . . 1.0 109.977 -175.593 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 37.6 t0 -73.44 -43.51 60.2 Favored 'General case' 0 N--CA 1.431 -1.416 0 O-C-N 120.469 -1.394 . . . . 1.0 111.953 -174.007 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 82' ' ' ARG . . . . . 0.486 ' HG2' ' CD1' ' A' ' 69' ' ' TYR . 0.1 OUTLIER -79.11 134.55 36.72 Favored 'General case' 0 N--CA 1.43 -1.463 0 O-C-N 119.977 -1.702 . . . . 1.0 110.378 176.911 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 8.0 t 65.58 -66.24 0.15 Allowed 'General case' 0 N--CA 1.43 -1.437 0 N-CA-C 116.215 1.932 . . . . 1.0 116.215 -179.951 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 130.48 89.49 0.52 Allowed Glycine 0 N--CA 1.43 -1.711 0 N-CA-C 107.474 -2.25 . . . . 1.0 107.474 -167.417 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 52.3 mt-10 -137.97 -168.33 2.33 Favored 'General case' 0 N--CA 1.431 -1.413 0 N-CA-C 105.162 -2.162 . . . . 1.0 105.162 -178.755 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 32.0 m -154.99 130.71 9.96 Favored 'General case' 0 N--CA 1.43 -1.471 0 O-C-N 119.346 -2.096 . . . . 1.0 111.102 -150.661 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 1.1 t80 -25.79 -92.56 0.0 OUTLIER 'General case' 0 N--CA 1.429 -1.492 0 N-CA-C 119.674 3.213 . . . . 1.0 119.674 174.7 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 88' ' ' TRP . . . . . . . . . . . . . 78.8 m95 -72.12 -26.8 62.26 Favored 'General case' 0 N--CA 1.429 -1.483 0 O-C-N 120.392 -1.442 . . . . 1.0 110.379 -169.819 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -68.42 -49.97 56.14 Favored 'General case' 0 N--CA 1.43 -1.454 0 C-N-CA 125.409 1.483 . . . . 1.0 113.139 178.413 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -70.14 -42.74 72.16 Favored 'General case' 0 N--CA 1.429 -1.48 0 CA-C-O 122.969 1.366 . . . . 1.0 111.73 -177.565 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 24.6 tp -53.76 -49.86 67.29 Favored 'General case' 0 N--CA 1.43 -1.459 0 C-N-CA 126.371 1.868 . . . . 1.0 112.946 173.996 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 1.9 tm-20 -58.21 -55.76 30.81 Favored 'General case' 0 N--CA 1.43 -1.443 0 C-N-CA 126.742 2.017 . . . . 1.0 114.816 173.71 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 3.6 pt20 -63.96 -43.42 95.83 Favored 'General case' 0 N--CA 1.43 -1.437 0 O-C-N 120.577 -1.327 . . . . 1.0 114.068 -177.452 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -62.79 -47.97 81.15 Favored 'General case' 0 N--CA 1.43 -1.442 0 O-C-N 120.635 -1.29 . . . . 1.0 113.057 175.098 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -63.43 -35.99 82.24 Favored 'General case' 0 N--CA 1.428 -1.536 0 O-C-N 120.312 -1.493 . . . . 1.0 113.399 176.98 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 91.5 m -57.75 -51.96 67.41 Favored 'General case' 0 N--CA 1.43 -1.456 0 C-N-CA 125.526 1.53 . . . . 1.0 112.474 173.149 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 5.0 pt20 -70.18 -31.34 68.77 Favored 'General case' 0 N--CA 1.43 -1.45 0 N-CA-C 114.75 1.389 . . . . 1.0 114.75 -179.847 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 51.0 mt-30 -66.26 -46.71 76.12 Favored 'General case' 0 N--CA 1.43 -1.468 0 O-C-N 119.741 -1.849 . . . . 1.0 114.806 169.876 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -77.98 -46.88 19.85 Favored 'General case' 0 N--CA 1.428 -1.534 0 N-CA-C 113.912 1.078 . . . . 1.0 113.912 -176.335 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . 99.58 24.7 9.84 Favored Glycine 0 N--CA 1.431 -1.691 0 C-N-CA 124.502 1.048 . . . . 1.0 113.422 -175.499 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 13.7 pt-20 -161.63 160.69 29.08 Favored 'General case' 0 N--CA 1.429 -1.482 0 N-CA-C 106.495 -1.669 . . . . 1.0 106.495 174.672 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 70.2 m -66.63 112.18 4.03 Favored 'General case' 0 N--CA 1.429 -1.5 0 CA-C-N 120.087 1.312 . . . . 1.0 112.43 -178.522 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 39.9 t -100.49 108.43 23.03 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.453 0 N-CA-C 107.302 -1.37 . . . . 1.0 107.302 173.867 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 44.0 p -141.31 127.72 19.95 Favored 'General case' 0 N--CA 1.43 -1.442 0 N-CA-C 113.792 1.034 . . . . 1.0 113.792 -169.483 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 5.2 t80 -93.85 -24.31 17.79 Favored 'General case' 0 N--CA 1.43 -1.458 0 C-N-CA 124.059 0.944 . . . . 1.0 109.759 167.366 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 18.3 mmm-85 . . . . . 0 C--O 1.261 1.661 0 O-C-N 120.971 -1.081 . . . . 1.0 110.385 -175.56 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 23.6 t-20 . . . . . 0 N--CA 1.431 -1.397 0 CA-C-O 121.772 0.796 . . . . 1.0 112.892 . . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 16.2 m-20 -61.69 -54.16 46.33 Favored 'General case' 0 N--CA 1.43 -1.447 0 C-N-CA 125.96 1.704 . . . . 1.0 113.924 176.451 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 53.9 m -65.56 -33.57 76.22 Favored 'General case' 0 N--CA 1.429 -1.496 0 O-C-N 120.462 -1.399 . . . . 1.0 113.247 -177.705 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 37.0 tt0 -60.33 -55.09 37.92 Favored 'General case' 0 N--CA 1.43 -1.448 0 C-N-CA 124.306 1.042 . . . . 1.0 112.488 170.471 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 19.8 t80 -50.56 -48.11 57.58 Favored 'General case' 0 N--CA 1.431 -1.425 0 N-CA-C 114.651 1.352 . . . . 1.0 114.651 170.829 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 7.5 t-80 -55.62 -55.72 28.75 Favored 'General case' 0 N--CA 1.43 -1.435 0 C-N-CA 125.979 1.712 . . . . 1.0 114.939 177.344 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 42.6 mtm105 -61.12 -54.37 45.38 Favored 'General case' 0 CA--C 1.49 -1.357 0 C-N-CA 124.86 1.264 . . . . 1.0 113.017 179.92 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 95.9 mt -59.9 -46.45 89.31 Favored 'General case' 0 N--CA 1.431 -1.393 0 O-C-N 121.249 -0.907 . . . . 1.0 113.299 -179.221 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -57.53 -43.46 84.36 Favored 'General case' 0 N--CA 1.43 -1.448 0 N-CA-C 113.779 1.029 . . . . 1.0 113.779 177.355 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 15.9 t0 -63.27 -46.96 84.4 Favored 'General case' 0 N--CA 1.43 -1.45 0 N-CA-C 113.297 0.851 . . . . 1.0 113.297 177.307 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 59.7 mt-30 -61.04 -48.61 80.97 Favored 'General case' 0 N--CA 1.432 -1.35 0 N-CA-C 116.357 1.984 . . . . 1.0 116.357 174.92 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 3.9 pp -67.39 -39.11 85.59 Favored 'General case' 0 N--CA 1.43 -1.474 0 O-C-N 119.917 -1.739 . . . . 1.0 113.996 179.626 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 5.6 m0 -48.69 -57.52 6.15 Favored 'General case' 0 N--CA 1.43 -1.459 0 C-N-CA 126.039 1.736 . . . . 1.0 114.195 166.983 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 51.6 tp -58.7 -41.82 87.17 Favored 'General case' 0 N--CA 1.431 -1.41 0 N-CA-C 113.819 1.044 . . . . 1.0 113.819 177.741 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 90.3 m -57.74 -55.44 34.83 Favored 'General case' 0 N--CA 1.43 -1.444 0 C-N-CA 125.819 1.647 . . . . 1.0 113.496 175.915 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 86.1 mt -59.76 -48.9 85.85 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.419 0 C-N-CA 125.557 1.543 . . . . 1.0 112.397 176.768 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 69.6 tt0 -54.92 -53.3 57.29 Favored 'General case' 0 N--CA 1.428 -1.525 0 C-N-CA 125.226 1.41 . . . . 1.0 113.776 178.666 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 34.8 tt0 -63.88 -43.78 95.02 Favored 'General case' 0 N--CA 1.429 -1.523 0 N-CA-C 114.484 1.29 . . . . 1.0 114.484 179.287 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 6.8 tpt180 -67.19 -35.31 79.38 Favored 'General case' 0 N--CA 1.43 -1.438 0 N-CA-C 114.562 1.319 . . . . 1.0 114.562 -179.559 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 94.6 mt -78.23 -35.87 47.76 Favored 'General case' 0 N--CA 1.43 -1.466 0 O-C-N 120.627 -1.295 . . . . 1.0 113.409 174.314 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 37.2 t70 -57.87 -33.12 68.35 Favored 'General case' 0 N--CA 1.43 -1.465 0 C-N-CA 125.155 1.382 . . . . 1.0 113.026 171.036 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 33.6 t70 -69.79 -18.66 63.49 Favored 'General case' 0 N--CA 1.431 -1.41 0 N-CA-C 114.382 1.253 . . . . 1.0 114.382 174.359 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 24' ' ' TRP . . . . . . . . . . . . . 28.8 t-105 -75.99 152.44 36.98 Favored 'General case' 0 N--CA 1.429 -1.488 0 O-C-N 119.225 -2.172 . . . . 1.0 114.184 -171.557 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 1.8 t0 -154.33 175.79 13.11 Favored 'General case' 0 N--CA 1.431 -1.419 0 N-CA-C 108.635 -0.876 . . . . 1.0 108.635 -174.059 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 160.03 -131.43 2.68 Favored Glycine 0 N--CA 1.43 -1.733 0 N-CA-C 110.911 -0.875 . . . . 1.0 110.911 -178.655 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -86.52 -34.47 19.97 Favored 'General case' 0 N--CA 1.429 -1.489 0 C-N-CA 125.523 1.529 . . . . 1.0 108.697 170.566 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 39.3 m -85.5 172.29 11.1 Favored 'General case' 0 N--CA 1.43 -1.434 0 C-N-CA 124.795 1.238 . . . . 1.0 112.918 -176.589 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 43.1 t0 -121.41 151.43 40.19 Favored 'General case' 0 N--CA 1.431 -1.408 0 C-N-CA 125.874 1.67 . . . . 1.0 106.92 176.116 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -159.84 117.72 0.2 Allowed 'Isoleucine or valine' 0 N--CA 1.43 -1.46 0 CA-C-O 122.355 1.074 . . . . 1.0 108.265 -167.863 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 23.8 t0 -136.21 134.82 38.55 Favored 'General case' 0 N--CA 1.428 -1.546 0 O-C-N 120.83 -1.169 . . . . 1.0 109.066 175.451 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 73.4 m -100.66 138.82 37.21 Favored 'General case' 0 N--CA 1.43 -1.47 0 O-C-N 119.531 -1.981 . . . . 1.0 111.423 179.793 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 52.6 mt-10 -109.81 134.44 52.03 Favored 'General case' 0 N--CA 1.43 -1.459 0 O-C-N 121.102 -0.999 . . . . 1.0 109.929 -172.09 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 2.3 tp -105.29 106.41 20.46 Favored 'Isoleucine or valine' 0 CA--C 1.488 -1.413 0 N-CA-C 105.25 -2.13 . . . . 1.0 105.25 169.304 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 55.2 t30 -135.55 107.5 7.11 Favored 'General case' 0 N--CA 1.43 -1.457 0 CA-C-N 114.777 -1.101 . . . . 1.0 109.899 -173.242 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . 67.11 31.44 77.7 Favored Glycine 0 N--CA 1.43 -1.756 0 O-C-N 120.413 -1.43 . . . . 1.0 114.944 174.179 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 81.64 4.54 90.34 Favored Glycine 0 N--CA 1.429 -1.794 0 O-C-N 121.231 -1.158 . . . . 1.0 114.775 -174.581 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 24.2 t -103.51 127.36 57.57 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.471 0 N-CA-C 107.963 -1.125 . . . . 1.0 107.963 175.353 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 12.3 mt -88.64 127.14 35.56 Favored 'General case' 0 N--CA 1.431 -1.385 0 CA-C-O 123.626 1.679 . . . . 1.0 107.084 161.601 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -130.09 115.04 16.51 Favored 'General case' 0 N--CA 1.429 -1.492 0 N-CA-C 105.759 -1.941 . . . . 1.0 105.759 -169.605 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 82.9 mt -94.14 110.78 24.1 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.485 0 N-CA-C 107.867 -1.16 . . . . 1.0 107.867 -168.625 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 9.8 p -112.65 126.6 55.55 Favored 'General case' 0 N--CA 1.431 -1.423 0 CA-C-O 121.662 0.744 . . . . 1.0 112.508 -170.319 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 43' ' ' PHE . . . . . . . . . . . . . 1.6 p90 -119.97 159.83 23.94 Favored 'General case' 0 N--CA 1.429 -1.489 0 O-C-N 120.558 -1.339 . . . . 1.0 110.405 174.048 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -66.03 -15.08 62.73 Favored 'General case' 0 N--CA 1.43 -1.475 0 N-CA-C 117.762 2.505 . . . . 1.0 117.762 -163.454 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 45.1 m-80 -71.8 -7.74 50.1 Favored 'General case' 0 N--CA 1.43 -1.429 0 C-N-CA 125.935 1.694 . . . . 1.0 113.845 173.472 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 88.76 41.42 6.0 Favored Glycine 0 N--CA 1.429 -1.819 0 O-C-N 120.942 -1.098 . . . . 1.0 114.668 165.888 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 17.0 m -150.99 168.92 23.08 Favored 'General case' 0 N--CA 1.43 -1.45 0 N-CA-C 106.058 -1.831 . . . . 1.0 106.058 179.597 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -156.96 153.27 27.78 Favored 'General case' 0 N--CA 1.43 -1.442 0 N-CA-C 114.295 1.22 . . . . 1.0 114.295 -168.202 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 5.0 mm -97.61 140.62 17.43 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.478 0 C-N-CA 125.825 1.65 . . . . 1.0 106.963 177.598 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 4.7 mm -115.85 118.16 57.9 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.468 0 C-N-CA 124.616 1.166 . . . . 1.0 110.176 -171.935 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 3.4 mt -128.68 120.87 53.55 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.479 0 CA-C-O 122.806 1.288 . . . . 1.0 112.476 -176.876 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 52' ' ' ASN . . . . . 0.461 ' H ' ' HD1' ' A' ' 61' ' ' TRP . 47.2 t30 -156.46 169.17 25.24 Favored 'General case' 0 N--CA 1.429 -1.488 0 N-CA-C 105.374 -2.084 . . . . 1.0 105.374 -178.739 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 29.6 ptt180 -140.57 127.22 20.3 Favored 'General case' 0 N--CA 1.431 -1.409 0 C-N-CA 124.777 1.231 . . . . 1.0 113.004 -159.315 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -110.46 108.2 18.13 Favored 'General case' 0 N--CA 1.43 -1.469 0 C-N-CA 125.212 1.405 . . . . 1.0 110.935 -174.641 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 86.8 mt-10 -64.82 -52.76 48.2 Favored Pre-proline 0 N--CA 1.43 -1.462 0 N-CA-C 118.363 2.727 . . . . 1.0 118.363 -169.497 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 31.9 Cg_exo -73.52 -10.62 23.89 Favored 'Trans proline' 0 N--CA 1.433 -2.033 0 CA-C-N 128.01 3.896 . . . . 1.0 114.01 -168.971 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 35.0 mt -94.1 -22.37 18.53 Favored 'General case' 0 N--CA 1.431 -1.425 0 C-N-CA 126.282 1.833 . . . . 1.0 109.159 177.535 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 84.5 m-70 65.91 47.92 1.92 Allowed 'General case' 0 N--CA 1.429 -1.494 0 C-N-CA 126.614 1.965 . . . . 1.0 111.193 175.145 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 13.9 pt20 -144.01 149.33 36.55 Favored 'General case' 0 N--CA 1.429 -1.49 0 C-N-CA 124.31 1.044 . . . . 1.0 110.733 -178.769 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 4.2 t -100.2 153.23 4.6 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.5 0 N-CA-C 108.372 -0.973 . . . . 1.0 108.372 172.043 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 61' ' ' TRP . . . . . 0.461 ' HD1' ' H ' ' A' ' 52' ' ' ASN . 0.0 OUTLIER -102.73 155.3 18.41 Favored 'General case' 0 N--CA 1.43 -1.443 0 O-C-N 119.856 -1.777 . . . . 1.0 113.784 173.337 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 18.2 mt -125.52 94.93 4.28 Favored 'General case' 0 N--CA 1.432 -1.36 0 N-CA-C 106.16 -1.793 . . . . 1.0 106.16 164.207 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 63' ' ' ALA . . . . . 0.406 ' HA ' ' HA2' ' A' ' 68' ' ' GLY . . . -98.56 140.7 32.4 Favored 'General case' 0 N--CA 1.429 -1.49 0 CA-C-O 122.712 1.244 . . . . 1.0 110.113 171.812 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 64' ' ' THR . . . . . . . . . . . . . 6.3 t -153.47 -130.04 0.04 OUTLIER 'General case' 0 N--CA 1.431 -1.414 0 O-C-N 120.767 -1.208 . . . . 1.0 109.011 -169.883 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 3.4 tmtp? -72.01 -64.96 0.83 Allowed 'General case' 0 N--CA 1.429 -1.498 0 O-C-N 119.969 -1.707 . . . . 1.0 111.537 -179.871 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -128.24 -26.69 2.79 Favored 'General case' 0 N--CA 1.429 -1.507 0 O-C-N 121.41 -0.806 . . . . 1.0 112.011 179.139 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . -94.84 61.96 1.62 Allowed Glycine 0 N--CA 1.431 -1.668 0 O-C-N 121.062 -1.024 . . . . 1.0 113.486 -168.62 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 68' ' ' GLY . . . . . 0.406 ' HA2' ' HA ' ' A' ' 63' ' ' ALA . . . -75.17 83.81 0.84 Allowed Glycine 0 N--CA 1.43 -1.705 0 CA-C-O 122.609 1.116 . . . . 1.0 115.663 174.412 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 20.0 m-30 -113.96 148.28 37.16 Favored 'General case' 0 N--CA 1.43 -1.432 0 N-CA-C 107.454 -1.313 . . . . 1.0 107.454 -169.634 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 18.1 p-80 -86.52 157.77 19.69 Favored 'General case' 0 N--CA 1.43 -1.428 0 O-C-N 120.288 -1.507 . . . . 1.0 111.272 174.593 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 71' ' ' PHE . . . . . . . . . . . . 0.294 86.9 t80 -121.41 113.18 19.51 Favored 'General case' 0 N--CA 1.43 -1.447 0 C-N-CA 125.671 1.588 . . . . 1.0 107.951 -157.147 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 12.1 m-20 -146.99 157.57 43.66 Favored 'General case' 0 N--CA 1.428 -1.56 0 CA-C-N 119.501 1.046 . . . . 1.0 111.323 -175.532 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 27.5 tp -84.78 137.09 33.4 Favored 'General case' 0 N--CA 1.432 -1.366 0 O-C-N 120.465 -1.397 . . . . 1.0 113.711 -172.302 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 38.9 mmtm -106.14 -96.63 0.35 Allowed 'General case' 0 N--CA 1.429 -1.475 0 C-N-CA 125.143 1.377 . . . . 1.0 108.926 166.971 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -100.7 -96.28 2.22 Favored Glycine 0 N--CA 1.429 -1.774 0 O-C-N 120.946 -1.096 . . . . 1.0 112.989 178.637 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 44.2 t0 -98.19 17.02 19.55 Favored 'General case' 0 N--CA 1.431 -1.394 0 C-N-CA 125.409 1.484 . . . . 1.0 108.182 173.587 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 5.3 mm-40 -135.78 124.58 23.97 Favored 'General case' 0 N--CA 1.43 -1.472 0 N-CA-C 106.162 -1.792 . . . . 1.0 106.162 -167.834 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 78' ' ' TRP . . . . . . . . . . . . . 46.8 m95 -80.56 102.22 9.63 Favored 'General case' 0 N--CA 1.43 -1.472 0 N-CA-C 104.639 -2.356 . . . . 1.0 104.639 161.536 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 1.7 pt -89.22 158.04 2.99 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.474 0 O-C-N 119.184 -2.197 . . . . 1.0 108.122 179.313 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 89.6 m -81.63 116.04 21.18 Favored 'General case' 0 N--CA 1.432 -1.359 0 N-CA-C 106.409 -1.7 . . . . 1.0 106.409 170.974 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 6.1 t70 -69.91 -41.58 74.47 Favored 'General case' 0 N--CA 1.431 -1.412 0 C-N-CA 126.147 1.779 . . . . 1.0 112.538 -161.744 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 27.3 ttt180 -73.24 125.23 27.29 Favored 'General case' 0 N--CA 1.431 -1.389 0 C-N-CA 125.8 1.64 . . . . 1.0 109.514 172.345 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 83' ' ' SER . . . . . . . . . . . . 0.341 56.8 m 73.17 -42.44 0.53 Allowed 'General case' 0 N--CA 1.43 -1.462 0 C-N-CA 126.511 1.924 . . . . 1.0 115.717 -174.947 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 107.18 70.16 0.72 Allowed Glycine 0 N--CA 1.43 -1.752 0 O-C-N 120.629 -1.294 . . . . 1.0 114.38 166.564 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 64.1 mm-40 -120.27 -126.62 0.27 Allowed 'General case' 0 N--CA 1.429 -1.481 0 CA-C-N 117.953 0.877 . . . . 1.0 112.519 -169.383 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 92.7 m -158.59 140.22 13.54 Favored 'General case' 0 N--CA 1.43 -1.467 0 O-C-N 119.806 -1.808 . . . . 1.0 108.851 -168.527 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 0.8 OUTLIER -42.94 -92.46 0.0 OUTLIER 'General case' 0 N--CA 1.43 -1.47 0 C-N-CA 127.699 2.399 . . . . 1.0 115.704 172.366 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 88' ' ' TRP . . . . . . . . . . . . . 1.1 t-105 -75.57 -26.61 58.08 Favored 'General case' 0 N--CA 1.428 -1.535 0 O-C-N 120.517 -1.365 . . . . 1.0 111.01 -164.739 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 60.2 m-20 -63.8 -42.53 97.69 Favored 'General case' 0 N--CA 1.43 -1.442 0 O-C-N 120.175 -1.578 . . . . 1.0 114.586 173.531 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 33.3 tp -74.66 -41.74 59.76 Favored 'General case' 0 N--CA 1.428 -1.526 0 O-C-N 119.457 -2.027 . . . . 1.0 111.733 178.589 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 37.0 tp -55.06 -35.4 64.47 Favored 'General case' 0 N--CA 1.431 -1.415 0 C-N-CA 126.617 1.967 . . . . 1.0 114.371 169.947 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 3.0 tm-20 -61.9 -53.51 54.81 Favored 'General case' 0 N--CA 1.43 -1.428 0 C-N-CA 126.189 1.796 . . . . 1.0 111.222 167.466 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 6.5 tt0 -56.01 -46.33 78.82 Favored 'General case' 0 N--CA 1.43 -1.435 0 CA-C-N 120.808 1.64 . . . . 1.0 115.151 176.514 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -51.67 -58.19 7.07 Favored 'General case' 0 N--CA 1.43 -1.438 0 C-N-CA 127.104 2.162 . . . . 1.0 114.584 171.859 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -64.63 -42.61 95.36 Favored 'General case' 0 N--CA 1.429 -1.487 0 O-C-N 120.5 -1.375 . . . . 1.0 113.604 178.366 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 44.5 m -57.87 -48.35 80.07 Favored 'General case' 0 N--CA 1.43 -1.431 0 C-N-CA 126.561 1.945 . . . . 1.0 112.56 175.403 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 24.1 pt20 -70.3 -28.36 65.13 Favored 'General case' 0 N--CA 1.429 -1.485 0 O-C-N 120.185 -1.572 . . . . 1.0 114.043 -179.953 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 3.6 mm-40 -81.84 -36.65 28.04 Favored 'General case' 0 N--CA 1.429 -1.477 0 O-C-N 120.033 -1.667 . . . . 1.0 114.263 175.656 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -86.14 -34.57 20.54 Favored 'General case' 0 N--CA 1.43 -1.435 0 O-C-N 120.518 -1.364 . . . . 1.0 114.186 -179.817 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . 92.67 22.06 29.69 Favored Glycine 0 N--CA 1.429 -1.794 0 O-C-N 120.514 -1.366 . . . . 1.0 114.073 178.156 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 12.0 pt-20 -158.17 158.46 34.64 Favored 'General case' 0 N--CA 1.43 -1.436 0 N-CA-C 104.707 -2.331 . . . . 1.0 104.707 -172.631 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 39.7 m -74.02 112.68 10.38 Favored 'General case' 0 N--CA 1.43 -1.444 0 CA-C-N 121.318 1.872 . . . . 1.0 111.848 178.205 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 44.7 t -107.24 101.59 12.72 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.444 0 CA-C-O 122.623 1.201 . . . . 1.0 108.315 177.071 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 66.1 p -139.76 149.91 44.14 Favored 'General case' 0 N--CA 1.429 -1.494 0 O-C-N 120.939 -1.101 . . . . 1.0 113.823 -168.057 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 105' ' ' PHE . . . . . . . . . . . . 0.262 0.0 OUTLIER -106.74 -21.94 12.88 Favored 'General case' 0 N--CA 1.429 -1.49 0 C-N-CA 124.679 1.192 . . . . 1.0 110.602 158.76 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 5.2 mmm180 . . . . . 0 C--O 1.26 1.628 0 CA-C-O 117.659 -1.162 . . . . 1.0 111.118 -178.855 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 1.8 p30 . . . . . 0 N--CA 1.43 -1.435 0 N-CA-C 112.278 0.473 . . . . 1.0 112.278 . . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 3.8 m-20 -55.71 -48.67 74.75 Favored 'General case' 0 N--CA 1.431 -1.424 0 C-N-CA 126.605 1.962 . . . . 1.0 114.784 -173.079 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 19.2 m -52.36 -53.93 38.3 Favored 'General case' 0 N--CA 1.43 -1.456 0 C-N-CA 125.186 1.394 . . . . 1.0 113.905 178.418 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 45.0 mt-10 -57.48 -58.59 7.62 Favored 'General case' 0 N--CA 1.431 -1.425 0 C-N-CA 125.49 1.516 . . . . 1.0 112.082 176.414 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 2.7 t80 -56.56 -39.44 73.45 Favored 'General case' 0 N--CA 1.43 -1.459 0 N-CA-C 116.481 2.03 . . . . 1.0 116.481 178.967 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 1.4 m-70 -67.82 -44.16 77.92 Favored 'General case' 0 CA--C 1.489 -1.372 0 O-C-N 121.061 -1.024 . . . . 1.0 113.454 179.418 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -70.89 -41.6 71.11 Favored 'General case' 0 N--CA 1.431 -1.392 0 O-C-N 121.091 -1.006 . . . . 1.0 112.295 178.53 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 89.9 mt -62.49 -39.07 92.28 Favored 'General case' 0 N--CA 1.431 -1.421 0 O-C-N 119.682 -1.886 . . . . 1.0 113.554 174.157 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -59.74 -53.2 60.75 Favored 'General case' 0 N--CA 1.43 -1.473 0 C-N-CA 125.047 1.339 . . . . 1.0 112.776 172.53 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 40.1 t0 -47.44 -54.97 9.94 Favored 'General case' 0 N--CA 1.43 -1.473 0 C-N-CA 127.609 2.364 . . . . 1.0 112.965 177.098 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 42.4 mt-30 -55.23 -50.73 68.69 Favored 'General case' 0 N--CA 1.43 -1.46 0 N-CA-C 116.375 1.991 . . . . 1.0 116.375 173.705 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 1.8 pp -71.27 -38.35 71.85 Favored 'General case' 0 N--CA 1.429 -1.497 0 O-C-N 119.942 -1.724 . . . . 1.0 115.386 178.888 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 0.5 OUTLIER -45.78 -57.19 4.49 Favored 'General case' 0 N--CA 1.429 -1.489 0 C-N-CA 128.231 2.612 . . . . 1.0 113.45 168.195 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 3.0 pp -70.55 -30.34 67.04 Favored 'General case' 0 N--CA 1.43 -1.431 0 O-C-N 120.764 -1.21 . . . . 1.0 112.926 -179.193 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 97.3 m -64.27 -50.19 68.91 Favored 'General case' 0 N--CA 1.43 -1.45 0 C-N-CA 124.419 1.088 . . . . 1.0 112.815 174.516 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 82.7 mt -60.49 -47.53 92.29 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.477 0 O-C-N 120.621 -1.3 . . . . 1.0 111.706 175.422 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 3.8 tt0 -52.45 -57.23 10.52 Favored 'General case' 0 N--CA 1.43 -1.432 0 N-CA-C 114.611 1.337 . . . . 1.0 114.611 175.115 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 21.9 tt0 -75.64 -33.36 60.47 Favored 'General case' 0 N--CA 1.429 -1.504 0 N-CA-C 114.719 1.377 . . . . 1.0 114.719 -174.488 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 2.0 tpm_? -64.81 -44.28 90.39 Favored 'General case' 0 N--CA 1.43 -1.426 0 O-C-N 119.668 -1.895 . . . . 1.0 112.433 174.133 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 4.6 mm? -74.13 -31.41 62.74 Favored 'General case' 0 N--CA 1.431 -1.424 0 N-CA-C 113.18 0.807 . . . . 1.0 113.18 178.435 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 20.1 t70 -54.55 -53.57 52.71 Favored 'General case' 0 N--CA 1.431 -1.423 0 O-C-N 120.432 -1.418 . . . . 1.0 113.171 167.909 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 6.0 t70 -96.52 29.64 2.86 Favored 'General case' 0 N--CA 1.43 -1.435 0 CA-C-O 122.175 0.988 . . . . 1.0 112.721 -174.27 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 24' ' ' TRP . . . . . . . . . . . . . 54.6 t-105 -80.27 -177.71 6.25 Favored 'General case' 0 N--CA 1.43 -1.449 0 O-C-N 120.037 -1.664 . . . . 1.0 111.379 177.083 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 40.1 t0 -81.16 65.82 6.44 Favored 'General case' 0 N--CA 1.429 -1.499 0 O-C-N 119.857 -1.777 . . . . 1.0 111.199 179.525 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -179.84 138.74 3.52 Favored Glycine 0 N--CA 1.429 -1.789 0 N-CA-C 107.056 -2.418 . . . . 1.0 107.056 -179.844 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 3.9 t70 -108.74 -43.68 4.2 Favored 'General case' 0 N--CA 1.43 -1.474 0 N-CA-C 108.446 -0.946 . . . . 1.0 108.446 -179.705 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 67.8 m -85.57 159.92 19.76 Favored 'General case' 0 N--CA 1.43 -1.472 0 C-N-CA 126.041 1.737 . . . . 1.0 109.953 171.876 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 29' ' ' ASP . . . . . 0.683 ' HA ' ' H ' ' A' ' 44' ' ' GLU 0.3 15.9 t70 61.26 20.53 11.12 Favored 'General case' 0 N--CA 1.429 -1.497 0 C-N-CA 128.156 2.582 . . . . 1.0 116.572 176.854 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 10.0 tp -147.21 111.36 0.8 Allowed 'Isoleucine or valine' 0 N--CA 1.43 -1.458 0 O-C-N 120.148 -1.595 . . . . 1.0 107.814 173.219 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 38.2 t0 -153.31 108.68 3.23 Favored 'General case' 0 N--CA 1.43 -1.462 0 O-C-N 120.544 -1.347 . . . . 1.0 108.421 -175.514 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 11.8 t -86.31 143.86 27.67 Favored 'General case' 0 N--CA 1.429 -1.477 0 O-C-N 118.055 -2.903 . . . . 1.0 113.099 -174.855 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 91.7 mt-10 -92.77 136.94 32.8 Favored 'General case' 0 N--CA 1.431 -1.417 0 C-N-CA 125.735 1.614 . . . . 1.0 108.481 167.164 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 4.3 mp -129.66 105.94 12.91 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.444 0 N-CA-C 106.421 -1.696 . . . . 1.0 106.421 177.451 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 35.1 m120 -128.48 77.63 1.79 Allowed 'General case' 0 N--CA 1.43 -1.475 0 CA-C-N 114.768 -1.105 . . . . 1.0 111.045 -178.647 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . 62.49 26.77 68.57 Favored Glycine 0 N--CA 1.429 -1.806 0 N-CA-C 118.587 2.195 . . . . 1.0 118.587 161.255 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 130.92 -32.8 2.94 Favored Glycine 0 N--CA 1.431 -1.685 0 N-CA-C 109.785 -1.326 . . . . 1.0 109.785 -173.82 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 44.9 t -88.41 128.17 40.86 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.434 0 O-C-N 121.639 -0.918 . . . . 1.0 109.212 175.562 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 80.2 mt -114.9 130.26 56.87 Favored 'General case' 0 N--CA 1.43 -1.445 0 N-CA-C 108.089 -1.078 . . . . 1.0 108.089 169.12 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -122.98 114.98 21.14 Favored 'General case' 0 N--CA 1.43 -1.426 0 N-CA-C 106.188 -1.782 . . . . 1.0 106.188 174.926 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 58.7 mt -88.05 112.13 23.21 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.482 0 N-CA-C 105.25 -2.13 . . . . 1.0 105.25 -178.788 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 33.3 m -108.7 143.04 38.32 Favored 'General case' 0 N--CA 1.43 -1.446 0 CA-C-O 122.237 1.017 . . . . 1.0 109.916 -166.024 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 43' ' ' PHE . . . . . . . . . . . . . 53.0 m-85 -115.31 155.96 26.34 Favored 'General case' 0 N--CA 1.43 -1.433 0 C-N-CA 124.874 1.27 . . . . 1.0 108.127 -172.806 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 44' ' ' GLU . . . . . 0.683 ' H ' ' HA ' ' A' ' 29' ' ' ASP . 5.3 mm-40 -66.12 -23.16 66.44 Favored 'General case' 0 N--CA 1.429 -1.501 0 O-C-N 119.291 -2.131 . . . . 1.0 115.299 164.268 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 49.4 m-80 -65.92 -7.26 15.66 Favored 'General case' 0 N--CA 1.429 -1.48 0 C-N-CA 124.989 1.316 . . . . 1.0 114.128 164.963 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 94.99 -8.49 70.25 Favored Glycine 0 N--CA 1.431 -1.694 0 O-C-N 119.962 -1.711 . . . . 1.0 113.925 169.219 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 1.5 m -80.71 -170.33 2.59 Favored 'General case' 0 N--CA 1.43 -1.45 0 C-N-CA 126.626 1.971 . . . . 1.0 113.001 -171.635 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 44.7 pttt -168.6 126.49 1.07 Allowed 'General case' 0 N--CA 1.43 -1.439 0 O-C-N 119.922 -1.736 . . . . 1.0 114.497 -162.819 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 49' ' ' ILE . . . . . 0.45 HD13 HG23 ' A' ' 64' ' ' THR . 5.9 mm -100.23 107.41 20.92 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.45 0 N-CA-C 106.737 -1.579 . . . . 1.0 106.737 166.298 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 4.5 tp -106.18 117.6 52.24 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.506 0 O-C-N 120.036 -1.665 . . . . 1.0 110.886 -173.942 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 3.7 mt -128.55 131.65 68.58 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.408 0 C-N-CA 125.864 1.666 . . . . 1.0 109.943 -171.444 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 16.8 t30 -161.26 175.03 12.74 Favored 'General case' 0 N--CA 1.432 -1.374 0 N-CA-C 104.628 -2.36 . . . . 1.0 104.628 -172.267 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 60.7 ttp85 -151.22 138.4 19.27 Favored 'General case' 0 N--CA 1.43 -1.46 0 O-C-N 120.033 -1.667 . . . . 1.0 108.238 -162.27 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 1.6 tt0 -149.03 -45.35 0.14 Allowed 'General case' 0 CA--C 1.489 -1.394 0 O-C-N 121.154 -0.966 . . . . 1.0 109.339 -168.647 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 55.5 mt-10 -76.05 147.77 80.64 Favored Pre-proline 0 N--CA 1.43 -1.468 0 N-CA-C 114.277 1.214 . . . . 1.0 114.277 -164.553 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 47.8 Cg_endo -77.6 -174.61 2.29 Favored 'Trans proline' 0 C--N 1.299 -2.06 0 C-N-CA 122.811 2.341 . . . . 1.0 111.478 166.221 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 22.8 mt 79.34 -48.66 0.4 Allowed 'General case' 0 N--CA 1.431 -1.402 0 C-N-CA 128.89 2.876 . . . . 1.0 112.122 178.305 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER 143.82 88.33 0.0 OUTLIER 'General case' 0 N--CA 1.43 -1.452 1 C-N-CA 132.382 4.273 . . . . 1.0 108.014 172.382 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 8.1 tt0 -154.25 145.27 22.7 Favored 'General case' 0 N--CA 1.43 -1.458 0 CA-C-N 123.06 2.664 . . . . 1.0 111.922 168.302 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 2.2 t -127.93 160.16 37.97 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.466 0 C-N-CA 127.478 2.311 . . . . 1.0 111.723 -175.395 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 61' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -109.48 152.44 25.41 Favored 'General case' 0 N--CA 1.431 -1.424 0 C-N-CA 124.564 1.146 . . . . 1.0 110.987 177.222 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 2.3 pt? -154.24 124.08 6.73 Favored 'General case' 0 N--CA 1.43 -1.45 0 CA-C-O 122.655 1.216 . . . . 1.0 109.935 168.781 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 63' ' ' ALA . . . . . 0.454 ' HA ' ' HA2' ' A' ' 68' ' ' GLY . . . -124.24 130.48 52.59 Favored 'General case' 0 N--CA 1.429 -1.487 0 N-CA-C 115.042 1.497 . . . . 1.0 115.042 -178.813 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 64' ' ' THR . . . . . 0.45 HG23 HD13 ' A' ' 49' ' ' ILE . 8.6 m -123.97 -102.44 0.38 Allowed 'General case' 0 N--CA 1.432 -1.352 0 C-N-CA 124.467 1.107 . . . . 1.0 110.983 177.553 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 9.1 tmtm? -125.92 -40.63 2.01 Favored 'General case' 0 N--CA 1.429 -1.483 0 O-C-N 120.369 -1.457 . . . . 1.0 111.814 -163.648 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 5.2 tm0? -79.42 -23.96 42.84 Favored 'General case' 0 N--CA 1.428 -1.537 0 O-C-N 120.662 -1.274 . . . . 1.0 112.576 -172.872 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . -176.18 -62.58 0.06 OUTLIER Glycine 0 N--CA 1.43 -1.761 0 O-C-N 120.36 -1.462 . . . . 1.0 112.501 171.229 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 68' ' ' GLY . . . . . 0.454 ' HA2' ' HA ' ' A' ' 63' ' ' ALA . . . 107.61 109.59 3.37 Favored Glycine 0 N--CA 1.43 -1.703 0 C-N-CA 124.894 1.235 . . . . 1.0 110.732 -171.322 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 23.1 m-85 -121.64 170.83 9.33 Favored 'General case' 0 N--CA 1.431 -1.404 0 C-N-CA 125.027 1.331 . . . . 1.0 108.665 -169.096 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 5.6 p80 -115.85 161.08 19.29 Favored 'General case' 0 N--CA 1.43 -1.463 0 O-C-N 120.278 -1.514 . . . . 1.0 110.025 171.606 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 71' ' ' PHE . . . . . . . . . . . . 0.273 65.6 t80 -135.27 120.77 19.27 Favored 'General case' 0 N--CA 1.43 -1.431 0 C-N-CA 124.721 1.208 . . . . 1.0 109.829 -144.418 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 51.4 t0 -139.54 165.82 26.23 Favored 'General case' 0 N--CA 1.43 -1.436 0 CA-C-O 121.884 0.85 . . . . 1.0 110.424 -176.96 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 55.9 tp -103.03 121.59 42.88 Favored 'General case' 0 N--CA 1.43 -1.435 0 O-C-N 120.268 -1.52 . . . . 1.0 113.209 -167.48 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 29.6 mmtm -112.65 84.98 2.07 Favored 'General case' 0 N--CA 1.43 -1.439 0 O-C-N 120.9 -1.125 . . . . 1.0 109.305 170.926 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . 73.38 -95.52 0.77 Allowed Glycine 0 N--CA 1.43 -1.736 0 O-C-N 120.573 -1.33 . . . . 1.0 114.823 174.365 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 55.9 m-20 -104.31 -3.83 23.71 Favored 'General case' 0 N--CA 1.43 -1.425 0 C-N-CA 125.645 1.578 . . . . 1.0 112.975 -176.639 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 33.3 tt0 -150.24 132.39 15.37 Favored 'General case' 0 N--CA 1.429 -1.501 0 N-CA-C 106.317 -1.734 . . . . 1.0 106.317 -169.59 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 78' ' ' TRP . . . . . . . . . . . . . 33.7 m95 -79.93 127.29 32.08 Favored 'General case' 0 N--CA 1.43 -1.441 0 O-C-N 120.666 -1.271 . . . . 1.0 108.878 177.224 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 9.5 mt -103.14 135.86 38.56 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.513 0 C-N-CA 125.766 1.626 . . . . 1.0 107.016 177.565 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -81.39 134.63 35.58 Favored 'General case' 0 N--CA 1.43 -1.456 0 O-C-N 121.009 -1.057 . . . . 1.0 109.168 178.36 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 25.7 t70 -77.6 -20.74 53.47 Favored 'General case' 0 N--CA 1.431 -1.411 0 N-CA-C 115.359 1.615 . . . . 1.0 115.359 -162.684 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 4.3 mmp_? -82.71 -90.03 0.08 Allowed 'General case' 0 N--CA 1.43 -1.432 0 O-C-N 120.349 -1.469 . . . . 1.0 113.462 -174.868 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 31.7 p -72.06 -29.64 64.35 Favored 'General case' 0 N--CA 1.431 -1.39 0 O-C-N 120.069 -1.644 . . . . 1.0 114.16 -176.854 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 106.24 83.37 1.62 Allowed Glycine 0 N--CA 1.43 -1.747 0 N-CA-C 109.716 -1.354 . . . . 1.0 109.716 -171.851 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 5.0 mm-40 -140.66 -172.27 3.41 Favored 'General case' 0 N--CA 1.431 -1.422 0 N-CA-C 105.693 -1.966 . . . . 1.0 105.693 -170.854 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 30.1 m -145.84 131.99 19.4 Favored 'General case' 0 N--CA 1.43 -1.444 0 O-C-N 120.578 -1.326 . . . . 1.0 111.435 -155.077 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 1.1 t80 -21.83 -97.08 0.0 OUTLIER 'General case' 0 N--CA 1.43 -1.433 0 N-CA-C 120.418 3.488 . . . . 1.0 120.418 175.523 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 88' ' ' TRP . . . . . . . . . . . . . 29.9 m95 -71.69 -26.83 62.67 Favored 'General case' 0 N--CA 1.431 -1.419 0 O-C-N 120.247 -1.533 . . . . 1.0 110.889 -167.445 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 16.2 m-20 -79.25 -42.21 26.41 Favored 'General case' 0 N--CA 1.43 -1.456 0 C-N-CA 126.432 1.893 . . . . 1.0 112.747 -176.879 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -70.3 -39.94 74.55 Favored 'General case' 0 N--CA 1.43 -1.452 0 O-C-N 119.716 -1.865 . . . . 1.0 111.54 176.007 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 41.0 tp -53.74 -47.28 70.78 Favored 'General case' 0 N--CA 1.429 -1.484 0 C-N-CA 126.252 1.821 . . . . 1.0 113.589 170.345 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 30.2 tt0 -56.73 -56.19 24.68 Favored 'General case' 0 N--CA 1.43 -1.448 0 C-N-CA 125.08 1.352 . . . . 1.0 113.917 169.832 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 38.6 mt-30 -55.34 -42.91 74.48 Favored 'General case' 0 N--CA 1.43 -1.442 0 C-N-CA 125.168 1.387 . . . . 1.0 113.678 179.248 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -59.21 -55.34 36.2 Favored 'General case' 0 N--CA 1.428 -1.526 0 C-N-CA 127.055 2.142 . . . . 1.0 114.395 173.538 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -65.68 -40.64 92.58 Favored 'General case' 0 N--CA 1.429 -1.498 0 O-C-N 120.222 -1.549 . . . . 1.0 113.314 -179.377 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 31.8 m -56.23 -45.81 79.81 Favored 'General case' 0 N--CA 1.43 -1.426 0 C-N-CA 125.215 1.406 . . . . 1.0 114.335 168.257 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 9.0 pt20 -71.8 -22.27 61.59 Favored 'General case' 0 N--CA 1.431 -1.397 0 O-C-N 120.589 -1.319 . . . . 1.0 114.129 -178.465 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 2.4 mm-40 -72.79 -57.64 3.94 Favored 'General case' 0 N--CA 1.431 -1.381 0 O-C-N 121.441 -0.787 . . . . 1.0 112.83 166.549 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -77.09 -41.95 40.13 Favored 'General case' 0 N--CA 1.43 -1.461 0 N-CA-C 117.089 2.255 . . . . 1.0 117.089 -170.563 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . 83.99 43.27 7.22 Favored Glycine 0 N--CA 1.43 -1.704 0 O-C-N 120.86 -1.15 . . . . 1.0 111.907 -165.868 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 4.9 tp10 -161.28 154.53 21.36 Favored 'General case' 0 N--CA 1.431 -1.419 0 N-CA-C 107.409 -1.33 . . . . 1.0 107.409 -169.69 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 93.2 m -78.47 93.68 4.8 Favored 'General case' 0 N--CA 1.43 -1.449 0 O-C-N 118.953 -2.342 . . . . 1.0 110.594 168.821 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 47.9 t -105.48 90.29 1.53 Allowed 'Isoleucine or valine' 0 N--CA 1.43 -1.437 0 C-N-CA 125.844 1.658 . . . . 1.0 106.931 -179.398 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 59.5 p -143.07 178.23 7.83 Favored 'General case' 0 N--CA 1.43 -1.444 0 O-C-N 120.709 -1.245 . . . . 1.0 113.754 -172.678 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -108.93 -40.41 5.03 Favored 'General case' 0 N--CA 1.43 -1.452 0 O-C-N 120.633 -1.292 . . . . 1.0 110.646 177.577 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 24.9 ttp180 . . . . . 0 C--O 1.259 1.581 0 O-C-N 120.766 -1.209 . . . . 1.0 111.824 -165.549 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 4.3 p30 . . . . . 0 N--CA 1.43 -1.435 0 CA-C-O 121.296 0.57 . . . . 1.0 110.145 . . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 1.1 p-10 -66.58 -30.49 70.8 Favored 'General case' 0 N--CA 1.43 -1.447 0 N-CA-C 114.978 1.473 . . . . 1.0 114.978 -176.67 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 8.5 t -63.52 -54.3 38.45 Favored 'General case' 0 N--CA 1.43 -1.47 0 O-C-N 120.492 -1.38 . . . . 1.0 113.368 174.019 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 53.9 mt-10 -63.38 -42.2 98.81 Favored 'General case' 0 N--CA 1.431 -1.385 0 O-C-N 120.615 -1.303 . . . . 1.0 113.624 176.625 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 6' ' ' PHE . . . . . 0.401 ' CD1' ' HA ' ' A' ' 58' ' ' HIS . 11.6 t80 -44.89 -55.37 5.5 Favored 'General case' 0 N--CA 1.429 -1.479 0 C-N-CA 125.666 1.586 . . . . 1.0 114.5 167.309 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 1.5 p80 -70.08 -30.41 67.63 Favored 'General case' 0 N--CA 1.431 -1.402 0 N-CA-C 114.514 1.302 . . . . 1.0 114.514 -179.61 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 31.1 ttt85 -68.88 -48.78 62.55 Favored 'General case' 0 N--CA 1.43 -1.45 0 C-N-CA 125.816 1.646 . . . . 1.0 113.182 179.152 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 92.1 mt -64.7 -36.77 85.36 Favored 'General case' 0 N--CA 1.429 -1.516 0 C-N-CA 126.193 1.797 . . . . 1.0 112.366 173.589 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -57.78 -47.44 82.53 Favored 'General case' 0 N--CA 1.43 -1.464 0 C-N-CA 124.293 1.037 . . . . 1.0 113.107 171.914 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -56.57 -43.95 80.52 Favored 'General case' 0 N--CA 1.429 -1.522 0 C-N-CA 126.703 2.001 . . . . 1.0 113.4 175.131 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 19.1 mm-40 -54.99 -63.25 1.21 Allowed 'General case' 0 N--CA 1.431 -1.401 0 C-N-CA 124.879 1.272 . . . . 1.0 113.524 172.855 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 3.7 pp -69.86 -39.85 76.12 Favored 'General case' 0 N--CA 1.43 -1.435 0 O-C-N 120.23 -1.543 . . . . 1.0 114.969 -173.621 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 14' ' ' TRP . . . . . 0.432 ' HE1' ' CG2' ' A' ' 51' ' ' ILE . 9.3 m0 -55.02 -48.66 73.07 Favored 'General case' 0 N--CA 1.43 -1.428 0 N-CA-C 114.179 1.178 . . . . 1.0 114.179 172.032 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 41.1 tp -63.71 -39.41 94.24 Favored 'General case' 0 N--CA 1.43 -1.442 0 N-CA-C 113.05 0.759 . . . . 1.0 113.05 175.876 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 25.6 m -52.36 -50.81 61.61 Favored 'General case' 0 N--CA 1.429 -1.497 0 C-N-CA 125.377 1.471 . . . . 1.0 114.709 172.921 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 20.6 mt -66.71 -48.61 79.57 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.483 0 O-C-N 120.174 -1.579 . . . . 1.0 112.206 178.078 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 41.1 tt0 -53.85 -54.56 36.82 Favored 'General case' 0 N--CA 1.43 -1.461 0 C-N-CA 124.638 1.175 . . . . 1.0 112.294 178.114 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 33.9 tt0 -58.32 -49.71 76.23 Favored 'General case' 0 N--CA 1.431 -1.403 0 C-N-CA 126.45 1.9 . . . . 1.0 114.241 178.414 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 8.7 tpm_? -60.49 -44.76 95.61 Favored 'General case' 0 N--CA 1.43 -1.469 0 CA-C-N 119.817 1.19 . . . . 1.0 112.913 -178.964 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 98.1 mt -72.29 -41.14 66.97 Favored 'General case' 0 N--CA 1.43 -1.443 0 N-CA-C 114.594 1.331 . . . . 1.0 114.594 175.769 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 38.0 t70 -59.48 -36.75 76.63 Favored 'General case' 0 N--CA 1.429 -1.483 0 O-C-N 119.365 -2.084 . . . . 1.0 113.566 174.967 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 24.6 t0 -105.17 33.83 3.49 Favored 'General case' 0 N--CA 1.43 -1.475 0 O-C-N 120.181 -1.575 . . . . 1.0 111.261 174.225 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 24' ' ' TRP . . . . . . . . . . . . . 22.6 t-105 -83.41 -61.76 1.76 Allowed 'General case' 0 N--CA 1.429 -1.494 0 O-C-N 119.872 -1.768 . . . . 1.0 109.896 168.515 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 28.1 t70 70.07 -111.66 0.08 Allowed 'General case' 0 N--CA 1.43 -1.438 0 C-N-CA 125.051 1.34 . . . . 1.0 111.501 174.344 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 76.35 -115.7 4.51 Favored Glycine 0 N--CA 1.43 -1.761 0 O-C-N 120.025 -1.672 . . . . 1.0 114.147 172.921 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -101.89 -19.45 15.27 Favored 'General case' 0 N--CA 1.431 -1.419 0 C-N-CA 124.962 1.305 . . . . 1.0 109.788 172.159 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 54.0 p -80.71 173.63 12.41 Favored 'General case' 0 N--CA 1.429 -1.476 0 N-CA-C 115.949 1.833 . . . . 1.0 115.949 -170.262 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 4.7 t70 -130.53 150.77 51.59 Favored 'General case' 0 N--CA 1.431 -1.416 0 N-CA-C 106.31 -1.737 . . . . 1.0 106.31 161.952 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER -155.16 114.27 0.32 Allowed 'Isoleucine or valine' 0 N--CA 1.431 -1.404 0 C-N-CA 125.047 1.339 . . . . 1.0 108.45 -159.923 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 21.1 m-20 -120.35 107.2 12.65 Favored 'General case' 0 N--CA 1.43 -1.441 0 C-N-CA 125.39 1.476 . . . . 1.0 110.645 174.12 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 27.6 t -86.34 136.22 33.22 Favored 'General case' 0 N--CA 1.431 -1.382 0 O-C-N 119.762 -1.836 . . . . 1.0 109.85 165.904 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 79.1 mt-10 -112.22 135.53 52.78 Favored 'General case' 0 N--CA 1.429 -1.478 0 O-C-N 120.904 -1.122 . . . . 1.0 109.342 179.292 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 3.2 tp -111.03 105.48 18.89 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.419 0 CA-C-O 125.1 2.381 . . . . 1.0 107.766 176.297 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 76.6 m-20 -115.63 74.68 0.9 Allowed 'General case' 0 N--CA 1.431 -1.408 0 CA-C-N 113.102 -1.863 . . . . 1.0 109.11 -179.382 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . 76.34 -92.16 0.96 Allowed Glycine 0 N--CA 1.43 -1.733 0 O-C-N 120.663 -1.273 . . . . 1.0 114.588 174.42 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -120.75 20.51 8.7 Favored Glycine 0 N--CA 1.431 -1.695 0 C-N-CA 124.308 0.956 . . . . 1.0 111.054 174.156 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 40.8 t -121.43 123.96 70.8 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.459 0 N-CA-C 107.543 -1.28 . . . . 1.0 107.543 178.257 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 12.6 mt -111.93 130.1 55.96 Favored 'General case' 0 N--CA 1.43 -1.448 0 CA-C-O 122.865 1.317 . . . . 1.0 107.973 167.308 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 17.9 p -126.33 125.8 42.86 Favored 'General case' 0 N--CA 1.431 -1.425 0 N-CA-C 107.387 -1.338 . . . . 1.0 107.387 177.868 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 22.8 mt -106.11 122.77 60.21 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.416 0 N-CA-C 108.846 -0.798 . . . . 1.0 108.846 -177.166 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 39.6 p -116.69 128.21 55.13 Favored 'General case' 0 N--CA 1.43 -1.449 0 CA-C-O 121.177 0.513 . . . . 1.0 112.055 -173.229 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 43' ' ' PHE . . . . . . . . . . . . . 26.1 p90 -119.66 171.85 8.09 Favored 'General case' 0 N--CA 1.431 -1.415 0 C-N-CA 124.447 1.099 . . . . 1.0 111.333 175.504 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 37.3 mm-40 -51.21 -30.88 18.57 Favored 'General case' 0 N--CA 1.43 -1.431 0 N-CA-C 118.88 2.918 . . . . 1.0 118.88 -173.154 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 6.6 m120 -66.95 -17.88 65.12 Favored 'General case' 0 N--CA 1.431 -1.424 0 O-C-N 119.761 -1.837 . . . . 1.0 114.0 179.007 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 86.95 -0.26 86.14 Favored Glycine 0 N--CA 1.429 -1.776 0 O-C-N 120.505 -1.372 . . . . 1.0 113.463 179.449 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 48.2 m -88.48 158.08 18.45 Favored 'General case' 0 N--CA 1.429 -1.502 0 C-N-CA 125.428 1.491 . . . . 1.0 107.66 167.702 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 6.8 ptpt -154.76 159.58 40.74 Favored 'General case' 0 N--CA 1.43 -1.431 0 O-C-N 120.933 -1.104 . . . . 1.0 112.878 -167.294 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 8.9 mm -100.37 137.64 27.23 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.477 0 N-CA-C 106.587 -1.635 . . . . 1.0 106.587 177.107 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 50' ' ' ILE . . . . . 0.405 ' HB ' ' HB3' ' A' ' 63' ' ' ALA . 4.7 mm -126.21 116.7 46.44 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.472 0 C-N-CA 124.518 1.127 . . . . 1.0 109.692 -178.516 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 51' ' ' ILE . . . . . 0.432 ' CG2' ' HE1' ' A' ' 14' ' ' TRP . 3.3 mt -128.47 128.11 67.78 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.428 0 CA-C-O 122.424 1.107 . . . . 1.0 112.378 -179.629 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 52' ' ' ASN . . . . . 0.611 ' H ' ' HD1' ' A' ' 61' ' ' TRP . 20.4 t-20 -151.35 162.47 40.87 Favored 'General case' 0 N--CA 1.43 -1.471 0 C-N-CA 126.452 1.901 . . . . 1.0 105.995 174.379 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -129.09 145.87 51.18 Favored 'General case' 0 N--CA 1.43 -1.432 0 C-N-CA 125.829 1.651 . . . . 1.0 109.897 -174.498 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 2.2 tt0 -151.25 -38.9 0.12 Allowed 'General case' 0 N--CA 1.431 -1.419 0 O-C-N 120.878 -1.139 . . . . 1.0 111.323 -168.993 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 28.8 mm-40 -70.99 156.55 91.9 Favored Pre-proline 0 N--CA 1.43 -1.47 0 N-CA-C 114.417 1.265 . . . . 1.0 114.417 -168.83 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 39.1 Cg_endo -75.88 -25.86 10.13 Favored 'Trans proline' 0 C--N 1.3 -1.987 0 C-N-CA 121.916 1.744 . . . . 1.0 114.126 -165.626 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 49.4 mt -93.51 -112.87 0.1 Allowed 'General case' 0 N--CA 1.429 -1.496 0 CA-C-O 122.726 1.251 . . . . 1.0 111.018 -173.804 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 58' ' ' HIS . . . . . 0.401 ' HA ' ' CD1' ' A' ' 6' ' ' PHE . 1.9 m-70 -125.85 70.1 1.2 Allowed 'General case' 0 N--CA 1.431 -1.394 0 C-N-CA 124.619 1.168 . . . . 1.0 109.171 174.827 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 9.6 mt-30 -141.06 125.44 17.59 Favored 'General case' 0 N--CA 1.431 -1.42 0 O-C-N 120.362 -1.461 . . . . 1.0 109.93 -175.683 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 88.6 t -124.32 156.41 32.0 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.509 0 O-C-N 120.942 -1.099 . . . . 1.0 108.825 -174.77 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 61' ' ' TRP . . . . . 0.611 ' HD1' ' H ' ' A' ' 52' ' ' ASN . 0.0 OUTLIER -92.6 152.22 19.7 Favored 'General case' 0 N--CA 1.43 -1.426 0 O-C-N 120.142 -1.599 . . . . 1.0 110.553 -178.201 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 2.2 tm? -137.27 98.26 3.68 Favored 'General case' 0 N--CA 1.429 -1.5 0 O-C-N 120.41 -1.432 . . . . 1.0 110.465 176.107 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 63' ' ' ALA . . . . . 0.405 ' HB3' ' HB ' ' A' ' 50' ' ' ILE . . . -103.95 139.61 38.86 Favored 'General case' 0 N--CA 1.431 -1.422 0 CA-C-O 123.314 1.531 . . . . 1.0 111.812 172.378 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 64' ' ' THR . . . . . 0.478 HG23 ' H ' ' A' ' 65' ' ' LYS . 0.0 OUTLIER -153.98 -80.16 0.09 Allowed 'General case' 0 N--CA 1.43 -1.436 0 C-N-CA 126.301 1.84 . . . . 1.0 107.066 -174.304 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 65' ' ' LYS . . . . . 0.478 ' H ' HG23 ' A' ' 64' ' ' THR . 3.6 tmtt? -116.65 -53.74 2.49 Favored 'General case' 0 N--CA 1.429 -1.494 0 C-N-CA 125.182 1.393 . . . . 1.0 113.376 176.831 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 50.7 mt-30 -72.43 -24.35 61.21 Favored 'General case' 0 N--CA 1.429 -1.499 0 N-CA-C 117.99 2.589 . . . . 1.0 117.99 -160.803 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 151.49 -9.93 0.7 Allowed Glycine 0 N--CA 1.43 -1.711 0 N-CA-C 116.714 1.446 . . . . 1.0 116.714 174.593 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 98.85 77.01 1.29 Allowed Glycine 0 N--CA 1.43 -1.731 0 CA-C-N 118.902 1.351 . . . . 1.0 110.77 -176.066 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 14.5 m-30 -102.22 122.14 43.61 Favored 'General case' 0 N--CA 1.43 -1.468 0 C-N-CA 124.345 1.058 . . . . 1.0 108.547 -175.589 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -86.5 157.25 19.82 Favored 'General case' 0 N--CA 1.431 -1.411 0 O-C-N 119.974 -1.704 . . . . 1.0 114.288 -179.271 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 49.6 p90 -129.37 138.45 51.53 Favored 'General case' 0 N--CA 1.429 -1.499 0 N-CA-C 113.296 0.85 . . . . 1.0 113.296 -165.558 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 23.5 t0 -126.99 159.54 33.77 Favored 'General case' 0 N--CA 1.43 -1.443 0 C-N-CA 126.34 1.856 . . . . 1.0 110.183 -176.779 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 7.0 tt -91.78 122.44 34.33 Favored 'General case' 0 N--CA 1.429 -1.495 0 O-C-N 120.471 -1.393 . . . . 1.0 112.664 -170.764 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 28.9 tptp -83.56 -56.59 3.65 Favored 'General case' 0 N--CA 1.43 -1.47 0 O-C-N 120.441 -1.412 . . . . 1.0 110.782 167.826 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -170.84 -79.65 0.05 OUTLIER Glycine 0 CA--C 1.487 -1.663 0 O-C-N 120.91 -1.119 . . . . 1.0 111.411 -179.805 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 7.6 m-20 -93.79 5.59 51.15 Favored 'General case' 0 N--CA 1.43 -1.451 0 C-N-CA 124.936 1.294 . . . . 1.0 111.139 178.93 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 7.7 pt-20 -165.59 145.33 6.57 Favored 'General case' 0 N--CA 1.431 -1.414 0 N-CA-C 104.383 -2.451 . . . . 1.0 104.383 -153.716 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 78' ' ' TRP . . . . . . . . . . . . . 27.4 m95 -111.79 139.1 47.54 Favored 'General case' 0 N--CA 1.431 -1.39 0 N-CA-C 107.633 -1.247 . . . . 1.0 107.633 178.254 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 40.4 mt -96.32 135.73 29.48 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.483 0 C-N-CA 127.247 2.219 . . . . 1.0 107.977 -179.379 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 75.8 m -82.5 122.19 27.73 Favored 'General case' 0 N--CA 1.431 -1.41 0 N-CA-C 108.154 -1.054 . . . . 1.0 108.154 171.684 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 16.3 t70 -66.68 -47.87 71.1 Favored 'General case' 0 N--CA 1.429 -1.485 0 N-CA-C 114.224 1.194 . . . . 1.0 114.224 -167.227 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 17.1 mmt180 -72.25 129.24 37.97 Favored 'General case' 0 N--CA 1.43 -1.455 0 O-C-N 120.899 -1.126 . . . . 1.0 109.55 177.804 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 83' ' ' SER . . . . . . . . . . . . 0.27 5.6 t 76.45 -47.64 0.55 Allowed 'General case' 0 N--CA 1.428 -1.532 0 C-N-CA 126.869 2.068 . . . . 1.0 114.124 -168.473 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 99.33 70.91 0.97 Allowed Glycine 0 N--CA 1.429 -1.773 0 O-C-N 120.69 -1.256 . . . . 1.0 111.024 176.68 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 5.5 mm-40 -128.97 -131.89 0.22 Allowed 'General case' 0 N--CA 1.431 -1.418 0 C-N-CA 124.156 0.983 . . . . 1.0 110.752 -166.35 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 93.9 m -153.76 133.61 13.1 Favored 'General case' 0 N--CA 1.431 -1.383 0 O-C-N 120.551 -1.343 . . . . 1.0 109.46 -157.34 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . 0.309 0.0 OUTLIER -49.3 -83.11 0.01 OUTLIER 'General case' 0 N--CA 1.43 -1.446 0 N-CA-C 119.939 3.311 . . . . 1.0 119.939 -175.911 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 88' ' ' TRP . . . . . . . . . . . . . 7.9 m95 -65.83 -34.37 78.01 Favored 'General case' 0 N--CA 1.43 -1.443 0 O-C-N 119.84 -1.788 . . . . 1.0 113.367 -175.106 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -61.64 -41.97 98.25 Favored 'General case' 0 N--CA 1.431 -1.408 0 N-CA-C 114.409 1.263 . . . . 1.0 114.409 176.148 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 17.9 tp -67.82 -48.93 64.86 Favored 'General case' 0 N--CA 1.43 -1.454 0 O-C-N 120.647 -1.283 . . . . 1.0 111.054 175.808 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 58.0 tp -51.96 -46.33 64.76 Favored 'General case' 0 N--CA 1.429 -1.492 0 C-N-CA 126.268 1.827 . . . . 1.0 113.752 174.017 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 18.6 tt0 -53.32 -54.39 37.17 Favored 'General case' 0 N--CA 1.429 -1.501 0 C-N-CA 125.983 1.713 . . . . 1.0 111.873 171.639 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -59.23 -53.25 60.4 Favored 'General case' 0 N--CA 1.43 -1.429 0 N-CA-C 113.418 0.896 . . . . 1.0 113.418 -178.188 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -59.7 -43.92 93.88 Favored 'General case' 0 N--CA 1.43 -1.436 0 C-N-CA 125.841 1.656 . . . . 1.0 115.381 178.455 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -71.31 -40.31 70.87 Favored 'General case' 0 N--CA 1.429 -1.517 0 O-C-N 120.497 -1.377 . . . . 1.0 112.988 178.53 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 95.1 m -63.65 -37.02 85.76 Favored 'General case' 0 N--CA 1.43 -1.44 0 C-N-CA 126.415 1.886 . . . . 1.0 112.06 174.304 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -57.35 -54.54 45.67 Favored 'General case' 0 CA--C 1.489 -1.395 0 C-N-CA 127.108 2.163 . . . . 1.0 112.205 173.382 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 2.3 pt20 -73.57 -33.73 64.79 Favored 'General case' 0 N--CA 1.43 -1.454 0 N-CA-C 115.217 1.562 . . . . 1.0 115.217 179.165 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -75.36 -41.24 56.94 Favored 'General case' 0 N--CA 1.43 -1.47 0 O-C-N 120.111 -1.618 . . . . 1.0 115.206 177.863 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . 85.87 24.41 41.84 Favored Glycine 0 N--CA 1.429 -1.791 0 C-N-CA 124.692 1.139 . . . . 1.0 112.763 -175.198 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 9.3 pt-20 -175.44 159.19 2.39 Favored 'General case' 0 N--CA 1.43 -1.462 0 C-N-CA 126.495 1.918 . . . . 1.0 106.117 -176.24 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 44.0 m -69.79 130.77 43.22 Favored 'General case' 0 N--CA 1.43 -1.456 0 O-C-N 120.792 -1.193 . . . . 1.0 113.271 -169.041 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 69.3 t -102.1 120.96 52.52 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.416 0 N-CA-C 107.771 -1.196 . . . . 1.0 107.771 173.768 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 19.7 m -107.03 141.94 37.46 Favored 'General case' 0 N--CA 1.429 -1.493 0 N-CA-C 115.103 1.52 . . . . 1.0 115.103 -160.285 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 2.6 p90 -127.28 -43.36 1.63 Allowed 'General case' 0 N--CA 1.43 -1.467 0 C-N-CA 125.509 1.524 . . . . 1.0 110.783 179.191 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 30.2 mtt-85 . . . . . 0 C--O 1.261 1.671 0 C-N-CA 124.465 1.106 . . . . 1.0 111.05 -179.907 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 26.5 mmt . . . . . 0 CA--C 1.49 -1.361 0 CA-C-O 121.369 0.604 . . . . 1.0 110.964 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 7.1 p30 -93.27 -51.21 5.11 Favored 'General case' 0 N--CA 1.43 -1.458 0 O-C-N 120.185 -1.572 . . . . 1.0 113.842 -170.172 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 35.3 t70 -55.92 -40.08 72.59 Favored 'General case' 0 N--CA 1.429 -1.479 0 C-N-CA 127.125 2.17 . . . . 1.0 113.46 -178.543 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 5.2 p -68.49 -37.94 80.55 Favored 'General case' 0 N--CA 1.43 -1.467 0 C-N-CA 126.274 1.83 . . . . 1.0 114.359 174.972 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 5' ' ' GLU . . . . . 0.452 ' HG2' ' HE1' ' A' ' 58' ' ' HIS . 14.2 tp10 -67.74 -53.06 30.44 Favored 'General case' 0 N--CA 1.43 -1.435 0 C-N-CA 125.226 1.41 . . . . 1.0 110.115 177.925 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 16.3 t80 -47.25 -50.94 20.17 Favored 'General case' 0 N--CA 1.431 -1.425 0 C-N-CA 127.425 2.29 . . . . 1.0 114.821 169.657 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 35.2 m-70 -63.97 -41.43 97.56 Favored 'General case' 0 N--CA 1.43 -1.452 0 N-CA-C 114.907 1.447 . . . . 1.0 114.907 177.989 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -70.76 -37.19 73.38 Favored 'General case' 0 N--CA 1.43 -1.435 0 O-C-N 120.366 -1.459 . . . . 1.0 114.074 178.887 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 79.7 mt -59.58 -51.55 69.37 Favored 'General case' 0 N--CA 1.43 -1.444 0 C-N-CA 124.99 1.316 . . . . 1.0 111.747 168.239 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -54.06 -50.34 66.95 Favored 'General case' 0 N--CA 1.431 -1.416 0 C-N-CA 125.011 1.324 . . . . 1.0 113.458 176.991 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -51.58 -49.71 61.57 Favored 'General case' 0 N--CA 1.43 -1.425 0 N-CA-C 114.783 1.401 . . . . 1.0 114.783 173.136 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 12.2 pt20 -68.9 -33.27 73.49 Favored 'General case' 0 N--CA 1.43 -1.433 0 N-CA-C 115.583 1.697 . . . . 1.0 115.583 179.764 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 84.8 mt -66.74 -59.07 3.89 Favored 'General case' 0 N--CA 1.431 -1.419 0 O-C-N 120.087 -1.633 . . . . 1.0 111.02 174.753 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 1.2 m-90 -50.3 -50.11 51.58 Favored 'General case' 0 N--CA 1.429 -1.487 0 C-N-CA 125.65 1.58 . . . . 1.0 113.27 -179.565 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 41.0 tp -61.85 -59.05 5.71 Favored 'General case' 0 N--CA 1.43 -1.447 0 N-CA-C 113.626 0.973 . . . . 1.0 113.626 175.775 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 59.6 m -64.88 -37.42 87.58 Favored 'General case' 0 N--CA 1.431 -1.4 0 N-CA-C 114.252 1.204 . . . . 1.0 114.252 -173.621 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 93.5 mt -64.63 -54.24 32.7 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.458 0 C-N-CA 124.923 1.289 . . . . 1.0 111.686 174.83 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 1.7 tt0 -55.48 -49.66 71.94 Favored 'General case' 0 N--CA 1.43 -1.473 0 C-N-CA 123.984 0.914 . . . . 1.0 113.386 178.565 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 44.4 tt0 -54.65 -49.1 71.38 Favored 'General case' 0 N--CA 1.429 -1.493 0 C-N-CA 125.966 1.706 . . . . 1.0 114.025 174.173 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 7.4 tpm_? -58.95 -45.92 89.29 Favored 'General case' 0 N--CA 1.431 -1.406 0 O-C-N 120.726 -1.234 . . . . 1.0 114.291 179.818 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 3.8 pp -83.51 -26.97 29.71 Favored 'General case' 0 N--CA 1.431 -1.384 0 N-CA-C 115.097 1.517 . . . . 1.0 115.097 -177.387 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 8.7 t70 -62.71 -34.09 76.44 Favored 'General case' 0 CA--C 1.488 -1.405 0 O-C-N 120.336 -1.478 . . . . 1.0 113.342 163.591 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 19.2 t70 -70.59 -55.08 9.65 Favored 'General case' 0 N--CA 1.43 -1.472 0 C-N-CA 126.201 1.8 . . . . 1.0 114.559 178.405 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 24' ' ' TRP . . . . . . . . . . . . . 32.4 t-105 -73.03 138.68 46.11 Favored 'General case' 0 N--CA 1.43 -1.456 0 O-C-N 120.703 -1.248 . . . . 1.0 113.104 -172.643 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 63.3 m-20 -84.16 -141.33 0.07 Allowed 'General case' 0 N--CA 1.431 -1.408 0 O-C-N 120.327 -1.483 . . . . 1.0 112.054 177.519 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 164.3 -164.8 36.9 Favored Glycine 0 N--CA 1.431 -1.664 0 O-C-N 118.592 -2.568 . . . . 1.0 114.181 -175.221 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 37.4 t70 -86.84 -53.43 4.92 Favored 'General case' 0 N--CA 1.43 -1.463 0 C-N-CA 125.238 1.415 . . . . 1.0 107.911 169.242 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 4.5 t -82.7 -176.48 6.3 Favored 'General case' 0 N--CA 1.431 -1.414 0 C-N-CA 125.728 1.611 . . . . 1.0 109.691 178.94 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 32.9 t0 -99.85 178.63 4.76 Favored 'General case' 0 N--CA 1.43 -1.449 0 O-C-N 120.26 -1.525 . . . . 1.0 108.142 175.218 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 9.3 tp -152.26 126.58 1.41 Allowed 'Isoleucine or valine' 0 N--CA 1.43 -1.431 0 N-CA-C 106.936 -1.505 . . . . 1.0 106.936 -173.974 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 28.4 t70 -131.73 119.07 20.82 Favored 'General case' 0 N--CA 1.43 -1.439 0 CA-C-O 122.956 1.36 . . . . 1.0 109.13 163.299 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 17.3 p -86.21 131.17 34.3 Favored 'General case' 0 N--CA 1.43 -1.445 0 O-C-N 120.088 -1.632 . . . . 1.0 111.228 174.349 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 41.0 mm-40 -100.06 137.5 38.42 Favored 'General case' 0 N--CA 1.429 -1.488 0 C-N-CA 124.708 1.203 . . . . 1.0 108.916 174.651 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 3.5 tp -127.42 114.1 34.79 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.407 0 CA-C-O 124.046 1.879 . . . . 1.0 106.245 178.81 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 1.6 t-20 -125.81 179.98 4.93 Favored 'General case' 0 N--CA 1.43 -1.427 0 C-N-CA 124.805 1.242 . . . . 1.0 107.828 176.663 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -71.36 87.36 0.41 Allowed Glycine 0 N--CA 1.431 -1.653 0 O-C-N 120.566 -1.334 . . . . 1.0 115.898 -168.657 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 82.2 23.57 56.67 Favored Glycine 0 N--CA 1.429 -1.792 0 C-N-CA 125.379 1.466 . . . . 1.0 112.526 -171.889 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 61.8 t -138.84 135.05 42.92 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.475 0 CA-C-N 118.307 1.053 . . . . 1.0 109.109 -173.253 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 31.1 mt -118.07 142.01 47.86 Favored 'General case' 0 N--CA 1.43 -1.427 0 CA-C-O 122.919 1.343 . . . . 1.0 108.799 166.273 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -138.49 111.3 7.71 Favored 'General case' 0 N--CA 1.43 -1.426 0 O-C-N 120.422 -1.424 . . . . 1.0 108.436 178.032 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 70.3 mt -96.83 105.41 17.07 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.467 0 N-CA-C 107.362 -1.347 . . . . 1.0 107.362 -165.859 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 14.0 m -118.44 131.2 56.28 Favored 'General case' 0 N--CA 1.43 -1.457 0 CA-C-N 118.896 0.771 . . . . 1.0 112.994 -163.053 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 43' ' ' PHE . . . . . . . . . . . . . 1.4 m-85 -99.56 173.68 6.61 Favored 'General case' 0 N--CA 1.43 -1.431 0 O-C-N 120.608 -1.308 . . . . 1.0 111.193 -179.381 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -71.77 -19.03 62.08 Favored 'General case' 0 N--CA 1.429 -1.481 0 O-C-N 119.219 -2.175 . . . . 1.0 113.476 -179.466 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 29.0 t-20 -67.21 -17.97 65.05 Favored 'General case' 0 N--CA 1.429 -1.502 0 C-N-CA 126.811 2.044 . . . . 1.0 113.512 170.731 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 92.34 -14.9 63.5 Favored Glycine 0 N--CA 1.43 -1.74 0 O-C-N 119.962 -1.712 . . . . 1.0 113.683 179.666 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 13.8 m -77.8 167.86 20.86 Favored 'General case' 0 N--CA 1.431 -1.425 0 O-C-N 121.082 -1.246 . . . . 1.0 111.077 172.943 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 12.9 ptpt -169.93 157.68 6.82 Favored 'General case' 0 N--CA 1.43 -1.439 0 O-C-N 121.156 -0.965 . . . . 1.0 113.07 -162.668 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 5.3 mm -101.54 137.11 30.39 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.438 0 C-N-CA 125.791 1.636 . . . . 1.0 107.389 171.823 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 16.1 mm -111.17 116.85 53.61 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.437 0 C-N-CA 125.032 1.333 . . . . 1.0 109.382 -178.013 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 3.0 mt -125.43 124.76 67.68 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.506 0 O-C-N 120.717 -1.239 . . . . 1.0 110.695 179.297 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 52' ' ' ASN . . . . . 0.481 ' H ' ' HD1' ' A' ' 61' ' ' TRP . 26.6 t30 -162.52 172.93 14.7 Favored 'General case' 0 N--CA 1.43 -1.471 0 N-CA-C 103.142 -2.91 . . . . 1.0 103.142 -172.815 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 1.9 ptm180 -139.76 150.57 44.93 Favored 'General case' 0 N--CA 1.429 -1.524 0 CA-C-O 122.546 1.165 . . . . 1.0 112.337 -158.913 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 15.8 mm-40 -107.16 -108.42 0.31 Allowed 'General case' 0 N--CA 1.43 -1.448 0 C-N-CA 124.653 1.181 . . . . 1.0 109.562 -167.173 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 33.2 mm-40 -79.23 135.75 57.6 Favored Pre-proline 0 N--CA 1.43 -1.446 0 CA-C-O 117.718 -1.134 . . . . 1.0 112.799 -172.041 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 98.5 Cg_endo -73.45 62.69 4.46 Favored 'Trans proline' 0 N--CA 1.434 -1.999 0 C-N-CA 123.277 2.651 . . . . 1.0 112.319 162.997 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 73.1 mt -120.32 -103.0 0.41 Allowed 'General case' 0 N--CA 1.429 -1.493 0 N-CA-C 102.841 -3.022 . . . . 1.0 102.841 164.483 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 58' ' ' HIS . . . . . 0.452 ' HE1' ' HG2' ' A' ' 5' ' ' GLU . 1.8 m-70 -132.47 92.02 3.01 Favored 'General case' 0 N--CA 1.429 -1.489 0 N-CA-C 106.622 -1.622 . . . . 1.0 106.622 159.412 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 22.1 tt0 -158.68 122.05 3.84 Favored 'General case' 0 N--CA 1.429 -1.516 0 CA-C-N 121.687 2.04 . . . . 1.0 114.161 173.005 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 86.4 t -133.36 157.57 42.63 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.451 0 C-N-CA 127.031 2.132 . . . . 1.0 109.437 -179.013 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 61' ' ' TRP . . . . . 0.481 ' HD1' ' H ' ' A' ' 52' ' ' ASN . 0.0 OUTLIER -111.36 156.06 22.16 Favored 'General case' 0 N--CA 1.429 -1.505 0 C-N-CA 127.867 2.467 . . . . 1.0 109.755 -174.169 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . 0.277 2.3 pt? -150.91 134.01 16.03 Favored 'General case' 0 N--CA 1.432 -1.364 0 CA-C-N 120.686 1.584 . . . . 1.0 113.916 150.939 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -120.08 147.29 45.03 Favored 'General case' 0 N--CA 1.429 -1.514 0 C-N-CA 125.367 1.467 . . . . 1.0 114.429 -179.557 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 64' ' ' THR . . . . . . . . . . . . . 12.5 t -153.96 -149.52 0.29 Allowed 'General case' 0 N--CA 1.429 -1.509 0 C-N-CA 126.745 2.018 . . . . 1.0 112.388 -172.694 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 5.6 tmtm? -63.56 -53.57 49.64 Favored 'General case' 0 N--CA 1.43 -1.456 0 C-N-CA 130.116 3.366 . . . . 1.0 114.362 -174.404 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 31.3 tt0 -82.24 2.19 33.02 Favored 'General case' 0 N--CA 1.429 -1.492 0 CA-C-O 122.581 1.181 . . . . 1.0 111.602 -177.008 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 117.5 -72.92 0.29 Allowed Glycine 0 N--CA 1.43 -1.732 0 N-CA-C 107.343 -2.303 . . . . 1.0 107.343 -177.4 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 106.06 -173.43 19.85 Favored Glycine 0 N--CA 1.43 -1.733 0 C-N-CA 124.229 0.918 . . . . 1.0 112.486 -176.382 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -162.05 169.83 20.29 Favored 'General case' 0 N--CA 1.431 -1.423 0 N-CA-C 107.284 -1.376 . . . . 1.0 107.284 -173.008 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 19.8 p80 -79.87 159.9 26.25 Favored 'General case' 0 N--CA 1.431 -1.422 0 O-C-N 119.775 -1.828 . . . . 1.0 114.653 174.504 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 71' ' ' PHE . . . . . . . . . . . . 0.3 72.3 t80 -112.21 113.77 26.2 Favored 'General case' 0 N--CA 1.431 -1.402 0 C-N-CA 127.744 2.418 . . . . 1.0 107.019 -158.565 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 5.7 m-20 -134.12 155.1 50.66 Favored 'General case' 0 N--CA 1.43 -1.459 0 CA-C-O 121.851 0.834 . . . . 1.0 110.546 -173.99 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 8.0 tt -97.37 133.53 41.84 Favored 'General case' 0 N--CA 1.431 -1.42 0 O-C-N 119.68 -1.888 . . . . 1.0 111.869 -166.677 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 53.5 tttm -101.81 -56.39 2.29 Favored 'General case' 0 N--CA 1.43 -1.471 0 O-C-N 120.823 -1.173 . . . . 1.0 109.556 174.539 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -157.03 -96.91 0.12 Allowed Glycine 0 N--CA 1.431 -1.677 0 O-C-N 121.035 -1.041 . . . . 1.0 111.346 175.863 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 27.9 m-20 -89.72 16.31 8.17 Favored 'General case' 0 N--CA 1.429 -1.479 0 O-C-N 121.047 -1.266 . . . . 1.0 111.405 179.94 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 32.9 tt0 -166.02 132.83 2.66 Favored 'General case' 0 N--CA 1.43 -1.427 0 N-CA-C 102.046 -3.316 . . . . 1.0 102.046 -161.484 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 78' ' ' TRP . . . . . . . . . . . . . 50.2 m95 -87.75 144.88 26.39 Favored 'General case' 0 N--CA 1.432 -1.37 0 N-CA-C 106.322 -1.732 . . . . 1.0 106.322 175.186 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 9.4 pt -102.35 167.54 2.33 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.485 0 N-CA-C 106.618 -1.623 . . . . 1.0 106.618 174.083 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 1.4 m -89.79 135.65 33.5 Favored 'General case' 0 N--CA 1.429 -1.484 0 O-C-N 120.195 -1.565 . . . . 1.0 107.193 155.29 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 36.8 t70 -59.94 -38.87 83.66 Favored 'General case' 0 N--CA 1.43 -1.447 0 CA-C-N 120.689 1.586 . . . . 1.0 115.069 -174.238 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -9.85 -84.34 0.0 OUTLIER 'General case' 0 N--CA 1.43 -1.467 0 C-N-CA 131.628 3.971 . . . . 1.0 118.457 176.634 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 58.8 m -111.19 -12.79 14.09 Favored 'General case' 0 CA--C 1.489 -1.371 0 O-C-N 120.485 -1.384 . . . . 1.0 109.588 158.126 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 115.85 76.41 0.63 Allowed Glycine 0 N--CA 1.43 -1.763 0 N-CA-C 108.041 -2.023 . . . . 1.0 108.041 -173.509 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 5.2 mm-40 -100.74 -136.4 0.31 Allowed 'General case' 0 N--CA 1.431 -1.419 0 N-CA-C 109.141 -0.688 . . . . 1.0 109.141 -175.583 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 95.5 m -154.2 133.95 12.94 Favored 'General case' 0 N--CA 1.43 -1.445 0 O-C-N 120.156 -1.59 . . . . 1.0 110.402 -171.317 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 1.1 t80 -38.02 -92.13 0.0 OUTLIER 'General case' 0 CA--C 1.489 -1.375 0 C-N-CA 128.432 2.693 . . . . 1.0 115.842 168.895 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 88' ' ' TRP . . . . . . . . . . . . . 50.7 m95 -63.16 -32.69 74.14 Favored 'General case' 0 N--CA 1.431 -1.419 0 C-N-CA 125.649 1.58 . . . . 1.0 113.454 -167.195 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 35.7 t70 -77.96 -42.94 31.24 Favored 'General case' 0 N--CA 1.43 -1.456 0 C-N-CA 125.088 1.355 . . . . 1.0 113.027 -175.898 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 35.0 tp -75.3 -38.9 60.08 Favored 'General case' 0 N--CA 1.43 -1.46 0 O-C-N 119.427 -2.045 . . . . 1.0 111.332 179.335 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 41.9 tp -54.78 -38.64 67.51 Favored 'General case' 0 N--CA 1.43 -1.427 0 C-N-CA 126.33 1.852 . . . . 1.0 113.626 168.106 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 3.4 tm-20 -56.85 -59.9 4.35 Favored 'General case' 0 N--CA 1.429 -1.506 0 C-N-CA 124.611 1.164 . . . . 1.0 112.043 165.875 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 35.9 mt-30 -51.92 -41.81 62.29 Favored 'General case' 0 N--CA 1.43 -1.425 0 N-CA-C 116.28 1.956 . . . . 1.0 116.28 177.394 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -59.19 -58.39 8.84 Favored 'General case' 0 N--CA 1.43 -1.473 0 C-N-CA 126.523 1.929 . . . . 1.0 113.906 172.424 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -62.77 -49.11 76.3 Favored 'General case' 0 N--CA 1.429 -1.507 0 O-C-N 120.41 -1.431 . . . . 1.0 113.446 179.783 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 66.1 m -48.18 -47.55 35.11 Favored 'General case' 0 N--CA 1.43 -1.437 0 C-N-CA 127.859 2.464 . . . . 1.0 114.913 170.501 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 6.6 pt20 -73.4 -30.93 63.59 Favored 'General case' 0 N--CA 1.43 -1.441 0 O-C-N 120.306 -1.496 . . . . 1.0 114.428 -179.222 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 49.7 mt-30 -81.03 -37.93 28.3 Favored 'General case' 0 N--CA 1.431 -1.379 0 O-C-N 120.323 -1.486 . . . . 1.0 113.868 174.715 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -79.42 -42.76 24.73 Favored 'General case' 0 N--CA 1.43 -1.456 0 O-C-N 120.32 -1.488 . . . . 1.0 114.98 -179.686 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . 106.98 17.75 11.35 Favored Glycine 0 N--CA 1.431 -1.695 0 O-C-N 120.683 -1.261 . . . . 1.0 115.762 175.408 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 4.9 tt0 -162.41 152.78 16.81 Favored 'General case' 0 N--CA 1.43 -1.455 0 N-CA-C 104.946 -2.242 . . . . 1.0 104.946 179.527 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 35.1 m -53.48 108.31 0.33 Allowed 'General case' 0 N--CA 1.43 -1.463 0 C-N-CA 125.238 1.415 . . . . 1.0 114.571 175.317 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 49.0 t -89.43 110.49 21.69 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.414 0 CA-C-O 123.258 1.504 . . . . 1.0 108.244 176.892 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 61.5 m -94.19 98.98 11.33 Favored 'General case' 0 N--CA 1.43 -1.46 0 N-CA-C 113.615 0.968 . . . . 1.0 113.615 -162.525 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 88.5 m-85 -89.17 -32.91 17.24 Favored 'General case' 0 N--CA 1.429 -1.485 0 O-C-N 120.961 -1.087 . . . . 1.0 112.884 176.738 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 30.7 mmt180 . . . . . 0 C--O 1.26 1.647 0 N-CA-C 107.3 -1.37 . . . . 1.0 107.3 172.78 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 26.5 mmt . . . . . 0 CA--C 1.491 -1.289 0 N-CA-C 114.482 1.289 . . . . 1.0 114.482 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 76.8 m-20 -110.83 -72.02 0.74 Allowed 'General case' 0 N--CA 1.431 -1.405 0 O-C-N 120.548 -1.345 . . . . 1.0 110.542 -173.643 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -56.86 -45.95 82.12 Favored 'General case' 0 N--CA 1.43 -1.446 0 C-N-CA 126.723 2.009 . . . . 1.0 110.611 170.95 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 49.5 m -60.06 -40.79 90.69 Favored 'General case' 0 N--CA 1.431 -1.416 0 C-N-CA 125.285 1.434 . . . . 1.0 114.776 176.57 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 26.1 tt0 -62.8 -57.34 11.25 Favored 'General case' 0 N--CA 1.429 -1.494 0 C-N-CA 124.236 1.014 . . . . 1.0 111.933 175.265 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 2.4 m-85 -67.31 -24.79 65.79 Favored 'General case' 0 N--CA 1.429 -1.499 0 N-CA-C 115.506 1.669 . . . . 1.0 115.506 178.555 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 10.0 t60 -62.56 -43.28 99.19 Favored 'General case' 0 N--CA 1.43 -1.429 0 O-C-N 119.709 -1.869 . . . . 1.0 112.982 167.857 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -73.84 -45.47 51.02 Favored 'General case' 0 N--CA 1.43 -1.458 0 O-C-N 120.355 -1.465 . . . . 1.0 113.683 177.965 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 84.2 mt -59.76 -44.82 93.69 Favored 'General case' 0 N--CA 1.429 -1.495 0 C-N-CA 124.539 1.135 . . . . 1.0 112.782 173.441 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -58.47 -40.57 83.06 Favored 'General case' 0 N--CA 1.43 -1.47 0 O-C-N 120.538 -1.351 . . . . 1.0 113.427 173.01 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -58.51 -38.48 77.78 Favored 'General case' 0 N--CA 1.431 -1.417 0 CA-C-N 120.276 1.398 . . . . 1.0 114.138 172.358 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 57.9 mm-40 -63.06 -47.94 80.79 Favored 'General case' 0 N--CA 1.43 -1.453 0 O-C-N 119.999 -1.688 . . . . 1.0 114.98 171.719 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 77.6 mt -60.71 -50.06 75.0 Favored 'General case' 0 N--CA 1.431 -1.422 0 O-C-N 120.283 -1.51 . . . . 1.0 112.508 173.863 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 0.4 OUTLIER -46.5 -61.75 1.67 Allowed 'General case' 0 N--CA 1.43 -1.451 0 C-N-CA 127.594 2.358 . . . . 1.0 111.799 177.416 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 53.0 tp -53.62 -58.21 7.99 Favored 'General case' 0 N--CA 1.431 -1.415 0 C-N-CA 125.041 1.336 . . . . 1.0 113.304 174.519 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 28.7 m -60.93 -44.13 97.64 Favored 'General case' 0 N--CA 1.429 -1.485 0 N-CA-C 115.038 1.496 . . . . 1.0 115.038 -170.234 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 7.4 mt -83.41 -27.85 7.69 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.408 0 O-C-N 120.237 -1.539 . . . . 1.0 111.4 -178.196 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 5.4 tt0 -59.33 -50.23 74.78 Favored 'General case' 0 N--CA 1.431 -1.394 0 O-C-N 119.852 -1.78 . . . . 1.0 110.944 167.714 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 53.3 mt-10 -51.84 -52.86 46.41 Favored 'General case' 0 N--CA 1.429 -1.48 0 C-N-CA 126.234 1.814 . . . . 1.0 114.397 172.315 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -63.94 -45.28 89.9 Favored 'General case' 0 N--CA 1.43 -1.472 0 O-C-N 120.277 -1.515 . . . . 1.0 114.843 -177.933 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 96.0 mt -63.93 -49.17 73.67 Favored 'General case' 0 N--CA 1.43 -1.447 0 N-CA-C 115.486 1.661 . . . . 1.0 115.486 174.207 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 25.2 t0 -58.28 -37.58 75.3 Favored 'General case' 0 N--CA 1.429 -1.492 0 O-C-N 119.517 -1.99 . . . . 1.0 114.501 174.349 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 18.2 t70 -91.21 28.32 1.67 Allowed 'General case' 0 N--CA 1.43 -1.46 0 C-N-CA 125.643 1.577 . . . . 1.0 113.9 177.201 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 24' ' ' TRP . . . . . . . . . . . . . 14.1 t90 -65.41 -66.81 0.5 Allowed 'General case' 0 N--CA 1.43 -1.47 0 O-C-N 119.51 -1.994 . . . . 1.0 113.356 176.844 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 29.0 t0 83.2 167.71 0.11 Allowed 'General case' 0 N--CA 1.43 -1.452 0 C-N-CA 127.368 2.267 . . . . 1.0 113.841 172.912 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 116.51 -134.59 11.45 Favored Glycine 0 N--CA 1.431 -1.686 0 C-N-CA 124.803 1.192 . . . . 1.0 111.785 177.223 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -80.57 -28.54 37.16 Favored 'General case' 0 N--CA 1.429 -1.519 0 C-N-CA 126.524 1.93 . . . . 1.0 111.054 -174.921 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 81.9 p -77.42 171.51 14.77 Favored 'General case' 0 N--CA 1.432 -1.366 0 C-N-CA 127.176 2.191 . . . . 1.0 115.68 -172.387 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 17.2 t0 -132.32 157.66 43.88 Favored 'General case' 0 N--CA 1.429 -1.478 0 N-CA-C 107.051 -1.462 . . . . 1.0 107.051 166.18 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 16.6 tt -159.62 123.33 0.41 Allowed 'Isoleucine or valine' 0 N--CA 1.43 -1.461 0 CA-C-O 123.088 1.423 . . . . 1.0 107.754 -169.274 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 31.9 t0 -115.7 101.59 8.97 Favored 'General case' 0 N--CA 1.43 -1.472 0 C-N-CA 127.554 2.342 . . . . 1.0 108.212 -179.377 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 21.7 p -89.26 134.48 34.03 Favored 'General case' 0 N--CA 1.43 -1.447 0 O-C-N 120.283 -1.511 . . . . 1.0 110.345 174.841 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 19.5 mt-10 -129.03 130.11 46.19 Favored 'General case' 0 N--CA 1.431 -1.379 0 O-C-N 120.488 -1.383 . . . . 1.0 111.475 -175.996 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 3.3 tp -106.51 110.77 32.71 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.456 0 C-N-CA 127.34 2.256 . . . . 1.0 105.893 178.335 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 62.7 m-80 -115.17 -178.5 3.39 Favored 'General case' 0 N--CA 1.429 -1.503 0 C-N-CA 126.255 1.822 . . . . 1.0 107.786 175.524 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -71.98 92.79 0.56 Allowed Glycine 0 N--CA 1.431 -1.669 0 O-C-N 119.816 -1.803 . . . . 1.0 115.695 -167.031 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 85.76 11.42 74.05 Favored Glycine 0 N--CA 1.429 -1.782 0 C-N-CA 125.898 1.713 . . . . 1.0 113.264 -174.194 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 48.5 t -136.97 125.89 35.8 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.426 0 O-C-N 121.615 -0.932 . . . . 1.0 111.048 -165.429 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 13.5 mt -105.47 126.0 51.63 Favored 'General case' 0 N--CA 1.43 -1.437 0 CA-C-O 124.511 2.101 . . . . 1.0 108.933 161.587 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -126.66 120.73 30.21 Favored 'General case' 0 N--CA 1.43 -1.449 0 N-CA-C 104.412 -2.44 . . . . 1.0 104.412 -178.621 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 4.5 mp -119.09 126.29 75.23 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.484 0 N-CA-C 108.011 -1.107 . . . . 1.0 108.011 -173.676 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 44.0 p -129.88 130.45 45.22 Favored 'General case' 0 N--CA 1.428 -1.547 0 CA-C-O 121.421 0.629 . . . . 1.0 110.932 -171.83 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 43' ' ' PHE . . . . . . . . . . . . . 1.9 p90 -120.02 172.31 7.83 Favored 'General case' 0 N--CA 1.429 -1.494 0 O-C-N 120.552 -1.343 . . . . 1.0 111.343 -176.395 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -64.02 -24.43 67.71 Favored 'General case' 0 N--CA 1.43 -1.466 0 N-CA-C 116.774 2.138 . . . . 1.0 116.774 -160.062 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 31.1 m120 -66.22 -18.17 65.18 Favored 'General case' 0 N--CA 1.429 -1.489 0 N-CA-C 115.369 1.618 . . . . 1.0 115.369 173.848 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 83.57 43.69 7.23 Favored Glycine 0 N--CA 1.429 -1.774 0 N-CA-C 109.898 -1.281 . . . . 1.0 109.898 -169.929 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 57.8 m -123.94 158.71 31.38 Favored 'General case' 0 N--CA 1.43 -1.468 0 C-N-CA 126.336 1.855 . . . . 1.0 107.213 -177.382 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 22.1 ptmt -151.35 142.3 23.0 Favored 'General case' 0 N--CA 1.43 -1.442 0 N-CA-C 115.21 1.559 . . . . 1.0 115.21 -160.985 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 4.7 mm -109.18 132.71 56.53 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.433 0 N-CA-C 106.136 -1.801 . . . . 1.0 106.136 166.651 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 2.7 tp -125.0 119.75 56.69 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.505 0 CA-C-O 123.116 1.436 . . . . 1.0 109.19 174.243 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 3.0 mt -124.69 96.02 3.58 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.386 0 C-N-CA 126.229 1.812 . . . . 1.0 110.769 -179.035 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 39.4 m-80 -94.68 150.77 19.88 Favored 'General case' 0 N--CA 1.43 -1.473 0 CA-C-O 123.864 1.792 . . . . 1.0 108.469 166.97 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 5.8 tmm_? -153.51 141.6 20.38 Favored 'General case' 0 N--CA 1.429 -1.495 0 CA-C-O 123.237 1.494 . . . . 1.0 110.933 -163.977 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -111.57 132.02 54.84 Favored 'General case' 0 N--CA 1.428 -1.541 0 C-N-CA 127.484 2.314 . . . . 1.0 107.352 178.047 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 56.0 mt-10 -67.33 -48.88 45.5 Favored Pre-proline 0 N--CA 1.43 -1.44 0 CA-C-O 115.687 -2.101 . . . . 1.0 115.295 165.573 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 92.4 Cg_endo -77.29 -172.31 1.41 Allowed 'Trans proline' 0 N--CA 1.434 -2.004 0 CA-C-N 126.449 3.339 . . . . 1.0 112.586 172.401 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 22.3 mt 77.7 -44.54 0.42 Allowed 'General case' 0 N--CA 1.43 -1.45 0 C-N-CA 127.419 2.288 . . . . 1.0 114.609 173.989 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER 91.15 47.0 0.01 OUTLIER 'General case' 0 N--CA 1.43 -1.458 0 C-N-CA 128.865 2.866 . . . . 1.0 112.673 169.035 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -150.49 161.86 41.72 Favored 'General case' 0 N--CA 1.43 -1.454 0 O-C-N 120.403 -1.435 . . . . 1.0 107.169 174.984 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 91.3 t -123.14 154.5 28.77 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.403 0 N-CA-C 108.126 -1.064 . . . . 1.0 108.126 173.166 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 61' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -90.1 153.67 20.36 Favored 'General case' 0 N--CA 1.43 -1.451 0 CA-C-N 120.91 1.687 . . . . 1.0 110.376 176.665 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 2.1 tm? -147.61 103.93 3.57 Favored 'General case' 0 N--CA 1.429 -1.477 0 O-C-N 119.144 -2.222 . . . . 1.0 111.035 178.761 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -123.97 136.07 54.06 Favored 'General case' 0 N--CA 1.43 -1.433 0 O-C-N 120.818 -1.176 . . . . 1.0 113.742 172.915 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 64' ' ' THR . . . . . . . . . . . . 0.258 0.1 OUTLIER -134.66 -80.84 0.44 Allowed 'General case' 0 N--CA 1.429 -1.475 0 N-CA-C 107.415 -1.328 . . . . 1.0 107.415 171.456 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 6.1 tmtm? -82.31 -83.69 0.12 Allowed 'General case' 0 N--CA 1.43 -1.442 0 O-C-N 120.242 -1.536 . . . . 1.0 113.161 -175.84 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 20.9 tt0 -128.51 -26.38 2.77 Favored 'General case' 0 N--CA 1.43 -1.464 0 O-C-N 120.218 -1.551 . . . . 1.0 111.733 -175.357 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . -92.19 71.25 1.67 Allowed Glycine 0 N--CA 1.431 -1.689 0 O-C-N 120.692 -1.255 . . . . 1.0 110.839 -179.466 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . -77.97 94.78 1.23 Allowed Glycine 0 N--CA 1.43 -1.759 0 C-N-CA 123.382 0.515 . . . . 1.0 112.522 168.831 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 15.5 m-85 -126.45 151.53 47.62 Favored 'General case' 0 N--CA 1.43 -1.447 0 N-CA-C 107.699 -1.223 . . . . 1.0 107.699 -171.625 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 5.1 p-80 -92.71 158.17 16.06 Favored 'General case' 0 N--CA 1.431 -1.392 0 O-C-N 120.187 -1.571 . . . . 1.0 111.063 169.411 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 47.1 p90 -130.01 143.32 50.73 Favored 'General case' 0 N--CA 1.431 -1.423 0 N-CA-C 114.379 1.252 . . . . 1.0 114.379 -162.503 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 30.8 m-20 -125.02 154.35 41.41 Favored 'General case' 0 N--CA 1.43 -1.464 0 C-N-CA 125.74 1.616 . . . . 1.0 110.496 -177.729 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 64.2 tp -87.07 137.48 32.31 Favored 'General case' 0 N--CA 1.43 -1.433 0 C-N-CA 125.625 1.57 . . . . 1.0 111.555 -178.397 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 2.5 mmmp? -101.46 -76.15 0.57 Allowed 'General case' 0 N--CA 1.43 -1.471 0 O-C-N 120.694 -1.254 . . . . 1.0 109.279 165.076 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -146.12 -76.35 0.02 OUTLIER Glycine 0 N--CA 1.43 -1.741 0 O-C-N 121.133 -0.98 . . . . 1.0 112.062 -178.674 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 37.8 m-20 -113.99 39.7 2.65 Favored 'General case' 0 N--CA 1.429 -1.502 0 C-N-CA 124.695 1.198 . . . . 1.0 109.382 170.637 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 15.0 tp10 -168.63 138.0 2.3 Favored 'General case' 0 N--CA 1.43 -1.453 0 N-CA-C 103.624 -2.732 . . . . 1.0 103.624 -178.81 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 78' ' ' TRP . . . . . . . . . . . . . 45.1 m95 -101.65 141.55 34.34 Favored 'General case' 0 N--CA 1.429 -1.477 0 N-CA-C 104.984 -2.228 . . . . 1.0 104.984 165.51 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 9.9 pt -105.11 160.6 5.21 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.432 0 O-C-N 120.527 -1.358 . . . . 1.0 107.93 176.744 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 39.0 m -82.74 133.54 35.15 Favored 'General case' 0 N--CA 1.43 -1.431 0 O-C-N 121.041 -1.037 . . . . 1.0 108.674 167.765 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 29.0 t70 -65.25 -43.29 91.84 Favored 'General case' 0 N--CA 1.43 -1.469 0 CA-C-N 120.577 1.535 . . . . 1.0 112.774 -178.092 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 29.2 tpt85 -66.63 101.79 0.83 Allowed 'General case' 0 N--CA 1.43 -1.428 0 C-N-CA 126.822 2.049 . . . . 1.0 111.38 -179.054 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 83' ' ' SER . . . . . . . . . . . . 0.279 15.4 m 80.52 -43.49 0.23 Allowed 'General case' 0 N--CA 1.43 -1.433 0 C-N-CA 128.619 2.767 . . . . 1.0 114.931 -171.87 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 110.86 81.78 1.23 Allowed Glycine 0 N--CA 1.43 -1.751 0 N-CA-C 109.71 -1.356 . . . . 1.0 109.71 -176.181 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . 0.264 16.0 mt-10 -124.72 -140.5 0.29 Allowed 'General case' 0 N--CA 1.43 -1.455 0 CA-C-N 118.19 0.995 . . . . 1.0 109.535 -172.0 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 62.9 m -146.04 129.2 16.63 Favored 'General case' 0 N--CA 1.43 -1.461 0 O-C-N 119.592 -1.942 . . . . 1.0 110.004 -169.388 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 15.0 t80 -58.86 -81.87 0.02 OUTLIER 'General case' 0 N--CA 1.429 -1.481 0 N-CA-C 117.11 2.263 . . . . 1.0 117.11 -171.277 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 88' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -66.94 -34.38 77.65 Favored 'General case' 0 N--CA 1.429 -1.487 0 O-C-N 120.608 -1.307 . . . . 1.0 112.958 -170.697 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 35.5 t70 -59.93 -47.51 85.47 Favored 'General case' 0 N--CA 1.43 -1.458 0 C-N-CA 126.233 1.813 . . . . 1.0 114.62 173.074 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 49.3 tp -69.81 -41.42 75.05 Favored 'General case' 0 N--CA 1.429 -1.524 0 O-C-N 119.541 -1.974 . . . . 1.0 111.981 178.521 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 45.3 tp -50.58 -44.27 56.78 Favored 'General case' 0 N--CA 1.429 -1.519 0 C-N-CA 126.584 1.954 . . . . 1.0 113.763 167.698 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 2.7 tm-20 -59.55 -50.36 74.21 Favored 'General case' 0 N--CA 1.429 -1.504 0 C-N-CA 125.329 1.452 . . . . 1.0 113.122 172.324 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 37.5 mt-30 -53.33 -45.55 69.1 Favored 'General case' 0 N--CA 1.43 -1.446 0 CA-C-N 120.188 1.358 . . . . 1.0 114.373 173.693 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -62.71 -44.47 96.14 Favored 'General case' 0 N--CA 1.43 -1.461 0 O-C-N 120.219 -1.551 . . . . 1.0 115.133 175.024 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -71.21 -45.23 63.77 Favored 'General case' 0 N--CA 1.43 -1.426 0 O-C-N 119.692 -1.88 . . . . 1.0 113.808 178.233 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 63.0 m -57.46 -30.83 65.36 Favored 'General case' 0 N--CA 1.431 -1.409 0 C-N-CA 127.764 2.425 . . . . 1.0 112.521 174.631 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -63.54 -72.36 0.14 Allowed 'General case' 0 N--CA 1.429 -1.507 0 C-N-CA 125.004 1.321 . . . . 1.0 112.098 168.711 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 3.2 pt20 -70.5 -12.17 61.4 Favored 'General case' 0 N--CA 1.43 -1.425 0 N-CA-C 116.756 2.132 . . . . 1.0 116.756 -169.76 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -90.51 -48.2 7.24 Favored 'General case' 0 N--CA 1.43 -1.446 0 C-N-CA 124.854 1.261 . . . . 1.0 112.139 164.643 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . 110.62 4.33 28.38 Favored Glycine 0 N--CA 1.43 -1.702 0 O-C-N 121.037 -1.039 . . . . 1.0 114.379 -178.614 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 11.2 pt-20 -162.91 165.87 24.61 Favored 'General case' 0 N--CA 1.429 -1.511 0 N-CA-C 106.754 -1.573 . . . . 1.0 106.754 -177.087 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 96.4 m -70.83 121.66 18.45 Favored 'General case' 0 N--CA 1.431 -1.424 0 CA-C-N 120.313 1.415 . . . . 1.0 113.424 -173.342 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 76.6 t -98.62 121.36 49.1 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.493 0 C-N-CA 127.272 2.229 . . . . 1.0 109.421 -179.625 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 29.6 m -67.27 124.07 22.09 Favored 'General case' 0 N--CA 1.43 -1.457 0 C-N-CA 128.845 2.858 . . . . 1.0 115.557 -172.721 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 1.6 p90 -140.85 -56.12 0.5 Allowed 'General case' 0 N--CA 1.429 -1.482 0 O-C-N 120.196 -1.565 . . . . 1.0 112.174 -156.032 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 17.6 ttt180 . . . . . 0 C--O 1.262 1.723 0 C-N-CA 125.346 1.459 . . . . 1.0 111.13 -171.938 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 77.4 mtm . . . . . 0 CA--C 1.491 -1.308 0 N-CA-C 113.099 0.777 . . . . 1.0 113.099 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 2.2 m120 -35.88 -70.29 0.09 Allowed 'General case' 0 N--CA 1.431 -1.406 0 N-CA-C 118.876 2.917 . . . . 1.0 118.876 -160.679 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 11.0 p-10 -71.51 -25.34 62.21 Favored 'General case' 0 N--CA 1.43 -1.436 0 O-C-N 120.181 -1.574 . . . . 1.0 114.129 -175.989 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 28.2 m -71.3 -53.65 13.54 Favored 'General case' 0 N--CA 1.43 -1.451 0 C-N-CA 124.877 1.271 . . . . 1.0 110.338 175.943 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 44.6 mm-40 -57.55 -51.17 70.59 Favored 'General case' 0 N--CA 1.429 -1.483 0 C-N-CA 126.622 1.969 . . . . 1.0 113.509 175.778 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 5.1 t80 -56.42 -39.73 73.54 Favored 'General case' 0 CA--C 1.489 -1.4 0 N-CA-C 114.833 1.42 . . . . 1.0 114.833 172.768 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . 0.31 0.2 OUTLIER -67.61 -40.42 84.69 Favored 'General case' 0 N--CA 1.43 -1.429 0 O-C-N 119.543 -1.973 . . . . 1.0 115.009 173.015 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 81.5 mtt180 -56.4 -53.96 51.26 Favored 'General case' 0 N--CA 1.429 -1.476 0 C-N-CA 125.28 1.432 . . . . 1.0 113.832 177.957 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 9' ' ' LEU . . . . . 0.454 HD12 ' N ' ' A' ' 10' ' ' ALA . 3.4 pp -62.0 -42.28 98.98 Favored 'General case' 0 N--CA 1.429 -1.504 0 C-N-CA 124.042 0.937 . . . . 1.0 112.865 176.936 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 10' ' ' ALA . . . . . 0.454 ' N ' HD12 ' A' ' 9' ' ' LEU . . . -56.92 -47.06 81.48 Favored 'General case' 0 N--CA 1.431 -1.419 0 C-N-CA 124.927 1.291 . . . . 1.0 113.996 172.598 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 58.7 m-20 -58.85 -41.7 87.6 Favored 'General case' 0 N--CA 1.43 -1.447 0 C-N-CA 125.484 1.514 . . . . 1.0 113.07 176.265 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . 0.26 15.6 pt20 -70.83 -39.24 73.12 Favored 'General case' 0 N--CA 1.431 -1.42 0 O-C-N 119.696 -1.877 . . . . 1.0 115.859 175.405 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 4.2 pp -73.01 -34.58 66.46 Favored 'General case' 0 N--CA 1.431 -1.376 0 O-C-N 119.183 -2.198 . . . . 1.0 114.028 175.128 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -51.73 -52.05 51.48 Favored 'General case' 0 N--CA 1.43 -1.47 0 C-N-CA 126.257 1.823 . . . . 1.0 112.438 166.434 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 50.8 tp -58.69 -45.83 88.6 Favored 'General case' 0 N--CA 1.429 -1.5 0 C-N-CA 124.643 1.177 . . . . 1.0 113.65 175.088 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 75.3 m -57.0 -59.81 4.51 Favored 'General case' 0 N--CA 1.43 -1.435 0 C-N-CA 125.699 1.6 . . . . 1.0 113.063 175.858 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 84.4 mt -50.15 -45.43 23.7 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.449 0 C-N-CA 126.515 1.926 . . . . 1.0 114.765 172.218 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 10.7 mt-10 -55.57 -63.83 1.04 Allowed 'General case' 0 N--CA 1.43 -1.459 0 O-C-N 119.901 -1.749 . . . . 1.0 113.15 173.65 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 95.2 mt-10 -62.53 -46.55 87.9 Favored 'General case' 0 N--CA 1.43 -1.449 0 C-N-CA 124.998 1.319 . . . . 1.0 113.736 -175.448 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 3.3 tpt180 -73.9 -24.03 59.65 Favored 'General case' 0 N--CA 1.43 -1.447 0 N-CA-C 114.372 1.249 . . . . 1.0 114.372 -174.553 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -88.01 -48.25 7.9 Favored 'General case' 0 N--CA 1.43 -1.43 0 O-C-N 120.742 -1.224 . . . . 1.0 112.088 172.895 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 26.2 t70 -60.33 -50.31 74.14 Favored 'General case' 0 N--CA 1.431 -1.408 0 O-C-N 120.25 -1.531 . . . . 1.0 114.531 -179.244 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 15.5 t70 -93.68 106.99 18.92 Favored 'General case' 0 N--CA 1.429 -1.499 0 O-C-N 119.88 -1.762 . . . . 1.0 109.441 171.047 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 24' ' ' TRP . . . . . . . . . . . . . 14.4 t90 -146.47 175.48 10.53 Favored 'General case' 0 N--CA 1.43 -1.471 0 C-N-CA 126.019 1.728 . . . . 1.0 108.335 -179.165 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 61.0 m-20 -100.48 112.15 24.49 Favored 'General case' 0 N--CA 1.432 -1.351 0 O-C-N 120.356 -1.465 . . . . 1.0 108.502 173.335 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -173.71 167.81 40.49 Favored Glycine 0 N--CA 1.429 -1.797 0 C-N-CA 119.136 -1.506 . . . . 1.0 112.892 176.85 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 31.2 m-20 -88.92 -34.21 17.01 Favored 'General case' 0 N--CA 1.43 -1.475 0 C-N-CA 126.837 2.055 . . . . 1.0 110.607 177.593 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 58.5 p -75.79 147.43 39.22 Favored 'General case' 0 CA--C 1.488 -1.42 0 C-N-CA 124.776 1.23 . . . . 1.0 113.302 -178.717 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 3.3 t0 -90.5 170.58 10.08 Favored 'General case' 0 N--CA 1.431 -1.416 0 O-C-N 120.453 -1.404 . . . . 1.0 111.127 -175.555 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 6.9 mm -152.5 122.59 0.87 Allowed 'Isoleucine or valine' 0 N--CA 1.429 -1.485 0 C-N-CA 128.473 2.709 . . . . 1.0 105.623 -171.288 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 60.6 m-20 -111.39 101.72 10.16 Favored 'General case' 0 N--CA 1.429 -1.513 0 C-N-CA 124.146 0.978 . . . . 1.0 108.803 158.419 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 14.3 p -85.08 124.83 32.22 Favored 'General case' 0 N--CA 1.43 -1.463 0 O-C-N 120.57 -1.331 . . . . 1.0 111.666 173.213 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 36.0 mm-40 -99.4 139.4 35.11 Favored 'General case' 0 N--CA 1.43 -1.429 0 O-C-N 119.781 -1.824 . . . . 1.0 109.534 -174.688 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 4.0 mp -127.2 112.53 28.85 Favored 'Isoleucine or valine' 0 N--CA 1.432 -1.366 0 N-CA-C 105.7 -1.963 . . . . 1.0 105.7 174.437 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 48.5 m-80 -123.8 175.26 6.99 Favored 'General case' 0 N--CA 1.43 -1.455 0 C-N-CA 126.918 2.087 . . . . 1.0 108.244 173.104 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -68.07 86.87 0.18 Allowed Glycine 0 N--CA 1.429 -1.781 0 N-CA-C 116.455 1.342 . . . . 1.0 116.455 -170.615 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 85.86 16.6 63.1 Favored Glycine 0 N--CA 1.43 -1.758 0 C-N-CA 125.29 1.424 . . . . 1.0 112.584 -174.152 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 94.7 t -136.54 122.98 30.13 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.395 0 C-N-CA 124.549 1.139 . . . . 1.0 109.162 -169.828 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 98.9 mt -112.91 140.72 47.47 Favored 'General case' 0 N--CA 1.431 -1.386 0 O-C-N 120.411 -1.431 . . . . 1.0 109.064 168.822 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -134.45 121.06 20.54 Favored 'General case' 0 N--CA 1.43 -1.442 0 O-C-N 120.361 -1.462 . . . . 1.0 108.204 179.229 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 96.4 mt -97.02 115.26 36.14 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.483 0 N-CA-C 106.784 -1.561 . . . . 1.0 106.784 -177.882 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 2.9 m -124.77 122.71 38.2 Favored 'General case' 0 N--CA 1.43 -1.472 0 N-CA-C 108.698 -0.853 . . . . 1.0 108.698 -177.354 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 43' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -115.07 173.28 6.57 Favored 'General case' 0 N--CA 1.429 -1.522 0 C-N-CA 124.339 1.055 . . . . 1.0 110.611 179.882 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -68.89 -23.27 64.18 Favored 'General case' 0 N--CA 1.43 -1.471 0 N-CA-C 116.474 2.027 . . . . 1.0 116.474 -161.017 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 8.4 t-20 -66.85 -18.56 65.44 Favored 'General case' 0 N--CA 1.429 -1.484 0 C-N-CA 124.81 1.244 . . . . 1.0 112.925 169.07 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 99.71 5.06 55.59 Favored Glycine 0 N--CA 1.429 -1.768 0 O-C-N 120.603 -1.311 . . . . 1.0 113.49 172.776 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 1.3 t -89.9 171.83 9.31 Favored 'General case' 0 N--CA 1.431 -1.379 0 CA-C-N 118.277 1.038 . . . . 1.0 112.795 -177.293 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 73.7 tttt -138.17 129.38 27.41 Favored 'General case' 0 N--CA 1.43 -1.468 0 N-CA-C 113.816 1.043 . . . . 1.0 113.816 -157.301 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 1.4 mm -112.32 127.14 69.7 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.39 0 N-CA-C 105.242 -2.133 . . . . 1.0 105.242 161.528 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 50' ' ' ILE . . . . . 0.511 HG23 ' HB3' ' A' ' 63' ' ' ALA . 3.0 tp -123.07 117.89 53.08 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.464 0 CA-C-O 123.67 1.7 . . . . 1.0 109.311 -178.803 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 6.6 mt -121.13 131.64 72.52 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.472 0 C-N-CA 125.703 1.601 . . . . 1.0 109.976 -170.127 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 52' ' ' ASN . . . . . 0.495 ' H ' ' HD1' ' A' ' 61' ' ' TRP . 6.8 t-20 -162.91 163.8 26.17 Favored 'General case' 0 N--CA 1.43 -1.439 0 CA-C-O 124.049 1.881 . . . . 1.0 107.108 -170.993 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 2.6 ttp180 -156.81 117.37 3.62 Favored 'General case' 0 N--CA 1.43 -1.456 0 CA-C-N 114.204 -1.362 . . . . 1.0 109.337 -156.098 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 32.2 mm-40 -104.55 122.29 45.27 Favored 'General case' 0 N--CA 1.43 -1.473 0 C-N-CA 126.562 1.945 . . . . 1.0 106.876 -179.342 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 23.5 mt-10 -55.72 -39.77 79.79 Favored Pre-proline 0 N--CA 1.43 -1.473 0 N-CA-C 119.332 3.086 . . . . 1.0 119.332 -175.505 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 50.1 Cg_exo -67.44 114.01 3.11 Favored 'Trans proline' 0 N--CA 1.434 -1.997 0 CA-C-N 126.107 3.217 . . . . 1.0 113.051 172.752 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . 0.389 5.3 mp 76.89 132.84 0.05 Allowed 'General case' 0 N--CA 1.429 -1.499 0 C-N-CA 126.83 2.052 . . . . 1.0 114.376 -166.872 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 35.4 m170 -73.78 43.65 0.16 Allowed 'General case' 0 N--CA 1.43 -1.451 0 C-N-CA 127.191 2.196 . . . . 1.0 114.48 -175.29 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 85.5 mt-30 -116.98 134.57 54.58 Favored 'General case' 0 N--CA 1.43 -1.474 0 O-C-N 119.877 -1.765 . . . . 1.0 110.321 -172.618 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 59.3 t -105.83 156.26 6.67 Favored 'Isoleucine or valine' 0 N--CA 1.427 -1.591 0 N-CA-C 106.173 -1.788 . . . . 1.0 106.173 177.91 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 61' ' ' TRP . . . . . 0.495 ' HD1' ' H ' ' A' ' 52' ' ' ASN . 0.0 OUTLIER -104.29 144.55 31.47 Favored 'General case' 0 N--CA 1.431 -1.394 0 O-C-N 119.788 -1.82 . . . . 1.0 111.447 170.82 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 13.1 mt -112.86 95.34 5.36 Favored 'General case' 0 N--CA 1.431 -1.392 0 N-CA-C 104.578 -2.379 . . . . 1.0 104.578 163.873 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 63' ' ' ALA . . . . . 0.511 ' HB3' HG23 ' A' ' 50' ' ' ILE . . . -90.79 125.91 35.86 Favored 'General case' 0 N--CA 1.43 -1.444 0 CA-C-O 123.174 1.464 . . . . 1.0 109.224 169.655 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 64' ' ' THR . . . . . . . . . . . . . 9.4 t -152.55 -169.44 3.34 Favored 'General case' 0 N--CA 1.43 -1.453 0 N-CA-C 107.414 -1.328 . . . . 1.0 107.414 -154.9 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 2.3 tptm -56.25 -44.44 79.67 Favored 'General case' 0 N--CA 1.43 -1.466 0 N-CA-C 115.778 1.77 . . . . 1.0 115.778 -178.326 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 82.1 mt-30 -71.66 -24.14 61.79 Favored 'General case' 0 N--CA 1.431 -1.418 0 N-CA-C 115.229 1.566 . . . . 1.0 115.229 -177.313 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 147.25 -46.78 0.71 Allowed Glycine 0 N--CA 1.43 -1.708 0 O-C-N 120.595 -1.315 . . . . 1.0 113.299 175.213 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 125.88 116.77 2.11 Favored Glycine 0 N--CA 1.431 -1.686 0 N-CA-C 117.816 1.886 . . . . 1.0 117.816 178.755 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 20.1 m-30 -123.59 131.99 53.76 Favored 'General case' 0 N--CA 1.431 -1.398 0 C-N-CA 124.791 1.237 . . . . 1.0 109.219 -178.912 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 4.0 p-80 -88.7 158.18 18.29 Favored 'General case' 0 N--CA 1.429 -1.487 0 O-C-N 120.372 -1.455 . . . . 1.0 114.024 173.502 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 48.0 p90 -148.19 148.8 30.94 Favored 'General case' 0 N--CA 1.431 -1.406 0 N-CA-C 115.469 1.655 . . . . 1.0 115.469 -161.369 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 6.2 m-20 -116.46 175.23 5.66 Favored 'General case' 0 N--CA 1.431 -1.414 0 C-N-CA 127.349 2.26 . . . . 1.0 111.808 -172.648 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 50.2 tp -111.3 116.74 31.51 Favored 'General case' 0 N--CA 1.431 -1.416 0 C-N-CA 125.723 1.609 . . . . 1.0 112.039 -178.998 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -72.91 -42.35 63.62 Favored 'General case' 0 N--CA 1.429 -1.495 0 O-C-N 121.14 -0.975 . . . . 1.0 112.476 163.375 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . 166.63 -66.64 0.2 Allowed Glycine 0 N--CA 1.431 -1.694 0 O-C-N 121.035 -1.04 . . . . 1.0 111.815 178.003 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 18.0 p-10 -110.45 6.07 21.86 Favored 'General case' 0 N--CA 1.43 -1.458 0 C-N-CA 124.888 1.275 . . . . 1.0 111.716 -179.108 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 20.2 tt0 -151.72 132.58 14.15 Favored 'General case' 0 N--CA 1.43 -1.44 0 N-CA-C 103.921 -2.622 . . . . 1.0 103.921 -177.574 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 78' ' ' TRP . . . . . 0.445 ' HZ2' HD13 ' A' ' 9' ' ' LEU . 71.3 m95 -89.12 135.54 33.51 Favored 'General case' 0 N--CA 1.43 -1.441 0 N-CA-C 105.667 -1.975 . . . . 1.0 105.667 173.495 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -133.96 136.92 53.13 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.452 0 N-CA-C 104.992 -2.225 . . . . 1.0 104.992 -161.737 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 60.5 m -78.69 137.42 37.79 Favored 'General case' 0 N--CA 1.431 -1.384 0 O-C-N 120.089 -1.632 . . . . 1.0 111.957 -173.194 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 23.8 t0 -72.78 -56.82 4.68 Favored 'General case' 0 N--CA 1.43 -1.428 0 CA-C-O 123.12 1.438 . . . . 1.0 109.548 177.311 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 1.9 tpt85 -72.73 128.59 36.0 Favored 'General case' 0 N--CA 1.43 -1.449 0 C-N-CA 125.535 1.534 . . . . 1.0 110.076 178.59 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 11.0 t 77.86 -63.2 0.34 Allowed 'General case' 0 N--CA 1.43 -1.471 0 C-N-CA 127.33 2.252 . . . . 1.0 112.916 -170.773 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 110.67 71.68 0.66 Allowed Glycine 0 N--CA 1.429 -1.779 0 C-N-CA 124.62 1.105 . . . . 1.0 110.813 -176.774 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 59.6 mt-10 -136.05 -146.36 0.24 Allowed 'General case' 0 N--CA 1.43 -1.441 0 C-N-CA 125.023 1.329 . . . . 1.0 109.444 -170.246 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 88.7 m -143.32 134.8 26.22 Favored 'General case' 0 N--CA 1.43 -1.464 0 O-C-N 120.427 -1.42 . . . . 1.0 109.998 -156.789 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 31.1 t80 -61.03 -76.85 0.05 OUTLIER 'General case' 0 N--CA 1.43 -1.444 0 N-CA-C 117.353 2.353 . . . . 1.0 117.353 -177.535 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 88' ' ' TRP . . . . . . . . . . . . . 55.0 m95 -60.77 -31.88 71.21 Favored 'General case' 0 N--CA 1.431 -1.425 0 O-C-N 120.032 -1.668 . . . . 1.0 114.727 -169.674 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 6.1 t70 -78.14 -36.2 48.04 Favored 'General case' 0 N--CA 1.43 -1.441 0 C-N-CA 125.83 1.652 . . . . 1.0 113.16 177.721 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 50.5 tp -70.63 -41.39 72.26 Favored 'General case' 0 N--CA 1.431 -1.409 0 O-C-N 118.679 -2.513 . . . . 1.0 110.989 175.591 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 31.6 tp -55.46 -37.8 68.23 Favored 'General case' 0 N--CA 1.431 -1.383 0 C-N-CA 126.554 1.942 . . . . 1.0 114.074 169.614 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 35.0 tt0 -60.66 -54.23 47.84 Favored 'General case' 0 N--CA 1.43 -1.434 0 C-N-CA 125.454 1.502 . . . . 1.0 113.028 169.804 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 10.9 tm0? -51.71 -53.81 35.22 Favored 'General case' 0 N--CA 1.43 -1.438 0 C-N-CA 125.995 1.718 . . . . 1.0 114.268 175.133 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -52.21 -55.56 20.36 Favored 'General case' 0 N--CA 1.431 -1.408 0 C-N-CA 127.721 2.408 . . . . 1.0 113.954 176.053 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -61.58 -44.9 96.16 Favored 'General case' 0 N--CA 1.429 -1.49 0 N-CA-C 114.528 1.307 . . . . 1.0 114.528 177.066 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 93.4 m -64.71 -21.21 66.69 Favored 'General case' 0 N--CA 1.429 -1.478 0 O-C-N 119.634 -1.916 . . . . 1.0 113.779 175.324 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 7.5 tp60 -74.45 -65.13 0.89 Allowed 'General case' 0 N--CA 1.429 -1.496 0 O-C-N 120.345 -1.472 . . . . 1.0 110.927 171.749 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 13.3 pt20 -77.38 -28.37 52.81 Favored 'General case' 0 N--CA 1.429 -1.486 0 N-CA-C 115.478 1.658 . . . . 1.0 115.478 -170.963 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -85.6 -46.2 11.02 Favored 'General case' 0 N--CA 1.43 -1.447 0 O-C-N 120.667 -1.271 . . . . 1.0 112.866 171.602 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . 95.61 32.46 6.91 Favored Glycine 0 N--CA 1.43 -1.742 0 O-C-N 120.878 -1.139 . . . . 1.0 114.655 -178.848 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 14.1 pt-20 -158.37 163.1 37.6 Favored 'General case' 0 N--CA 1.43 -1.433 0 O-C-N 120.955 -1.321 . . . . 1.0 108.987 179.57 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 92.6 m -77.9 85.38 4.16 Favored 'General case' 0 N--CA 1.429 -1.502 0 O-C-N 119.862 -1.774 . . . . 1.0 112.58 -178.937 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 47.8 t -85.12 100.38 8.27 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.42 0 C-N-CA 126.914 2.085 . . . . 1.0 106.617 168.378 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 34.9 t -143.09 154.72 44.23 Favored 'General case' 0 N--CA 1.431 -1.415 0 C-N-CA 125.261 1.424 . . . . 1.0 107.93 -174.78 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -110.98 -16.77 13.44 Favored 'General case' 0 N--CA 1.43 -1.456 0 O-C-N 120.437 -1.415 . . . . 1.0 112.217 176.262 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 16.1 mtp180 . . . . . 0 C--O 1.259 1.574 0 N-CA-C 115.519 1.674 . . . . 1.0 115.519 -167.16 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 91.7 mtp . . . . . 0 CA--C 1.49 -1.35 0 CA-C-O 121.391 0.615 . . . . 1.0 110.725 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 18.8 m120 66.53 -84.62 0.03 OUTLIER 'General case' 0 N--CA 1.43 -1.46 0 C-N-CA 126.7 2.0 . . . . 1.0 114.02 -178.278 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -57.3 -47.61 81.04 Favored 'General case' 0 CA--C 1.49 -1.361 0 C-N-CA 127.493 2.317 . . . . 1.0 113.197 -173.235 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 10.5 m -60.07 -42.5 94.67 Favored 'General case' 0 N--CA 1.43 -1.43 0 C-N-CA 125.743 1.617 . . . . 1.0 113.567 177.106 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 9.0 tp10 -70.6 -46.47 63.35 Favored 'General case' 0 N--CA 1.43 -1.426 0 C-N-CA 125.083 1.353 . . . . 1.0 111.729 -178.732 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 4.4 t80 -50.36 -54.69 19.83 Favored 'General case' 0 N--CA 1.429 -1.5 0 C-N-CA 125.802 1.641 . . . . 1.0 114.63 166.572 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 30.4 m170 -59.47 -45.16 92.42 Favored 'General case' 0 N--CA 1.43 -1.454 0 N-CA-C 115.475 1.657 . . . . 1.0 115.475 178.434 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 73.4 mtp85 -56.52 -56.27 23.34 Favored 'General case' 0 N--CA 1.43 -1.433 0 N-CA-C 113.338 0.866 . . . . 1.0 113.338 173.282 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 82.7 mt -66.23 -40.59 90.37 Favored 'General case' 0 N--CA 1.43 -1.441 0 N-CA-C 114.676 1.361 . . . . 1.0 114.676 -179.161 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -62.79 -48.5 78.87 Favored 'General case' 0 N--CA 1.43 -1.468 0 C-N-CA 124.905 1.282 . . . . 1.0 113.383 178.509 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 58.7 m-20 -66.22 -36.33 82.77 Favored 'General case' 0 N--CA 1.429 -1.485 0 O-C-N 120.829 -1.17 . . . . 1.0 113.071 175.812 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 29.1 mm100 -61.65 -46.73 88.52 Favored 'General case' 0 N--CA 1.43 -1.461 0 O-C-N 120.116 -1.615 . . . . 1.0 114.845 170.398 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 1.2 pp -70.05 -37.18 75.48 Favored 'General case' 0 N--CA 1.43 -1.451 0 O-C-N 119.942 -1.724 . . . . 1.0 114.503 -179.688 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 0.1 OUTLIER -43.82 -62.09 1.22 Allowed 'General case' 0 N--CA 1.43 -1.459 0 C-N-CA 127.786 2.434 . . . . 1.0 112.411 163.348 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 44.7 tp -60.06 -47.85 84.15 Favored 'General case' 0 N--CA 1.43 -1.44 0 C-N-CA 124.738 1.215 . . . . 1.0 113.499 177.88 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 32.6 m -57.33 -50.83 71.71 Favored 'General case' 0 N--CA 1.43 -1.474 0 C-N-CA 125.743 1.617 . . . . 1.0 113.686 179.482 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 95.9 mt -65.32 -45.45 93.37 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.465 0 O-C-N 120.353 -1.467 . . . . 1.0 111.554 179.718 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -57.65 -55.05 39.89 Favored 'General case' 0 N--CA 1.428 -1.532 0 O-C-N 121.774 -0.579 . . . . 1.0 112.542 176.26 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 5.5 tm-20 -58.21 -49.7 76.14 Favored 'General case' 0 N--CA 1.43 -1.467 0 C-N-CA 126.103 1.761 . . . . 1.0 114.591 178.008 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.28 -38.54 77.19 Favored 'General case' 0 N--CA 1.43 -1.471 0 C-N-CA 124.72 1.208 . . . . 1.0 113.912 -179.388 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 21' ' ' LEU . . . . . 0.44 HD23 HG21 ' A' ' 41' ' ' ILE . 2.7 tp -86.08 -38.32 17.92 Favored 'General case' 0 N--CA 1.429 -1.495 0 N-CA-C 113.877 1.065 . . . . 1.0 113.877 177.914 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 37.3 t70 -61.23 -26.41 67.72 Favored 'General case' 0 N--CA 1.43 -1.469 0 O-C-N 119.281 -2.137 . . . . 1.0 113.969 173.709 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 29.8 t70 -59.85 -35.51 74.93 Favored 'General case' 0 N--CA 1.429 -1.478 0 C-N-CA 126.247 1.819 . . . . 1.0 114.506 171.02 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 24' ' ' TRP . . . . . . . . . . . . . 48.7 t90 -83.93 138.78 32.98 Favored 'General case' 0 N--CA 1.43 -1.46 0 CA-C-O 122.062 0.934 . . . . 1.0 113.124 -167.349 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 24.0 t70 -133.64 131.46 39.59 Favored 'General case' 0 N--CA 1.431 -1.393 0 O-C-N 121.236 -0.915 . . . . 1.0 109.298 -179.661 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -125.88 -141.35 5.52 Favored Glycine 0 N--CA 1.43 -1.74 0 N-CA-C 109.843 -1.303 . . . . 1.0 109.843 177.272 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -89.07 -26.83 21.18 Favored 'General case' 0 N--CA 1.43 -1.438 0 O-C-N 120.825 -1.397 . . . . 1.0 109.134 165.632 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 88.1 p -82.12 163.98 21.63 Favored 'General case' 0 N--CA 1.431 -1.4 0 O-C-N 120.375 -1.453 . . . . 1.0 111.935 165.448 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 9.4 t70 -117.48 175.48 5.61 Favored 'General case' 0 N--CA 1.43 -1.448 0 N-CA-C 107.442 -1.318 . . . . 1.0 107.442 177.653 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 9.1 tp -159.08 114.24 0.15 Allowed 'Isoleucine or valine' 0 N--CA 1.429 -1.499 0 CA-C-O 123.81 1.767 . . . . 1.0 109.502 -159.884 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 25.1 t0 -131.21 102.47 6.01 Favored 'General case' 0 N--CA 1.43 -1.44 0 C-N-CA 125.501 1.52 . . . . 1.0 110.247 -168.079 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 28.2 t -85.57 135.22 33.9 Favored 'General case' 0 N--CA 1.429 -1.509 0 O-C-N 118.899 -2.376 . . . . 1.0 111.976 176.631 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 38.5 mt-10 -85.11 139.59 31.6 Favored 'General case' 0 N--CA 1.43 -1.44 0 O-C-N 120.953 -1.092 . . . . 1.0 110.856 171.538 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 7.9 mm -111.85 105.39 18.7 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.419 0 N-CA-C 104.927 -2.249 . . . . 1.0 104.927 166.859 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 8.0 t30 -122.95 68.25 0.98 Allowed 'General case' 0 N--CA 1.431 -1.413 0 C-N-CA 125.696 1.599 . . . . 1.0 108.208 -176.58 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . 66.61 -88.48 0.13 Allowed Glycine 0 N--CA 1.429 -1.771 0 O-C-N 120.524 -1.36 . . . . 1.0 115.986 176.584 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -113.88 4.57 24.18 Favored Glycine 0 N--CA 1.43 -1.708 0 C-N-CA 124.866 1.222 . . . . 1.0 112.955 177.953 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 40.3 t -117.54 131.17 71.04 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.483 0 C-N-CA 124.786 1.234 . . . . 1.0 107.679 176.919 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 40.1 mt -110.82 131.05 55.38 Favored 'General case' 0 N--CA 1.429 -1.478 0 O-C-N 120.702 -1.249 . . . . 1.0 108.14 166.771 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -130.6 111.69 12.46 Favored 'General case' 0 N--CA 1.431 -1.423 0 CA-C-O 123.119 1.438 . . . . 1.0 108.003 -174.245 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 41' ' ' ILE . . . . . 0.44 HG21 HD23 ' A' ' 21' ' ' LEU . 69.9 mt -89.66 114.83 28.2 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.421 0 O-C-N 120.762 -1.211 . . . . 1.0 108.023 -170.153 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 6.4 m -111.99 128.87 56.3 Favored 'General case' 0 N--CA 1.43 -1.451 0 CA-C-O 121.694 0.759 . . . . 1.0 111.295 -170.631 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 43' ' ' PHE . . . . . . . . . . . . . 2.7 m-85 -114.74 149.42 36.89 Favored 'General case' 0 N--CA 1.43 -1.445 0 O-C-N 120.437 -1.414 . . . . 1.0 107.731 -175.408 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 4.5 mt-10 -65.8 -17.01 64.34 Favored 'General case' 0 N--CA 1.43 -1.458 0 N-CA-C 116.304 1.965 . . . . 1.0 116.304 176.248 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 3.6 m-20 -64.7 -17.76 64.39 Favored 'General case' 0 N--CA 1.429 -1.478 0 O-C-N 120.66 -1.275 . . . . 1.0 113.538 172.771 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 104.45 -4.46 43.75 Favored Glycine 0 N--CA 1.429 -1.792 0 O-C-N 120.996 -1.065 . . . . 1.0 111.092 -177.861 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 69.0 m -73.92 164.57 26.47 Favored 'General case' 0 N--CA 1.43 -1.442 0 C-N-CA 129.115 2.966 . . . . 1.0 113.458 -179.865 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 81.8 tttt -168.48 132.25 1.54 Allowed 'General case' 0 N--CA 1.43 -1.466 0 O-C-N 120.778 -1.201 . . . . 1.0 114.088 -167.799 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 5.5 mm -112.98 144.4 20.71 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.471 0 C-N-CA 125.082 1.353 . . . . 1.0 108.401 174.417 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 50' ' ' ILE . . . . . 0.431 ' HB ' ' HB3' ' A' ' 63' ' ' ALA . 3.6 mm -120.0 119.39 60.0 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.483 0 C-N-CA 125.494 1.517 . . . . 1.0 109.942 -178.979 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 3.7 mt -126.99 125.6 66.84 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.474 0 O-C-N 120.304 -1.498 . . . . 1.0 111.357 -178.894 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 52' ' ' ASN . . . . . 0.409 ' H ' ' HD1' ' A' ' 61' ' ' TRP . 45.7 t-20 -160.56 166.39 29.12 Favored 'General case' 0 N--CA 1.429 -1.477 0 C-N-CA 126.759 2.024 . . . . 1.0 105.833 -177.206 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 11.1 ptm180 -133.61 145.09 49.71 Favored 'General case' 0 N--CA 1.43 -1.442 0 C-N-CA 125.513 1.525 . . . . 1.0 110.996 -162.49 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 6.2 mm-40 -128.45 -72.61 0.61 Allowed 'General case' 0 N--CA 1.429 -1.476 0 O-C-N 120.728 -1.232 . . . . 1.0 112.623 -175.052 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 54.1 mm-40 -74.12 121.64 85.68 Favored Pre-proline 0 N--CA 1.429 -1.488 0 CA-C-O 117.329 -1.32 . . . . 1.0 112.765 -165.809 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 38.4 Cg_endo -81.13 36.55 0.63 Allowed 'Trans proline' 0 C--N 1.3 -1.998 0 C-N-CA 123.877 3.051 . . . . 1.0 112.918 -174.006 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 55.4 mt -109.79 -100.42 0.39 Allowed 'General case' 0 N--CA 1.431 -1.413 0 N-CA-C 104.354 -2.462 . . . . 1.0 104.354 171.754 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 5.9 m-70 -137.52 79.0 1.72 Allowed 'General case' 0 N--CA 1.43 -1.427 0 C-N-CA 125.57 1.548 . . . . 1.0 111.182 170.22 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 17.9 tt0 -155.5 132.75 10.89 Favored 'General case' 0 N--CA 1.43 -1.451 0 CA-C-N 121.84 2.109 . . . . 1.0 113.155 173.24 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 85.0 t -135.82 164.15 33.03 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.454 0 N-CA-C 107.339 -1.356 . . . . 1.0 107.339 179.933 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 61' ' ' TRP . . . . . 0.409 ' HD1' ' H ' ' A' ' 52' ' ' ASN . 0.1 OUTLIER -105.59 153.97 21.05 Favored 'General case' 0 N--CA 1.43 -1.441 0 O-C-N 119.971 -1.706 . . . . 1.0 114.127 178.298 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 68.9 mt -123.19 97.39 5.4 Favored 'General case' 0 N--CA 1.43 -1.446 0 N-CA-C 107.229 -1.397 . . . . 1.0 107.229 162.605 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 63' ' ' ALA . . . . . 0.431 ' HB3' ' HB ' ' A' ' 50' ' ' ILE . . . -98.24 139.11 34.52 Favored 'General case' 0 N--CA 1.431 -1.417 0 O-C-N 120.811 -1.18 . . . . 1.0 108.744 172.959 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 64' ' ' THR . . . . . . . . . . . . . 6.6 t -152.68 -158.52 0.9 Allowed 'General case' 0 N--CA 1.431 -1.405 0 O-C-N 120.595 -1.316 . . . . 1.0 111.39 -158.794 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 41.3 tptt -57.2 -62.85 1.47 Allowed 'General case' 0 N--CA 1.43 -1.473 0 C-N-CA 127.391 2.276 . . . . 1.0 114.373 178.762 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 31.3 tt0 -76.63 -23.56 53.35 Favored 'General case' 0 N--CA 1.429 -1.51 0 CA-C-O 122.489 1.138 . . . . 1.0 112.933 -171.605 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 155.73 -67.16 0.3 Allowed Glycine 0 N--CA 1.43 -1.704 0 N-CA-C 108.014 -2.034 . . . . 1.0 108.014 -178.398 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 85.92 170.92 47.55 Favored Glycine 0 N--CA 1.43 -1.712 0 C-N-CA 124.245 0.926 . . . . 1.0 114.971 -177.689 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -155.95 164.89 37.91 Favored 'General case' 0 N--CA 1.429 -1.509 0 C-N-CA 123.732 0.813 . . . . 1.0 110.7 -166.375 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 28.2 p80 -82.77 157.76 23.1 Favored 'General case' 0 N--CA 1.431 -1.422 0 N-CA-C 114.952 1.464 . . . . 1.0 114.952 177.518 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 42.6 p90 -121.02 134.42 55.29 Favored 'General case' 0 N--CA 1.431 -1.423 0 CA-C-N 114.835 -1.075 . . . . 1.0 113.55 -175.076 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -131.4 147.33 52.55 Favored 'General case' 0 N--CA 1.43 -1.451 0 C-N-CA 125.207 1.403 . . . . 1.0 108.203 -177.604 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 1.5 tt -85.76 114.0 22.37 Favored 'General case' 0 N--CA 1.43 -1.461 0 O-C-N 119.695 -1.878 . . . . 1.0 112.0 -169.468 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 32.3 mmtp -115.51 72.5 0.8 Allowed 'General case' 0 N--CA 1.43 -1.472 0 O-C-N 120.639 -1.288 . . . . 1.0 111.705 177.944 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . 97.84 -100.27 2.35 Favored Glycine 0 N--CA 1.43 -1.735 0 O-C-N 120.198 -1.564 . . . . 1.0 112.716 175.631 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 34.2 m-20 -115.74 11.09 15.59 Favored 'General case' 0 N--CA 1.431 -1.399 0 C-N-CA 124.436 1.094 . . . . 1.0 111.731 179.908 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 5.3 tp10 -151.44 146.32 25.86 Favored 'General case' 0 N--CA 1.43 -1.467 0 N-CA-C 105.418 -2.068 . . . . 1.0 105.418 -179.957 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 78' ' ' TRP . . . . . 0.449 ' HB2' ' HB2' ' A' ' 87' ' ' PHE . 23.7 m95 -90.25 125.63 35.56 Favored 'General case' 0 N--CA 1.429 -1.499 0 N-CA-C 107.159 -1.423 . . . . 1.0 107.159 176.266 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 2.4 mt -89.44 137.98 20.23 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.469 0 C-N-CA 127.191 2.196 . . . . 1.0 109.396 178.272 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 20.8 m -82.05 141.6 33.05 Favored 'General case' 0 N--CA 1.431 -1.425 0 N-CA-C 108.073 -1.084 . . . . 1.0 108.073 175.655 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 24.7 t70 -78.39 -1.54 33.94 Favored 'General case' 0 N--CA 1.43 -1.426 0 CA-C-N 120.201 1.364 . . . . 1.0 114.555 -175.834 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 2.0 ptt180 -82.29 176.79 9.17 Favored 'General case' 0 N--CA 1.43 -1.446 0 O-C-N 119.171 -2.206 . . . . 1.0 112.312 170.56 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 52.5 m -76.09 65.01 2.03 Favored 'General case' 0 N--CA 1.431 -1.375 0 O-C-N 119.899 -1.751 . . . . 1.0 113.051 170.878 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 170.44 103.14 0.16 Allowed Glycine 0 N--CA 1.43 -1.717 0 N-CA-C 105.577 -3.009 . . . . 1.0 105.577 170.486 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 3.2 pt-20 -116.44 82.08 1.73 Allowed 'General case' 0 N--CA 1.43 -1.444 0 N-CA-C 114.521 1.304 . . . . 1.0 114.521 -146.324 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -162.41 129.41 3.7 Favored 'General case' 0 N--CA 1.431 -1.399 0 N-CA-C 115.545 1.683 . . . . 1.0 115.545 -173.329 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 87' ' ' PHE . . . . . 0.449 ' HB2' ' HB2' ' A' ' 78' ' ' TRP . 4.4 t80 -63.63 -89.24 0.01 OUTLIER 'General case' 0 N--CA 1.43 -1.463 0 N-CA-C 116.432 2.012 . . . . 1.0 116.432 173.048 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 88' ' ' TRP . . . . . . . . . . . . . 68.5 m95 -62.1 -27.31 68.83 Favored 'General case' 0 N--CA 1.429 -1.476 0 C-N-CA 125.313 1.445 . . . . 1.0 113.217 -173.022 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . 0.276 0.6 OUTLIER -78.1 -39.41 41.5 Favored 'General case' 0 N--CA 1.429 -1.479 0 C-N-CA 126.291 1.836 . . . . 1.0 112.916 178.683 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 26.5 tp -72.08 -37.66 69.56 Favored 'General case' 0 N--CA 1.43 -1.436 0 O-C-N 118.419 -2.676 . . . . 1.0 111.784 171.15 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 18.5 tp -54.37 -40.33 68.03 Favored 'General case' 0 N--CA 1.43 -1.435 0 C-N-CA 125.43 1.492 . . . . 1.0 114.144 170.325 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 31.4 tt0 -55.71 -56.23 22.87 Favored 'General case' 0 N--CA 1.431 -1.385 0 C-N-CA 124.535 1.134 . . . . 1.0 112.88 165.908 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 60.7 mt-30 -61.25 -39.38 90.12 Favored 'General case' 0 N--CA 1.43 -1.428 0 N-CA-C 115.14 1.533 . . . . 1.0 115.14 -177.736 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -62.51 -46.7 87.21 Favored 'General case' 0 N--CA 1.43 -1.469 0 O-C-N 119.402 -2.061 . . . . 1.0 112.91 170.622 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -67.59 -36.57 81.14 Favored 'General case' 0 N--CA 1.429 -1.501 0 O-C-N 119.566 -1.959 . . . . 1.0 114.263 176.678 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -57.72 -38.67 75.68 Favored 'General case' 0 N--CA 1.43 -1.448 0 C-N-CA 127.033 2.133 . . . . 1.0 112.474 173.617 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 8.2 pt20 -78.15 -37.11 46.74 Favored 'General case' 0 N--CA 1.431 -1.41 0 O-C-N 121.097 -1.002 . . . . 1.0 113.455 174.963 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 6.9 mm-40 -72.69 -41.91 64.8 Favored 'General case' 0 N--CA 1.43 -1.467 0 N-CA-C 115.308 1.596 . . . . 1.0 115.308 -177.486 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -84.91 -39.15 18.55 Favored 'General case' 0 N--CA 1.429 -1.494 0 C-N-CA 124.804 1.242 . . . . 1.0 112.136 174.255 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . 105.61 12.56 26.24 Favored Glycine 0 N--CA 1.43 -1.715 0 O-C-N 121.004 -1.06 . . . . 1.0 114.256 176.105 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 8.4 pt-20 -165.2 163.44 20.25 Favored 'General case' 0 N--CA 1.43 -1.435 0 N-CA-C 105.439 -2.059 . . . . 1.0 105.439 -175.486 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 94.9 m -67.47 114.06 5.83 Favored 'General case' 0 N--CA 1.43 -1.472 0 CA-C-N 120.286 1.403 . . . . 1.0 113.717 -172.09 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 76.1 t -95.6 122.61 47.23 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.448 0 C-N-CA 126.899 2.08 . . . . 1.0 106.325 171.694 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 59.5 m -103.16 102.63 12.63 Favored 'General case' 0 N--CA 1.43 -1.461 0 C-N-CA 124.556 1.142 . . . . 1.0 112.66 -162.363 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 45.7 m-85 -95.57 -36.67 11.18 Favored 'General case' 0 N--CA 1.43 -1.45 0 O-C-N 120.317 -1.489 . . . . 1.0 111.825 177.363 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 11.7 mmt85 . . . . . 0 C--O 1.26 1.658 0 C-N-CA 124.174 0.99 . . . . 1.0 110.778 -179.42 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 25.0 mmt . . . . . 0 CA--C 1.491 -1.296 0 N-CA-C 112.297 0.48 . . . . 1.0 112.297 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 19.6 m120 -137.77 -179.83 5.99 Favored 'General case' 0 N--CA 1.43 -1.45 0 C-N-CA 124.551 1.14 . . . . 1.0 109.235 175.165 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 25.7 t70 -56.84 -50.35 72.68 Favored 'General case' 0 N--CA 1.43 -1.47 0 C-N-CA 128.239 2.616 . . . . 1.0 112.321 178.947 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 41.9 t -44.7 -50.23 10.07 Favored 'General case' 0 N--CA 1.429 -1.488 0 C-N-CA 128.253 2.621 . . . . 1.0 114.181 170.086 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 14.5 tt0 -74.04 -51.41 15.9 Favored 'General case' 0 N--CA 1.43 -1.457 0 C-N-CA 125.33 1.452 . . . . 1.0 113.024 -177.0 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 11.1 t80 -49.95 -43.51 50.07 Favored 'General case' 0 N--CA 1.431 -1.409 0 N-CA-C 115.753 1.76 . . . . 1.0 115.753 170.698 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 15.2 m-70 -69.9 -33.65 72.47 Favored 'General case' 0 N--CA 1.43 -1.425 0 N-CA-C 114.664 1.357 . . . . 1.0 114.664 175.458 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -66.0 -46.39 78.14 Favored 'General case' 0 N--CA 1.43 -1.458 0 O-C-N 120.731 -1.23 . . . . 1.0 112.96 169.742 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 97.7 mt -60.3 -34.73 74.18 Favored 'General case' 0 N--CA 1.43 -1.438 0 O-C-N 120.57 -1.331 . . . . 1.0 113.745 173.647 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -59.05 -46.69 87.62 Favored 'General case' 0 N--CA 1.43 -1.473 0 C-N-CA 125.692 1.597 . . . . 1.0 113.245 170.307 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -58.28 -41.49 84.46 Favored 'General case' 0 N--CA 1.429 -1.482 0 C-N-CA 124.658 1.183 . . . . 1.0 113.11 172.359 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 55.1 mt-30 -58.13 -58.43 8.47 Favored 'General case' 0 N--CA 1.431 -1.42 0 N-CA-C 115.166 1.543 . . . . 1.0 115.166 172.092 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 3.7 pp -66.36 -40.15 89.58 Favored 'General case' 0 N--CA 1.43 -1.433 0 O-C-N 120.15 -1.594 . . . . 1.0 114.996 -176.483 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 33.7 m0 -64.6 -44.19 91.42 Favored 'General case' 0 N--CA 1.429 -1.487 0 C-N-CA 124.814 1.246 . . . . 1.0 112.948 174.548 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 63.0 tp -58.6 -54.77 43.29 Favored 'General case' 0 N--CA 1.431 -1.417 0 O-C-N 120.564 -1.335 . . . . 1.0 112.506 171.533 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 29.4 m -57.42 -53.39 58.66 Favored 'General case' 0 N--CA 1.43 -1.451 0 C-N-CA 125.492 1.517 . . . . 1.0 113.228 -174.381 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 14.4 mt -68.22 -44.24 84.2 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.44 0 O-C-N 120.499 -1.376 . . . . 1.0 113.846 178.826 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 32.3 tt0 -60.86 -47.57 85.78 Favored 'General case' 0 N--CA 1.431 -1.399 0 CA-C-N 120.641 1.564 . . . . 1.0 112.883 179.09 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 34.0 tt0 -58.75 -55.0 40.69 Favored 'General case' 0 N--CA 1.43 -1.438 0 C-N-CA 125.109 1.364 . . . . 1.0 113.551 174.381 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 16.3 tpt180 -58.39 -44.06 88.81 Favored 'General case' 0 N--CA 1.43 -1.462 0 C-N-CA 124.798 1.239 . . . . 1.0 114.11 -176.084 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 84.8 mt -74.83 -43.38 54.88 Favored 'General case' 0 N--CA 1.43 -1.436 0 O-C-N 121.0 -1.062 . . . . 1.0 113.845 179.013 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 21.1 t70 -64.09 -35.14 79.77 Favored 'General case' 0 CA--C 1.488 -1.434 0 O-C-N 120.527 -1.358 . . . . 1.0 114.433 176.092 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 29.4 t70 -71.8 -43.36 65.78 Favored 'General case' 0 N--CA 1.431 -1.404 0 O-C-N 120.33 -1.481 . . . . 1.0 113.84 179.715 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 24' ' ' TRP . . . . . . . . . . . . . 68.8 t-105 -78.71 154.45 30.07 Favored 'General case' 0 N--CA 1.43 -1.474 0 CA-C-O 122.342 1.068 . . . . 1.0 113.523 -173.304 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 52.5 m-20 -96.93 -153.76 0.43 Allowed 'General case' 0 N--CA 1.431 -1.419 0 O-C-N 120.384 -1.447 . . . . 1.0 111.381 -176.165 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 153.16 -173.68 31.99 Favored Glycine 0 N--CA 1.431 -1.639 0 N-CA-C 109.003 -1.639 . . . . 1.0 109.003 -178.275 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 6.6 t70 -78.06 -44.64 25.77 Favored 'General case' 0 N--CA 1.432 -1.351 0 O-C-N 121.418 -1.048 . . . . 1.0 108.322 170.326 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 21.9 t -68.31 156.4 37.79 Favored 'General case' 0 N--CA 1.43 -1.469 0 C-N-CA 125.912 1.685 . . . . 1.0 113.743 172.661 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 4.6 t70 -86.52 175.45 8.34 Favored 'General case' 0 N--CA 1.429 -1.475 0 C-N-CA 125.833 1.653 . . . . 1.0 107.735 164.471 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -162.89 119.63 0.16 Allowed 'Isoleucine or valine' 0 N--CA 1.43 -1.436 0 O-C-N 120.223 -1.548 . . . . 1.0 107.508 -172.051 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 26.3 t70 -131.93 111.26 11.41 Favored 'General case' 0 N--CA 1.43 -1.458 0 O-C-N 120.189 -1.569 . . . . 1.0 108.743 174.258 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 96.3 m -90.25 134.93 33.99 Favored 'General case' 0 N--CA 1.431 -1.385 0 O-C-N 119.231 -2.168 . . . . 1.0 109.857 174.399 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 37.0 mt-10 -101.97 132.78 47.59 Favored 'General case' 0 N--CA 1.431 -1.419 0 C-N-CA 125.012 1.325 . . . . 1.0 109.157 -178.605 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 3.6 tp -112.48 113.59 44.57 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.449 0 CA-C-O 123.792 1.758 . . . . 1.0 106.379 175.756 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -136.42 99.08 3.99 Favored 'General case' 0 N--CA 1.43 -1.45 0 CA-C-N 114.578 -1.192 . . . . 1.0 111.219 -177.849 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . 71.77 26.24 73.25 Favored Glycine 0 N--CA 1.429 -1.774 0 O-C-N 120.251 -1.531 . . . . 1.0 116.34 164.395 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 86.95 20.71 52.76 Favored Glycine 0 N--CA 1.43 -1.752 0 C-N-CA 123.798 0.713 . . . . 1.0 112.889 -173.785 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 84.9 t -125.08 131.48 72.45 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.394 0 N-CA-C 105.815 -1.921 . . . . 1.0 105.815 173.068 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 42.5 mt -102.6 132.25 48.82 Favored 'General case' 0 N--CA 1.431 -1.398 0 CA-C-O 122.56 1.172 . . . . 1.0 109.615 165.785 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 40' ' ' THR . . . . . 0.402 HG23 HD13 ' A' ' 50' ' ' ILE . 0.1 OUTLIER -118.13 124.62 48.45 Favored 'General case' 0 N--CA 1.43 -1.427 0 N-CA-C 106.724 -1.584 . . . . 1.0 106.724 171.392 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 69.7 mt -101.42 121.57 52.48 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.475 0 N-CA-C 108.406 -0.961 . . . . 1.0 108.406 -173.626 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 20.2 p -123.72 118.51 27.38 Favored 'General case' 0 N--CA 1.431 -1.397 0 N-CA-C 113.942 1.09 . . . . 1.0 113.942 -173.439 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 43' ' ' PHE . . . . . . . . . . . . . 3.0 p90 -123.32 169.82 10.93 Favored 'General case' 0 N--CA 1.43 -1.44 0 C-N-CA 126.015 1.726 . . . . 1.0 114.088 174.674 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 7.5 mm-40 -53.34 -32.71 50.42 Favored 'General case' 0 N--CA 1.43 -1.441 0 N-CA-C 118.129 2.64 . . . . 1.0 118.129 -174.44 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -66.78 -12.99 60.89 Favored 'General case' 0 N--CA 1.43 -1.449 0 O-C-N 120.478 -1.389 . . . . 1.0 113.527 -179.715 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 100.96 -14.37 58.68 Favored Glycine 0 N--CA 1.43 -1.755 0 O-C-N 120.791 -1.193 . . . . 1.0 113.425 166.008 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 4.3 m -77.09 168.75 19.55 Favored 'General case' 0 N--CA 1.43 -1.451 0 C-N-CA 124.615 1.166 . . . . 1.0 111.661 176.918 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 93.1 mttt -142.91 135.48 27.64 Favored 'General case' 0 N--CA 1.43 -1.451 0 O-C-N 121.03 -1.044 . . . . 1.0 111.154 -172.266 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 49' ' ' ILE . . . . . 0.633 HD12 HG23 ' A' ' 64' ' ' THR . 4.2 mm -101.36 137.31 29.46 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.414 0 N-CA-C 105.922 -1.881 . . . . 1.0 105.922 175.671 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 50' ' ' ILE . . . . . 0.553 HG23 ' HB3' ' A' ' 63' ' ' ALA . 2.5 tp -128.06 124.83 63.44 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.469 0 CA-C-O 123.078 1.418 . . . . 1.0 109.687 -176.778 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 2.3 mt -127.45 118.03 48.47 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.496 0 C-N-CA 126.316 1.846 . . . . 1.0 111.906 -172.858 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 52' ' ' ASN . . . . . 0.417 ' H ' ' HD1' ' A' ' 61' ' ' TRP . 48.6 t30 -157.75 171.42 20.34 Favored 'General case' 0 N--CA 1.431 -1.418 0 C-N-CA 127.022 2.129 . . . . 1.0 107.792 -176.305 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -136.74 161.17 36.68 Favored 'General case' 0 N--CA 1.43 -1.474 0 C-N-CA 125.722 1.609 . . . . 1.0 114.547 -167.668 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 13.3 mm100 -108.09 129.03 55.17 Favored 'General case' 0 N--CA 1.429 -1.493 0 C-N-CA 125.998 1.719 . . . . 1.0 106.59 169.572 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 47.1 tt0 -60.69 -38.21 53.96 Favored Pre-proline 0 N--CA 1.428 -1.536 0 CA-C-O 117.132 -1.413 . . . . 1.0 114.528 164.481 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 51.9 Cg_exo -66.55 121.57 8.84 Favored 'Trans proline' 0 C--N 1.299 -2.056 0 CA-C-N 124.97 2.811 . . . . 1.0 113.745 160.716 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . 0.381 5.0 mp 75.3 131.9 0.05 OUTLIER 'General case' 0 N--CA 1.43 -1.43 0 CA-C-O 124.944 2.306 . . . . 1.0 116.336 -179.041 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 41.7 m-70 -79.98 55.85 2.22 Favored 'General case' 0 N--CA 1.429 -1.502 0 C-N-CA 126.358 1.863 . . . . 1.0 114.144 -172.661 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -144.06 147.37 33.71 Favored 'General case' 0 N--CA 1.43 -1.453 0 C-N-CA 126.112 1.765 . . . . 1.0 110.528 -178.279 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 43.3 t -121.09 151.16 24.1 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.431 0 O-C-N 120.484 -1.385 . . . . 1.0 109.457 -175.372 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 61' ' ' TRP . . . . . 0.456 ' HA ' ' HA ' ' A' ' 70' ' ' HIS . 0.0 OUTLIER -88.77 152.87 21.51 Favored 'General case' 0 N--CA 1.43 -1.461 0 O-C-N 119.65 -1.906 . . . . 1.0 114.533 -178.565 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 80.6 mt -116.17 93.89 4.42 Favored 'General case' 0 N--CA 1.43 -1.444 0 N-CA-C 106.594 -1.632 . . . . 1.0 106.594 162.422 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 63' ' ' ALA . . . . . 0.553 ' HB3' HG23 ' A' ' 50' ' ' ILE . . . -92.96 100.18 12.68 Favored 'General case' 0 N--CA 1.43 -1.429 0 CA-C-O 123.26 1.505 . . . . 1.0 109.872 169.016 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 64' ' ' THR . . . . . 0.633 HG23 HD12 ' A' ' 49' ' ' ILE . 3.0 m -111.33 -113.51 0.32 Allowed 'General case' 0 N--CA 1.429 -1.509 0 N-CA-C 106.691 -1.596 . . . . 1.0 106.691 -171.909 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 13.3 tmtt? -82.81 -45.59 14.13 Favored 'General case' 0 N--CA 1.43 -1.45 0 O-C-N 119.745 -1.847 . . . . 1.0 111.01 174.452 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 66' ' ' GLN . . . . . 0.436 HE22 ' HB2' ' A' ' 94' ' ' ALA . 17.5 mp0 -74.59 -27.02 60.3 Favored 'General case' 0 N--CA 1.43 -1.469 0 N-CA-C 116.099 1.888 . . . . 1.0 116.099 -166.475 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 117.48 26.24 2.94 Favored Glycine 0 N--CA 1.43 -1.752 0 N-CA-C 117.133 1.613 . . . . 1.0 117.133 166.074 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 115.51 74.59 0.58 Allowed Glycine 0 N--CA 1.43 -1.752 0 CA-C-N 119.569 1.685 . . . . 1.0 115.735 165.185 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 18.2 m-30 -102.07 116.67 33.18 Favored 'General case' 0 N--CA 1.43 -1.468 0 N-CA-C 106.858 -1.534 . . . . 1.0 106.858 178.299 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 70' ' ' HIS . . . . . 0.456 ' HA ' ' HA ' ' A' ' 61' ' ' TRP . 40.8 p-80 -81.68 157.51 24.59 Favored 'General case' 0 N--CA 1.43 -1.468 0 O-C-N 119.802 -1.811 . . . . 1.0 113.891 -179.33 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -116.09 129.76 56.49 Favored 'General case' 0 N--CA 1.43 -1.45 0 N-CA-C 113.375 0.879 . . . . 1.0 113.375 -176.193 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 7.1 m-20 -112.32 179.39 4.0 Favored 'General case' 0 N--CA 1.431 -1.382 0 N-CA-C 107.28 -1.378 . . . . 1.0 107.28 172.483 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 26.3 tp -113.3 106.93 15.2 Favored 'General case' 0 N--CA 1.43 -1.45 0 O-C-N 119.117 -2.239 . . . . 1.0 112.079 -174.957 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 2.8 ttpm? -70.81 -45.18 65.07 Favored 'General case' 0 N--CA 1.431 -1.421 0 O-C-N 119.647 -1.908 . . . . 1.0 113.3 168.024 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -170.51 -103.06 0.16 Allowed Glycine 0 N--CA 1.43 -1.735 0 O-C-N 120.365 -1.459 . . . . 1.0 112.184 177.996 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 40.7 m-20 -89.74 17.94 6.06 Favored 'General case' 0 N--CA 1.431 -1.42 0 O-C-N 120.676 -1.485 . . . . 1.0 111.623 179.698 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 9.2 tt0 -168.13 137.12 2.42 Favored 'General case' 0 N--CA 1.43 -1.467 0 N-CA-C 102.864 -3.013 . . . . 1.0 102.864 -163.676 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 78' ' ' TRP . . . . . . . . . . . . . 33.0 m95 -88.53 145.83 25.51 Favored 'General case' 0 N--CA 1.43 -1.469 0 CA-C-O 122.195 0.998 . . . . 1.0 108.822 -177.131 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 2.1 tt -114.1 130.79 67.7 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.47 0 C-N-CA 129.394 3.078 . . . . 1.0 104.587 -168.818 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 80' ' ' CYS . . . . . 0.402 ' HB2' ' HA ' ' A' ' 85' ' ' GLU . 81.3 m -89.4 146.13 24.87 Favored 'General case' 0 N--CA 1.43 -1.472 0 O-C-N 120.679 -1.263 . . . . 1.0 113.483 -172.674 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 22.0 t70 -45.0 -53.69 7.44 Favored 'General case' 0 N--CA 1.431 -1.383 0 C-N-CA 128.27 2.628 . . . . 1.0 115.871 174.263 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 16.1 ptm180 -149.65 177.43 9.77 Favored 'General case' 0 N--CA 1.43 -1.431 0 O-C-N 120.677 -1.265 . . . . 1.0 110.19 -174.007 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 3.4 t 78.58 -73.47 0.07 Allowed 'General case' 0 N--CA 1.43 -1.439 0 C-N-CA 126.802 2.041 . . . . 1.0 113.026 -175.701 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -170.89 104.1 0.2 Allowed Glycine 0 N--CA 1.43 -1.719 0 N-CA-C 108.845 -1.702 . . . . 1.0 108.845 -176.131 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 85' ' ' GLU . . . . . 0.417 ' HG3' ' H ' ' A' ' 85' ' ' GLU . 0.0 OUTLIER -63.41 105.26 0.73 Allowed 'General case' 0 N--CA 1.429 -1.513 0 N-CA-C 119.86 3.281 . . . . 1.0 119.86 -166.807 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -173.81 127.01 0.39 Allowed 'General case' 0 N--CA 1.43 -1.472 0 C-N-CA 124.718 1.207 . . . . 1.0 112.604 166.522 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 1.2 t80 -45.53 -89.5 0.0 OUTLIER 'General case' 0 N--CA 1.43 -1.44 0 N-CA-C 119.059 2.985 . . . . 1.0 119.059 178.187 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 88' ' ' TRP . . . . . . . . . . . . . 85.7 m95 -72.38 -26.07 61.75 Favored 'General case' 0 N--CA 1.43 -1.436 0 O-C-N 120.07 -1.644 . . . . 1.0 111.546 -166.702 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 6.8 m-20 -69.87 -45.73 67.07 Favored 'General case' 0 N--CA 1.43 -1.451 0 C-N-CA 125.476 1.51 . . . . 1.0 113.283 177.578 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 35.3 tp -69.66 -41.83 75.0 Favored 'General case' 0 N--CA 1.429 -1.521 0 O-C-N 119.557 -1.964 . . . . 1.0 111.523 176.278 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 33.5 tp -56.21 -40.75 74.53 Favored 'General case' 0 N--CA 1.429 -1.52 0 C-N-CA 124.846 1.258 . . . . 1.0 114.26 169.384 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 42.2 tt0 -55.24 -49.87 70.92 Favored 'General case' 0 N--CA 1.43 -1.461 0 C-N-CA 126.711 2.004 . . . . 1.0 112.021 172.379 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 2.1 mp0 -59.96 -46.88 87.98 Favored 'General case' 0 N--CA 1.43 -1.431 0 O-C-N 120.205 -1.559 . . . . 1.0 114.649 173.773 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 94' ' ' ALA . . . . . 0.436 ' HB2' HE22 ' A' ' 66' ' ' GLN . . . -62.87 -42.18 99.67 Favored 'General case' 0 N--CA 1.43 -1.456 0 N-CA-C 115.068 1.507 . . . . 1.0 115.068 177.833 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -80.2 -37.37 33.32 Favored 'General case' 0 N--CA 1.429 -1.497 0 O-C-N 120.268 -1.52 . . . . 1.0 114.043 -179.472 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 96' ' ' THR . . . . . 0.448 HG23 HG12 ' A' ' 103' ' ' VAL . 23.2 p -58.52 -38.51 77.87 Favored 'General case' 0 N--CA 1.43 -1.452 0 CA-C-N 120.663 1.574 . . . . 1.0 112.335 170.574 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 34.1 tp60 -59.44 -61.58 2.52 Favored 'General case' 0 N--CA 1.429 -1.484 0 C-N-CA 124.837 1.255 . . . . 1.0 113.354 172.425 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 4.4 mm-40 -64.25 -43.4 95.01 Favored 'General case' 0 N--CA 1.429 -1.496 0 N-CA-C 116.145 1.906 . . . . 1.0 116.145 -179.038 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -77.45 -31.82 54.08 Favored 'General case' 0 CA--C 1.489 -1.386 0 O-C-N 120.644 -1.285 . . . . 1.0 113.427 -178.017 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . 98.26 16.63 31.81 Favored Glycine 0 N--CA 1.428 -1.857 0 C-N-CA 124.568 1.08 . . . . 1.0 115.537 169.735 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 16.4 pt-20 -168.05 174.86 7.01 Favored 'General case' 0 N--CA 1.428 -1.562 0 N-CA-C 108.204 -1.036 . . . . 1.0 108.204 -172.403 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 25.8 m -66.35 121.73 15.91 Favored 'General case' 0 N--CA 1.431 -1.385 0 O-C-N 120.645 -1.285 . . . . 1.0 112.569 -177.268 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 103' ' ' VAL . . . . . 0.448 HG12 HG23 ' A' ' 96' ' ' THR . 4.7 p -97.83 137.14 26.25 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.508 0 N-CA-C 106.046 -1.835 . . . . 1.0 106.046 179.391 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 2.8 t -117.07 78.88 1.26 Allowed 'General case' 0 N--CA 1.431 -1.396 0 O-C-N 121.181 -0.949 . . . . 1.0 112.161 -162.638 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 61.9 m-85 -103.03 -35.55 8.5 Favored 'General case' 0 N--CA 1.429 -1.486 0 O-C-N 120.06 -1.65 . . . . 1.0 110.306 174.458 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 22.6 mtm180 . . . . . 0 C--O 1.259 1.598 0 C-N-CA 123.411 0.685 . . . . 1.0 110.043 -172.597 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 54.7 mtt . . . . . 0 CA--C 1.489 -1.373 0 CA-C-O 121.681 0.753 . . . . 1.0 111.866 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 22.6 m120 -128.88 160.73 31.7 Favored 'General case' 0 N--CA 1.43 -1.471 0 O-C-N 120.206 -1.559 . . . . 1.0 112.647 -170.407 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 8.3 p-10 -73.48 -29.2 62.37 Favored 'General case' 0 N--CA 1.43 -1.474 0 C-N-CA 125.19 1.396 . . . . 1.0 112.433 175.786 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 48.3 p -58.66 -52.17 66.84 Favored 'General case' 0 N--CA 1.43 -1.459 0 C-N-CA 125.762 1.625 . . . . 1.0 113.151 168.752 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 95.6 mt-10 -54.31 -54.07 45.34 Favored 'General case' 0 N--CA 1.428 -1.555 0 C-N-CA 126.822 2.049 . . . . 1.0 112.573 172.037 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 43.0 t80 -48.69 -46.94 41.14 Favored 'General case' 0 N--CA 1.429 -1.49 0 N-CA-C 115.343 1.609 . . . . 1.0 115.343 172.728 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -60.98 -51.54 68.83 Favored 'General case' 0 N--CA 1.43 -1.428 0 N-CA-C 113.838 1.051 . . . . 1.0 113.838 175.884 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 94.7 mtt180 -61.45 -40.61 95.12 Favored 'General case' 0 N--CA 1.429 -1.493 0 O-C-N 120.542 -1.349 . . . . 1.0 113.92 -179.724 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 72.5 mt -64.33 -45.35 88.23 Favored 'General case' 0 N--CA 1.43 -1.469 0 C-N-CA 125.402 1.481 . . . . 1.0 112.795 173.107 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -60.3 -51.04 71.23 Favored 'General case' 0 N--CA 1.43 -1.459 0 C-N-CA 125.898 1.679 . . . . 1.0 113.641 -179.407 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 -56.64 -49.21 75.68 Favored 'General case' 0 N--CA 1.429 -1.487 0 C-N-CA 124.267 1.027 . . . . 1.0 112.207 172.818 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . 0.315 5.9 pt20 -63.82 -44.73 92.38 Favored 'General case' 0 N--CA 1.431 -1.408 0 O-C-N 120.091 -1.631 . . . . 1.0 115.108 178.705 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 4.2 pp -65.34 -36.7 84.84 Favored 'General case' 0 N--CA 1.43 -1.469 0 CA-C-N 121.375 1.898 . . . . 1.0 115.019 -179.011 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 29.6 m0 -54.9 -60.41 3.4 Favored 'General case' 0 N--CA 1.43 -1.461 0 N-CA-C 113.507 0.929 . . . . 1.0 113.507 166.683 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 35.2 mt -63.67 -33.75 76.32 Favored 'General case' 0 N--CA 1.431 -1.413 0 CA-C-N 120.561 1.528 . . . . 1.0 114.593 -178.416 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 86.0 m -54.86 -59.98 3.99 Favored 'General case' 0 N--CA 1.431 -1.416 0 C-N-CA 125.475 1.51 . . . . 1.0 111.98 173.771 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 38.9 mm -62.12 -39.12 82.71 Favored 'Isoleucine or valine' 0 CA--C 1.489 -1.374 0 N-CA-C 114.596 1.332 . . . . 1.0 114.596 176.844 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 95.4 mt-10 -51.55 -52.33 48.05 Favored 'General case' 0 N--CA 1.43 -1.434 0 CA-C-N 121.434 1.925 . . . . 1.0 113.281 171.529 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 2.4 tp10 -65.4 -36.58 84.38 Favored 'General case' 0 N--CA 1.429 -1.489 0 N-CA-C 114.246 1.202 . . . . 1.0 114.246 -179.819 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 49.8 ttt-85 -54.0 -51.03 65.24 Favored 'General case' 0 N--CA 1.43 -1.465 0 O-C-N 120.793 -1.192 . . . . 1.0 113.053 170.521 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -70.07 -45.05 67.85 Favored 'General case' 0 N--CA 1.43 -1.436 0 N-CA-C 113.085 0.772 . . . . 1.0 113.085 178.302 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 34.8 t0 -55.18 -44.56 75.36 Favored 'General case' 0 N--CA 1.43 -1.449 0 C-N-CA 125.122 1.369 . . . . 1.0 114.075 178.987 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 32.1 t70 -71.04 -28.73 64.6 Favored 'General case' 0 N--CA 1.431 -1.409 0 O-C-N 120.052 -1.655 . . . . 1.0 113.472 177.678 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 24' ' ' TRP . . . . . . . . . . . . . 37.3 t-105 -71.28 149.33 46.26 Favored 'General case' 0 N--CA 1.43 -1.462 0 O-C-N 120.063 -1.648 . . . . 1.0 112.897 -177.831 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 6.8 m-20 -151.66 163.02 40.02 Favored 'General case' 0 N--CA 1.429 -1.488 0 N-CA-C 104.002 -2.592 . . . . 1.0 104.002 163.543 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -161.27 -132.6 1.36 Allowed Glycine 0 N--CA 1.43 -1.72 0 O-C-N 120.622 -1.299 . . . . 1.0 111.417 176.565 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -68.3 -32.6 72.86 Favored 'General case' 0 N--CA 1.43 -1.437 0 O-C-N 121.466 -1.02 . . . . 1.0 110.347 171.743 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 79.9 p -112.86 172.48 6.91 Favored 'General case' 0 N--CA 1.43 -1.452 0 C-N-CA 124.347 1.059 . . . . 1.0 111.212 177.046 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 2.9 t70 -96.12 -168.94 1.83 Allowed 'General case' 0 N--CA 1.43 -1.462 0 C-N-CA 124.811 1.244 . . . . 1.0 110.28 179.091 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 7.1 tp -163.37 119.73 0.15 Allowed 'Isoleucine or valine' 0 N--CA 1.43 -1.456 0 O-C-N 120.502 -1.374 . . . . 1.0 110.652 -169.19 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 37.7 t0 -135.84 108.25 7.35 Favored 'General case' 0 N--CA 1.43 -1.432 0 O-C-N 119.86 -1.775 . . . . 1.0 110.533 169.407 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 33.7 t -81.33 143.97 31.83 Favored 'General case' 0 N--CA 1.43 -1.438 0 O-C-N 119.033 -2.292 . . . . 1.0 112.049 173.012 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 33.4 mt-10 -90.16 139.22 30.84 Favored 'General case' 0 N--CA 1.43 -1.445 0 O-C-N 120.403 -1.436 . . . . 1.0 109.13 168.765 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 3.9 mp -126.28 105.68 14.75 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.425 0 N-CA-C 104.853 -2.277 . . . . 1.0 104.853 173.927 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 48.6 t30 -132.75 76.64 1.7 Allowed 'General case' 0 N--CA 1.429 -1.48 0 C-N-CA 124.882 1.273 . . . . 1.0 110.849 -167.171 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . 78.75 -73.15 2.31 Favored Glycine 0 N--CA 1.43 -1.754 0 O-C-N 120.963 -1.086 . . . . 1.0 115.453 167.343 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -142.93 27.53 2.17 Favored Glycine 0 N--CA 1.431 -1.684 0 C-N-CA 124.906 1.241 . . . . 1.0 110.432 172.116 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 76.4 t -125.44 136.22 61.54 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.419 0 C-N-CA 125.313 1.445 . . . . 1.0 107.198 177.216 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 72.7 mt -109.62 136.66 48.63 Favored 'General case' 0 N--CA 1.43 -1.431 0 N-CA-C 107.084 -1.45 . . . . 1.0 107.084 155.684 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -138.55 111.04 7.51 Favored 'General case' 0 N--CA 1.431 -1.393 0 N-CA-C 106.035 -1.839 . . . . 1.0 106.035 178.368 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 67.9 mt -89.74 126.35 42.65 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.432 0 O-C-N 120.32 -1.488 . . . . 1.0 109.684 -171.097 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 28.3 p -119.85 126.35 50.76 Favored 'General case' 0 N--CA 1.43 -1.435 0 CA-C-O 121.728 0.775 . . . . 1.0 113.004 179.896 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 43' ' ' PHE . . . . . . . . . . . . . 1.0 OUTLIER -122.96 170.27 10.3 Favored 'General case' 0 N--CA 1.43 -1.444 0 O-C-N 120.27 -1.519 . . . . 1.0 112.302 169.909 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 4.4 mm-40 -48.41 -36.75 15.38 Favored 'General case' 0 N--CA 1.429 -1.488 0 N-CA-C 118.557 2.799 . . . . 1.0 118.557 -171.439 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 47.1 m-80 -68.86 -6.0 24.52 Favored 'General case' 0 N--CA 1.43 -1.474 0 N-CA-C 115.535 1.68 . . . . 1.0 115.535 179.716 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 80.24 30.54 41.27 Favored Glycine 0 N--CA 1.43 -1.757 0 O-C-N 120.579 -1.325 . . . . 1.0 112.791 172.142 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 51.0 m -127.12 149.52 49.91 Favored 'General case' 0 N--CA 1.43 -1.46 0 N-CA-C 105.168 -2.16 . . . . 1.0 105.168 -177.571 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 22.8 pttm -140.53 159.07 43.0 Favored 'General case' 0 N--CA 1.431 -1.404 0 N-CA-C 113.826 1.047 . . . . 1.0 113.826 -165.136 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 12.7 mm -110.61 138.56 38.1 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.471 0 N-CA-C 106.195 -1.78 . . . . 1.0 106.195 177.1 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 5.5 mm -120.77 114.91 45.3 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.414 0 CA-C-N 119.937 1.244 . . . . 1.0 110.787 -173.562 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER -125.68 89.26 1.39 Allowed 'Isoleucine or valine' 0 N--CA 1.43 -1.459 0 C-N-CA 126.187 1.795 . . . . 1.0 110.468 -172.565 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 52' ' ' ASN . . . . . 0.425 ' H ' ' HD1' ' A' ' 61' ' ' TRP . 51.3 m-20 -114.25 161.74 17.46 Favored 'General case' 0 N--CA 1.43 -1.448 0 C-N-CA 128.725 2.81 . . . . 1.0 110.239 178.545 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -154.31 151.54 29.22 Favored 'General case' 0 N--CA 1.43 -1.455 0 O-C-N 119.91 -1.744 . . . . 1.0 112.319 -168.666 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -100.33 144.17 29.65 Favored 'General case' 0 N--CA 1.43 -1.433 0 CA-C-O 123.426 1.584 . . . . 1.0 108.192 174.977 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 54.3 mt-10 -70.75 -63.55 1.56 Allowed Pre-proline 0 N--CA 1.431 -1.418 0 CA-C-O 116.034 -1.936 . . . . 1.0 114.479 172.163 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 87.3 Cg_endo -78.85 157.9 27.58 Favored 'Trans proline' 0 C--N 1.3 -1.984 0 CA-C-N 126.135 3.227 . . . . 1.0 112.622 169.959 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . 0.409 5.1 mp 72.18 134.94 0.04 OUTLIER 'General case' 0 N--CA 1.43 -1.456 0 C-N-CA 127.266 2.226 . . . . 1.0 113.588 -165.616 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 17.5 m170 -83.8 50.77 1.88 Allowed 'General case' 0 N--CA 1.431 -1.411 0 O-C-N 120.668 -1.27 . . . . 1.0 112.853 -172.596 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -152.28 158.95 43.51 Favored 'General case' 0 N--CA 1.43 -1.428 0 O-C-N 120.382 -1.449 . . . . 1.0 109.43 -178.401 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 38.2 t -126.5 161.63 32.28 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.438 0 C-N-CA 125.528 1.531 . . . . 1.0 108.55 -169.182 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 61' ' ' TRP . . . . . 0.425 ' HD1' ' H ' ' A' ' 52' ' ' ASN . 0.0 OUTLIER -93.52 154.78 17.7 Favored 'General case' 0 N--CA 1.431 -1.413 0 O-C-N 118.792 -2.443 . . . . 1.0 111.028 177.3 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -142.5 101.41 3.88 Favored 'General case' 0 N--CA 1.431 -1.409 0 O-C-N 118.362 -2.711 . . . . 1.0 112.687 169.55 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -112.22 149.62 32.03 Favored 'General case' 0 N--CA 1.43 -1.467 0 O-C-N 119.494 -2.003 . . . . 1.0 114.61 174.313 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 64' ' ' THR . . . . . . . . . . . . . 95.1 m -151.89 -87.12 0.07 Allowed 'General case' 0 N--CA 1.43 -1.436 0 C-N-CA 126.186 1.794 . . . . 1.0 109.977 -179.891 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -131.23 -54.77 1.04 Allowed 'General case' 0 N--CA 1.43 -1.445 0 O-C-N 121.139 -0.976 . . . . 1.0 113.184 -170.556 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 58.8 mt-30 -71.08 -24.75 62.38 Favored 'General case' 0 N--CA 1.431 -1.418 0 N-CA-C 114.639 1.348 . . . . 1.0 114.639 -171.003 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 177.09 -40.42 0.1 OUTLIER Glycine 0 N--CA 1.429 -1.811 0 C-N-CA 117.753 -2.165 . . . . 1.0 115.588 174.207 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 98.8 106.62 2.65 Favored Glycine 0 N--CA 1.43 -1.745 0 CA-C-O 122.557 1.087 . . . . 1.0 111.978 -173.96 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 14.8 m-85 -128.5 135.77 49.89 Favored 'General case' 0 N--CA 1.43 -1.459 0 N-CA-C 105.802 -1.925 . . . . 1.0 105.802 -167.939 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 70' ' ' HIS . . . . . 0.458 ' HE1' ' OD2' ' A' ' 81' ' ' ASP . 27.2 p80 -83.42 159.8 21.71 Favored 'General case' 0 N--CA 1.43 -1.467 0 O-C-N 119.826 -1.796 . . . . 1.0 112.881 179.905 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 71' ' ' PHE . . . . . . . . . . . . 0.321 24.5 t80 -117.9 112.46 20.37 Favored 'General case' 0 N--CA 1.43 -1.428 0 C-N-CA 127.653 2.381 . . . . 1.0 105.185 -156.875 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -126.45 165.55 18.88 Favored 'General case' 0 N--CA 1.431 -1.394 0 N-CA-C 107.574 -1.269 . . . . 1.0 107.574 -169.689 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 51.4 tp -112.06 124.81 53.21 Favored 'General case' 0 N--CA 1.43 -1.451 0 O-C-N 119.528 -1.982 . . . . 1.0 110.434 -169.963 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 6.2 tmtt? -74.64 -58.73 3.1 Favored 'General case' 0 N--CA 1.429 -1.478 0 O-C-N 121.322 -0.861 . . . . 1.0 109.599 162.277 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -179.3 -61.65 0.07 OUTLIER Glycine 0 N--CA 1.43 -1.716 0 O-C-N 121.098 -1.001 . . . . 1.0 111.551 179.033 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 24.1 t0 -99.32 -18.21 17.66 Favored 'General case' 0 N--CA 1.43 -1.425 0 C-N-CA 126.108 1.763 . . . . 1.0 110.141 179.075 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 1.1 tp10 -130.09 128.43 41.86 Favored 'General case' 0 N--CA 1.431 -1.415 0 N-CA-C 103.377 -2.823 . . . . 1.0 103.377 -170.711 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 78' ' ' TRP . . . . . . . . . . . . . 91.7 m95 -77.47 129.55 35.87 Favored 'General case' 0 N--CA 1.429 -1.481 0 N-CA-C 105.364 -2.088 . . . . 1.0 105.364 162.498 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 79' ' ' ILE . . . . . 0.455 ' HB ' ' HB2' ' A' ' 85' ' ' GLU . 0.1 OUTLIER -131.34 153.24 38.65 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.377 0 O-C-N 119.976 -1.703 . . . . 1.0 106.865 -173.876 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 5.2 m -80.55 132.37 35.65 Favored 'General case' 0 N--CA 1.429 -1.488 0 O-C-N 119.873 -1.767 . . . . 1.0 112.922 -172.378 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 81' ' ' ASP . . . . . 0.458 ' OD2' ' HE1' ' A' ' 70' ' ' HIS . 24.0 t70 -86.61 62.8 7.63 Favored 'General case' 0 N--CA 1.431 -1.42 0 O-C-N 118.928 -2.357 . . . . 1.0 110.932 177.32 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -155.71 -135.73 0.05 OUTLIER 'General case' 0 N--CA 1.43 -1.441 0 O-C-N 120.608 -1.307 . . . . 1.0 111.858 -176.027 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 35.1 p -86.0 -12.44 50.32 Favored 'General case' 0 N--CA 1.428 -1.551 0 O-C-N 119.347 -2.096 . . . . 1.0 113.887 -170.524 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -161.93 92.32 0.11 Allowed Glycine 0 N--CA 1.429 -1.768 0 O-C-N 120.684 -1.26 . . . . 1.0 113.331 -177.534 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 85' ' ' GLU . . . . . 0.455 ' HB2' ' HB ' ' A' ' 79' ' ' ILE . 8.2 pt-20 -77.55 113.41 15.35 Favored 'General case' 0 N--CA 1.431 -1.398 0 N-CA-C 119.014 2.968 . . . . 1.0 119.014 -169.845 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 86.1 m -174.46 125.25 0.31 Allowed 'General case' 0 N--CA 1.431 -1.422 0 C-N-CA 126.315 1.846 . . . . 1.0 110.574 161.775 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 2.0 t80 -52.77 -84.21 0.01 OUTLIER 'General case' 0 N--CA 1.429 -1.508 0 N-CA-C 115.378 1.621 . . . . 1.0 115.378 170.265 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 88' ' ' TRP . . . . . . . . . . . . . 56.0 m95 -58.95 -29.43 67.15 Favored 'General case' 0 N--CA 1.43 -1.445 0 N-CA-C 116.283 1.957 . . . . 1.0 116.283 -166.1 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 24.0 m-20 -76.99 -41.35 43.25 Favored 'General case' 0 N--CA 1.429 -1.479 0 C-N-CA 124.489 1.116 . . . . 1.0 112.254 175.668 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 41.9 tp -69.65 -43.23 73.03 Favored 'General case' 0 N--CA 1.43 -1.425 0 O-C-N 119.521 -1.987 . . . . 1.0 111.88 176.249 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 2.6 tm? -48.38 -50.69 29.71 Favored 'General case' 0 N--CA 1.43 -1.471 0 C-N-CA 128.941 2.896 . . . . 1.0 113.08 172.608 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 37.5 tt0 -51.66 -54.44 27.96 Favored 'General case' 0 N--CA 1.431 -1.423 0 C-N-CA 125.823 1.649 . . . . 1.0 114.547 166.852 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 4.1 tt0 -58.5 -44.73 89.54 Favored 'General case' 0 N--CA 1.43 -1.471 0 N-CA-C 114.372 1.249 . . . . 1.0 114.372 179.929 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -58.75 -48.49 81.03 Favored 'General case' 0 N--CA 1.431 -1.412 0 C-N-CA 127.53 2.332 . . . . 1.0 113.554 174.895 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -64.89 -46.56 81.24 Favored 'General case' 0 N--CA 1.429 -1.483 0 O-C-N 119.426 -2.046 . . . . 1.0 113.131 176.191 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 96.5 m -53.61 -48.89 68.87 Favored 'General case' 0 N--CA 1.431 -1.409 0 C-N-CA 127.224 2.21 . . . . 1.0 114.176 174.037 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 2.1 pt20 -70.18 -28.02 64.98 Favored 'General case' 0 N--CA 1.43 -1.45 0 O-C-N 121.061 -1.025 . . . . 1.0 113.607 -178.911 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 15.7 mm-40 -75.91 -39.02 57.13 Favored 'General case' 0 N--CA 1.43 -1.459 0 N-CA-C 114.309 1.226 . . . . 1.0 114.309 171.988 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -85.85 -46.58 10.49 Favored 'General case' 0 N--CA 1.43 -1.461 0 O-C-N 120.229 -1.545 . . . . 1.0 114.963 -176.436 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . 91.28 43.25 4.7 Favored Glycine 0 N--CA 1.43 -1.745 0 O-C-N 120.418 -1.426 . . . . 1.0 112.55 -170.825 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 18.6 tt0 -170.04 145.75 2.93 Favored 'General case' 0 N--CA 1.43 -1.455 0 N-CA-C 103.712 -2.699 . . . . 1.0 103.712 -172.865 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 13.4 m -74.49 99.95 3.72 Favored 'General case' 0 N--CA 1.429 -1.484 0 CA-C-N 121.792 2.087 . . . . 1.0 111.033 179.282 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 12.2 t -95.36 84.1 1.55 Allowed 'Isoleucine or valine' 0 N--CA 1.432 -1.362 0 CA-C-O 124.231 1.967 . . . . 1.0 107.953 178.769 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 8.2 t -92.36 177.07 6.25 Favored 'General case' 0 N--CA 1.43 -1.438 0 C-N-CA 125.718 1.607 . . . . 1.0 112.695 -168.259 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 30.8 t80 -138.58 -29.32 0.8 Allowed 'General case' 0 N--CA 1.43 -1.434 0 O-C-N 120.83 -1.169 . . . . 1.0 111.04 156.83 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 89.1 mtt180 . . . . . 0 C--O 1.26 1.634 0 O-C-N 120.368 -1.457 . . . . 1.0 110.437 179.27 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 26.4 mmt . . . . . 0 CA--C 1.49 -1.341 0 N-CA-C 113.682 0.994 . . . . 1.0 113.682 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 91.9 m-20 -118.24 57.95 0.83 Allowed 'General case' 0 N--CA 1.431 -1.416 0 O-C-N 120.766 -1.209 . . . . 1.0 109.995 -178.377 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 22.5 m-20 -65.78 -39.16 90.72 Favored 'General case' 0 N--CA 1.429 -1.477 0 C-N-CA 125.272 1.429 . . . . 1.0 113.581 179.131 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 8.6 t -65.07 -43.29 92.7 Favored 'General case' 0 N--CA 1.43 -1.473 0 O-C-N 120.951 -1.093 . . . . 1.0 111.786 -178.854 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 14.0 mt-10 -58.36 -60.83 3.16 Favored 'General case' 0 N--CA 1.429 -1.483 0 C-N-CA 124.694 1.197 . . . . 1.0 112.364 171.148 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 1.1 t80 -53.26 -38.48 63.06 Favored 'General case' 0 N--CA 1.43 -1.425 0 N-CA-C 115.911 1.819 . . . . 1.0 115.911 179.229 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 2.5 m-70 -61.18 -50.56 72.66 Favored 'General case' 0 N--CA 1.43 -1.439 0 N-CA-C 115.524 1.676 . . . . 1.0 115.524 170.224 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 23.1 ttm180 -67.81 -45.38 74.91 Favored 'General case' 0 N--CA 1.43 -1.47 0 C-N-CA 124.17 0.988 . . . . 1.0 112.207 -176.106 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 83.4 mt -55.26 -45.59 76.12 Favored 'General case' 0 N--CA 1.43 -1.464 0 C-N-CA 126.507 1.923 . . . . 1.0 113.611 172.367 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -56.84 -55.49 33.77 Favored 'General case' 0 N--CA 1.43 -1.467 0 C-N-CA 125.27 1.428 . . . . 1.0 113.152 173.949 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -56.3 -43.53 79.01 Favored 'General case' 0 N--CA 1.431 -1.415 0 C-N-CA 124.228 1.011 . . . . 1.0 112.617 -176.05 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 28.3 mm100 -63.4 -53.86 45.76 Favored 'General case' 0 N--CA 1.43 -1.441 0 N-CA-C 115.165 1.542 . . . . 1.0 115.165 173.846 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 2.4 pp -65.2 -47.18 77.79 Favored 'General case' 0 N--CA 1.43 -1.443 0 O-C-N 120.387 -1.446 . . . . 1.0 114.272 -177.697 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 39.8 m0 -52.87 -50.04 64.61 Favored 'General case' 0 N--CA 1.43 -1.468 0 C-N-CA 126.953 2.101 . . . . 1.0 113.447 174.256 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 44.0 tp -60.79 -49.34 77.87 Favored 'General case' 0 N--CA 1.429 -1.517 0 C-N-CA 123.651 0.78 . . . . 1.0 112.719 177.49 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 36.5 m -59.11 -53.15 61.63 Favored 'General case' 0 N--CA 1.431 -1.398 0 C-N-CA 125.818 1.647 . . . . 1.0 113.276 -178.676 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 78.8 mt -57.64 -54.1 35.87 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.464 0 C-N-CA 125.839 1.656 . . . . 1.0 114.169 174.989 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 31.8 tt0 -60.18 -48.42 81.82 Favored 'General case' 0 N--CA 1.429 -1.496 0 CA-C-N 120.072 1.306 . . . . 1.0 113.117 -177.774 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 42.9 tt0 -57.85 -48.57 79.41 Favored 'General case' 0 N--CA 1.429 -1.511 0 C-N-CA 125.102 1.361 . . . . 1.0 114.164 178.144 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -71.15 -29.64 65.48 Favored 'General case' 0 N--CA 1.43 -1.456 0 N-CA-C 113.056 0.761 . . . . 1.0 113.056 -177.548 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 5.3 tp -67.14 -50.92 59.59 Favored 'General case' 0 N--CA 1.43 -1.446 0 O-C-N 120.919 -1.113 . . . . 1.0 112.597 171.393 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 11.3 t70 -62.31 -36.42 82.1 Favored 'General case' 0 N--CA 1.429 -1.507 0 O-C-N 121.023 -1.048 . . . . 1.0 112.889 -177.425 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 21.2 t0 -90.81 21.89 3.88 Favored 'General case' 0 N--CA 1.43 -1.438 0 O-C-N 120.486 -1.384 . . . . 1.0 113.847 177.515 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 24' ' ' TRP . . . . . . . . . . . . . 47.0 t-105 -84.56 -59.7 2.29 Favored 'General case' 0 N--CA 1.43 -1.452 0 O-C-N 119.025 -2.297 . . . . 1.0 113.691 -179.445 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 7.0 t70 67.03 -132.0 0.14 Allowed 'General case' 0 N--CA 1.43 -1.453 0 C-N-CA 126.784 2.034 . . . . 1.0 112.603 -176.32 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 93.1 -138.38 14.09 Favored Glycine 0 N--CA 1.43 -1.709 0 O-C-N 120.737 -1.227 . . . . 1.0 112.691 176.116 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -82.23 -26.27 33.4 Favored 'General case' 0 N--CA 1.429 -1.489 0 O-C-N 120.592 -1.534 . . . . 1.0 109.79 172.589 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 4.4 p -75.36 144.27 42.4 Favored 'General case' 0 N--CA 1.429 -1.498 0 C-N-CA 126.506 1.923 . . . . 1.0 114.434 174.642 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 29' ' ' ASP . . . . . 0.41 ' H ' ' HG2' ' A' ' 44' ' ' GLU . 13.8 t70 -104.36 138.43 40.8 Favored 'General case' 0 N--CA 1.43 -1.469 0 N-CA-C 104.137 -2.542 . . . . 1.0 104.137 162.925 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -146.15 115.48 1.47 Allowed 'Isoleucine or valine' 0 N--CA 1.429 -1.481 0 CA-C-O 122.84 1.305 . . . . 1.0 108.62 -157.653 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 13.8 m-20 -126.47 143.3 51.24 Favored 'General case' 0 N--CA 1.429 -1.493 0 C-N-CA 124.103 0.961 . . . . 1.0 109.291 168.625 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 17.8 t -109.67 149.9 29.05 Favored 'General case' 0 N--CA 1.43 -1.432 0 O-C-N 119.832 -1.793 . . . . 1.0 108.203 164.627 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 17.2 mt-10 -113.65 142.39 46.06 Favored 'General case' 0 N--CA 1.429 -1.511 0 O-C-N 120.829 -1.169 . . . . 1.0 108.113 176.822 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 3.3 tp -122.47 110.34 26.62 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.484 0 CA-C-O 124.086 1.898 . . . . 1.0 107.259 -178.099 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 48.3 m-80 -108.95 73.75 0.87 Allowed 'General case' 0 N--CA 1.431 -1.396 0 CA-C-N 114.477 -1.238 . . . . 1.0 109.088 176.677 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . 73.35 -7.65 11.3 Favored Glycine 0 N--CA 1.43 -1.761 0 N-CA-C 117.618 1.807 . . . . 1.0 117.618 171.503 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 151.91 -33.7 0.87 Allowed Glycine 0 N--CA 1.43 -1.764 0 N-CA-C 109.127 -1.589 . . . . 1.0 109.127 -168.734 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 64.7 t -79.27 105.94 9.47 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.43 0 O-C-N 120.397 -1.649 . . . . 1.0 109.595 175.5 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 18.5 mt -94.8 129.16 41.87 Favored 'General case' 0 N--CA 1.43 -1.464 0 CA-C-O 123.074 1.416 . . . . 1.0 110.206 175.667 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 18.6 p -126.52 121.89 33.61 Favored 'General case' 0 N--CA 1.43 -1.455 0 N-CA-C 107.358 -1.349 . . . . 1.0 107.358 -179.713 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 74.2 mt -97.2 122.28 48.59 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.479 0 C-N-CA 124.721 1.208 . . . . 1.0 109.32 -169.866 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 21.8 p -123.74 108.38 12.46 Favored 'General case' 0 N--CA 1.431 -1.396 0 N-CA-C 114.863 1.431 . . . . 1.0 114.863 -171.55 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 43' ' ' PHE . . . . . . . . . . . . . 9.0 p90 -114.55 164.86 13.42 Favored 'General case' 0 N--CA 1.429 -1.49 0 O-C-N 119.633 -1.917 . . . . 1.0 113.894 178.75 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 44' ' ' GLU . . . . . 0.41 ' HG2' ' H ' ' A' ' 29' ' ' ASP . 0.5 OUTLIER -61.76 -20.18 63.27 Favored 'General case' 0 N--CA 1.43 -1.442 0 C-N-CA 128.77 2.828 . . . . 1.0 118.371 -166.779 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 22.5 t30 -66.69 -15.08 63.26 Favored 'General case' 0 N--CA 1.429 -1.491 0 C-N-CA 124.674 1.19 . . . . 1.0 113.618 173.583 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 101.48 -5.25 54.72 Favored Glycine 0 N--CA 1.431 -1.686 0 O-C-N 120.508 -1.37 . . . . 1.0 113.066 171.197 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 70.0 m -93.73 159.28 15.28 Favored 'General case' 0 N--CA 1.43 -1.425 0 O-C-N 121.467 -1.02 . . . . 1.0 111.33 178.493 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 24.0 pttm -142.29 140.08 32.08 Favored 'General case' 0 N--CA 1.429 -1.497 0 O-C-N 121.526 -0.734 . . . . 1.0 111.566 -178.784 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -108.45 143.95 17.88 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.453 0 C-N-CA 126.701 2.0 . . . . 1.0 107.572 179.549 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 9.7 mm -126.38 122.43 61.21 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.458 0 C-N-CA 124.227 1.011 . . . . 1.0 110.816 -163.33 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 3.7 mt -124.61 108.18 19.79 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.428 0 CA-C-O 123.328 1.537 . . . . 1.0 112.874 -179.77 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 52' ' ' ASN . . . . . 0.444 ' H ' ' HD1' ' A' ' 61' ' ' TRP . 29.1 m-80 -120.44 160.63 22.73 Favored 'General case' 0 N--CA 1.429 -1.481 0 C-N-CA 128.224 2.61 . . . . 1.0 108.445 173.497 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 10.3 ptt180 -141.68 140.21 33.15 Favored 'General case' 0 N--CA 1.43 -1.453 0 C-N-CA 124.713 1.205 . . . . 1.0 111.737 174.083 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 24.6 mm100 -110.02 114.46 28.01 Favored 'General case' 0 N--CA 1.431 -1.406 0 C-N-CA 126.004 1.722 . . . . 1.0 108.522 174.558 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 54.8 mt-10 -48.09 -47.48 65.37 Favored Pre-proline 0 N--CA 1.431 -1.414 0 N-CA-C 119.479 3.14 . . . . 1.0 119.479 -175.548 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 50.9 Cg_exo -73.01 -11.41 25.4 Favored 'Trans proline' 0 N--CA 1.434 -2.021 0 CA-C-N 126.022 3.186 . . . . 1.0 114.829 -175.468 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 38.5 mt -84.18 -39.67 19.09 Favored 'General case' 0 N--CA 1.43 -1.443 0 CA-C-N 119.269 0.941 . . . . 1.0 111.191 -174.977 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 19.8 m80 71.33 23.73 3.91 Favored 'General case' 0 CA--C 1.488 -1.433 0 C-N-CA 125.448 1.499 . . . . 1.0 113.866 -179.423 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 1.7 pt20 -131.32 156.58 45.24 Favored 'General case' 0 N--CA 1.429 -1.483 0 C-N-CA 127.898 2.479 . . . . 1.0 106.072 172.903 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 48.0 t -116.41 158.19 16.98 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.43 0 O-C-N 121.185 -0.947 . . . . 1.0 108.687 -171.732 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 61' ' ' TRP . . . . . 0.444 ' HD1' ' H ' ' A' ' 52' ' ' ASN . 0.0 OUTLIER -101.67 152.55 20.7 Favored 'General case' 0 N--CA 1.43 -1.436 0 O-C-N 119.831 -1.793 . . . . 1.0 114.194 176.018 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 93.7 mt -125.83 97.99 5.36 Favored 'General case' 0 N--CA 1.428 -1.55 0 C-N-CA 125.957 1.703 . . . . 1.0 109.056 164.71 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 63' ' ' ALA . . . . . 0.406 ' HA ' ' HA2' ' A' ' 68' ' ' GLY . . . -94.49 141.75 28.23 Favored 'General case' 0 N--CA 1.43 -1.44 0 O-C-N 120.285 -1.509 . . . . 1.0 110.478 167.451 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 64' ' ' THR . . . . . . . . . . . . . 74.5 p -142.49 -119.71 0.1 Allowed 'General case' 0 N--CA 1.43 -1.452 0 C-N-CA 124.79 1.236 . . . . 1.0 108.223 -165.43 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 3.5 tmtt? -101.53 -40.83 6.85 Favored 'General case' 0 N--CA 1.431 -1.419 0 O-C-N 120.503 -1.373 . . . . 1.0 109.717 170.134 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 51.2 tt0 -74.22 -25.93 59.95 Favored 'General case' 0 N--CA 1.429 -1.484 0 N-CA-C 116.863 2.171 . . . . 1.0 116.863 -164.101 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 157.7 -34.99 0.54 Allowed Glycine 0 N--CA 1.43 -1.728 0 O-C-N 119.585 -1.947 . . . . 1.0 115.65 175.501 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 68' ' ' GLY . . . . . 0.406 ' HA2' ' HA ' ' A' ' 63' ' ' ALA . . . 117.17 115.05 2.76 Favored Glycine 0 N--CA 1.429 -1.775 0 C-N-CA 125.625 1.583 . . . . 1.0 112.806 -179.19 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -104.34 142.81 33.9 Favored 'General case' 0 N--CA 1.43 -1.445 0 C-N-CA 125.498 1.519 . . . . 1.0 106.963 175.444 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 15.3 p80 -109.25 152.79 24.74 Favored 'General case' 0 N--CA 1.43 -1.438 0 O-C-N 119.082 -2.262 . . . . 1.0 110.545 165.68 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 48.8 p90 -129.77 131.37 46.21 Favored 'General case' 0 N--CA 1.43 -1.472 0 N-CA-C 113.975 1.102 . . . . 1.0 113.975 -166.068 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 32.7 m-20 -110.01 169.7 8.55 Favored 'General case' 0 N--CA 1.429 -1.49 0 C-N-CA 126.356 1.863 . . . . 1.0 109.21 -176.197 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 50.9 tp -115.97 114.22 24.32 Favored 'General case' 0 N--CA 1.43 -1.447 0 O-C-N 119.984 -1.698 . . . . 1.0 110.584 -178.164 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 18.5 mttm -71.05 -60.21 2.36 Favored 'General case' 0 N--CA 1.431 -1.408 0 O-C-N 120.124 -1.61 . . . . 1.0 112.984 164.729 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -171.56 -73.65 0.04 OUTLIER Glycine 0 N--CA 1.429 -1.775 0 O-C-N 120.622 -1.299 . . . . 1.0 113.518 -179.38 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 4.2 t70 -107.34 26.98 9.54 Favored 'General case' 0 N--CA 1.43 -1.45 0 CA-C-O 123.141 1.448 . . . . 1.0 107.831 174.615 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 1.7 pm0 -161.19 116.71 2.14 Favored 'General case' 0 N--CA 1.43 -1.427 0 N-CA-C 105.205 -2.146 . . . . 1.0 105.205 -168.949 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 78' ' ' TRP . . . . . . . . . . . . . 97.0 m95 -80.95 130.51 35.06 Favored 'General case' 0 N--CA 1.429 -1.505 0 N-CA-C 105.011 -2.218 . . . . 1.0 105.011 162.206 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -126.36 135.32 64.14 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.482 0 O-C-N 119.529 -1.982 . . . . 1.0 108.041 -171.325 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 30.1 m -84.38 122.14 28.52 Favored 'General case' 0 N--CA 1.43 -1.46 0 O-C-N 120.05 -1.656 . . . . 1.0 114.553 -171.275 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 13.2 t70 -84.86 55.21 3.36 Favored 'General case' 0 N--CA 1.429 -1.489 0 O-C-N 119.757 -1.84 . . . . 1.0 112.608 -177.228 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 1.1 tmt_? -148.38 81.7 1.47 Allowed 'General case' 0 N--CA 1.43 -1.428 0 O-C-N 120.36 -1.463 . . . . 1.0 107.347 179.884 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 83' ' ' SER . . . . . . . . . . . . 0.268 16.3 m 79.23 -44.69 0.34 Allowed 'General case' 0 N--CA 1.429 -1.488 0 C-N-CA 127.397 2.279 . . . . 1.0 116.754 175.117 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -159.48 103.19 0.22 Allowed Glycine 0 N--CA 1.431 -1.693 0 N-CA-C 109.128 -1.589 . . . . 1.0 109.128 -167.063 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 1.8 pm0 -87.43 105.97 17.65 Favored 'General case' 0 N--CA 1.429 -1.521 0 N-CA-C 119.424 3.12 . . . . 1.0 119.424 -153.421 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 7.3 m -160.74 122.53 3.08 Favored 'General case' 0 N--CA 1.43 -1.434 0 O-C-N 118.8 -2.438 . . . . 1.0 112.34 174.823 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 41.5 t80 -63.35 -80.17 0.03 OUTLIER 'General case' 0 N--CA 1.43 -1.46 0 N-CA-C 117.254 2.316 . . . . 1.0 117.254 -176.614 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 88' ' ' TRP . . . . . . . . . . . . . 72.6 m95 -63.21 -24.46 67.89 Favored 'General case' 0 N--CA 1.43 -1.432 0 O-C-N 120.442 -1.411 . . . . 1.0 113.892 -169.809 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 1.3 t70 -79.37 -42.76 24.86 Favored 'General case' 0 N--CA 1.428 -1.531 0 C-N-CA 125.87 1.668 . . . . 1.0 113.049 178.568 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 38.5 tp -69.49 -40.2 77.19 Favored 'General case' 0 N--CA 1.431 -1.417 0 O-C-N 119.137 -2.227 . . . . 1.0 111.135 175.514 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 21.4 tp -51.37 -41.4 60.62 Favored 'General case' 0 N--CA 1.43 -1.434 0 C-N-CA 126.926 2.09 . . . . 1.0 114.85 168.049 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 2.0 tm-20 -61.33 -46.42 90.32 Favored 'General case' 0 N--CA 1.43 -1.426 0 C-N-CA 125.627 1.571 . . . . 1.0 113.31 171.085 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 15.4 tt0 -60.96 -46.04 92.31 Favored 'General case' 0 N--CA 1.429 -1.477 0 O-C-N 120.785 -1.197 . . . . 1.0 113.09 176.209 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -58.16 -36.99 73.82 Favored 'General case' 0 N--CA 1.43 -1.425 0 C-N-CA 127.001 2.12 . . . . 1.0 114.703 172.101 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 95' ' ' ALA . . . . . 0.585 ' HB1' ' HB ' ' A' ' 103' ' ' VAL . . . -75.31 -41.34 57.14 Favored 'General case' 0 N--CA 1.428 -1.542 0 O-C-N 119.787 -1.821 . . . . 1.0 113.09 178.42 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 29.8 m -58.23 -28.5 64.92 Favored 'General case' 0 N--CA 1.429 -1.509 0 C-N-CA 126.809 2.044 . . . . 1.0 112.954 169.912 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -69.94 -55.93 8.37 Favored 'General case' 0 N--CA 1.431 -1.413 0 C-N-CA 127.706 2.402 . . . . 1.0 111.891 171.672 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 47.5 mt-30 -75.14 -40.47 59.64 Favored 'General case' 0 N--CA 1.43 -1.453 0 N-CA-C 115.829 1.788 . . . . 1.0 115.829 -175.868 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -81.24 -36.02 30.48 Favored 'General case' 0 N--CA 1.431 -1.402 0 O-C-N 120.376 -1.453 . . . . 1.0 112.619 -179.241 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . 79.44 36.0 27.89 Favored Glycine 0 N--CA 1.429 -1.824 0 O-C-N 120.972 -1.08 . . . . 1.0 111.782 -173.551 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 19.4 tt0 -170.79 145.98 2.52 Favored 'General case' 0 N--CA 1.429 -1.496 0 N-CA-C 103.93 -2.619 . . . . 1.0 103.93 -168.911 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 57.4 m -72.25 97.12 1.93 Allowed 'General case' 0 N--CA 1.429 -1.476 0 CA-C-N 120.851 1.66 . . . . 1.0 111.883 178.957 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 103' ' ' VAL . . . . . 0.585 ' HB ' ' HB1' ' A' ' 95' ' ' ALA . 85.6 t -95.91 106.7 18.65 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.434 0 N-CA-C 106.314 -1.735 . . . . 1.0 106.314 171.802 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 35.6 p -132.24 136.89 47.3 Favored 'General case' 0 N--CA 1.429 -1.497 0 C-N-CA 124.171 0.988 . . . . 1.0 109.995 -171.862 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 37.2 m-85 -93.68 -10.35 34.75 Favored 'General case' 0 N--CA 1.43 -1.429 0 C-N-CA 124.265 1.026 . . . . 1.0 112.129 178.904 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 9.7 mmm180 . . . . . 0 C--O 1.26 1.63 0 C-N-CA 124.489 1.116 . . . . 1.0 109.332 177.582 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 26.5 mmt . . . . . 0 CA--C 1.49 -1.361 0 CA-C-O 121.369 0.604 . . . . 1.0 110.964 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 7.1 p30 -93.27 -51.21 5.11 Favored 'General case' 0 N--CA 1.43 -1.458 0 O-C-N 120.185 -1.572 . . . . 1.0 113.842 -170.172 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 35.3 t70 -55.92 -40.08 72.59 Favored 'General case' 0 N--CA 1.429 -1.479 0 C-N-CA 127.125 2.17 . . . . 1.0 113.46 -178.543 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 5.2 p -68.49 -37.94 80.55 Favored 'General case' 0 N--CA 1.43 -1.467 0 C-N-CA 126.274 1.83 . . . . 1.0 114.359 174.972 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 5' ' ' GLU . . . . . 0.452 ' HG2' ' HE1' ' A' ' 58' ' ' HIS . 14.2 tp10 -67.74 -53.06 30.44 Favored 'General case' 0 N--CA 1.43 -1.435 0 C-N-CA 125.226 1.41 . . . . 1.0 110.115 177.925 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 16.3 t80 -47.25 -50.94 20.17 Favored 'General case' 0 N--CA 1.431 -1.425 0 C-N-CA 127.425 2.29 . . . . 1.0 114.821 169.657 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 35.2 m-70 -63.97 -41.43 97.56 Favored 'General case' 0 N--CA 1.43 -1.452 0 N-CA-C 114.907 1.447 . . . . 1.0 114.907 177.989 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -70.76 -37.19 73.38 Favored 'General case' 0 N--CA 1.43 -1.435 0 O-C-N 120.366 -1.459 . . . . 1.0 114.074 178.887 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 79.7 mt -59.58 -51.55 69.37 Favored 'General case' 0 N--CA 1.43 -1.444 0 C-N-CA 124.99 1.316 . . . . 1.0 111.747 168.239 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -54.06 -50.34 66.95 Favored 'General case' 0 N--CA 1.431 -1.416 0 C-N-CA 125.011 1.324 . . . . 1.0 113.458 176.991 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -51.58 -49.71 61.57 Favored 'General case' 0 N--CA 1.43 -1.425 0 N-CA-C 114.783 1.401 . . . . 1.0 114.783 173.136 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 12.2 pt20 -68.9 -33.27 73.49 Favored 'General case' 0 N--CA 1.43 -1.433 0 N-CA-C 115.583 1.697 . . . . 1.0 115.583 179.764 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 84.8 mt -66.74 -59.07 3.89 Favored 'General case' 0 N--CA 1.431 -1.419 0 O-C-N 120.087 -1.633 . . . . 1.0 111.02 174.753 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 1.2 m-90 -50.3 -50.11 51.58 Favored 'General case' 0 N--CA 1.429 -1.487 0 C-N-CA 125.65 1.58 . . . . 1.0 113.27 -179.565 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 41.0 tp -61.85 -59.05 5.71 Favored 'General case' 0 N--CA 1.43 -1.447 0 N-CA-C 113.626 0.973 . . . . 1.0 113.626 175.775 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 59.6 m -64.88 -37.42 87.58 Favored 'General case' 0 N--CA 1.431 -1.4 0 N-CA-C 114.252 1.204 . . . . 1.0 114.252 -173.621 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 93.5 mt -64.63 -54.24 32.7 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.458 0 C-N-CA 124.923 1.289 . . . . 1.0 111.686 174.83 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 1.7 tt0 -55.48 -49.66 71.94 Favored 'General case' 0 N--CA 1.43 -1.473 0 C-N-CA 123.984 0.914 . . . . 1.0 113.386 178.565 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 44.4 tt0 -54.65 -49.1 71.38 Favored 'General case' 0 N--CA 1.429 -1.493 0 C-N-CA 125.966 1.706 . . . . 1.0 114.025 174.173 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 7.4 tpm_? -58.95 -45.92 89.29 Favored 'General case' 0 N--CA 1.431 -1.406 0 O-C-N 120.726 -1.234 . . . . 1.0 114.291 179.818 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 3.8 pp -83.51 -26.97 29.71 Favored 'General case' 0 N--CA 1.431 -1.384 0 N-CA-C 115.097 1.517 . . . . 1.0 115.097 -177.387 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 8.7 t70 -62.71 -34.09 76.44 Favored 'General case' 0 CA--C 1.488 -1.405 0 O-C-N 120.336 -1.478 . . . . 1.0 113.342 163.591 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 19.2 t70 -70.59 -55.08 9.65 Favored 'General case' 0 N--CA 1.43 -1.472 0 C-N-CA 126.201 1.8 . . . . 1.0 114.559 178.405 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 24' ' ' TRP . . . . . . . . . . . . . 32.4 t-105 -73.03 138.68 46.11 Favored 'General case' 0 N--CA 1.43 -1.456 0 O-C-N 120.703 -1.248 . . . . 1.0 113.104 -172.643 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 63.3 m-20 -84.16 -141.33 0.07 Allowed 'General case' 0 N--CA 1.431 -1.408 0 O-C-N 120.327 -1.483 . . . . 1.0 112.054 177.519 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 164.3 -164.8 36.9 Favored Glycine 0 N--CA 1.431 -1.664 0 O-C-N 118.592 -2.568 . . . . 1.0 114.181 -175.221 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 37.4 t70 -86.84 -53.43 4.92 Favored 'General case' 0 N--CA 1.43 -1.463 0 C-N-CA 125.238 1.415 . . . . 1.0 107.911 169.242 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 4.5 t -82.7 -176.48 6.3 Favored 'General case' 0 N--CA 1.431 -1.414 0 C-N-CA 125.728 1.611 . . . . 1.0 109.691 178.94 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 32.9 t0 -99.85 178.63 4.76 Favored 'General case' 0 N--CA 1.43 -1.449 0 O-C-N 120.26 -1.525 . . . . 1.0 108.142 175.218 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 9.3 tp -152.26 126.58 1.41 Allowed 'Isoleucine or valine' 0 N--CA 1.43 -1.431 0 N-CA-C 106.936 -1.505 . . . . 1.0 106.936 -173.974 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 28.4 t70 -131.73 119.07 20.82 Favored 'General case' 0 N--CA 1.43 -1.439 0 CA-C-O 122.956 1.36 . . . . 1.0 109.13 163.299 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 17.3 p -86.21 131.17 34.3 Favored 'General case' 0 N--CA 1.43 -1.445 0 O-C-N 120.088 -1.632 . . . . 1.0 111.228 174.349 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 41.0 mm-40 -100.06 137.5 38.42 Favored 'General case' 0 N--CA 1.429 -1.488 0 C-N-CA 124.708 1.203 . . . . 1.0 108.916 174.651 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 3.5 tp -127.42 114.1 34.79 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.407 0 CA-C-O 124.046 1.879 . . . . 1.0 106.245 178.81 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 1.6 t-20 -125.81 179.98 4.93 Favored 'General case' 0 N--CA 1.43 -1.427 0 C-N-CA 124.805 1.242 . . . . 1.0 107.828 176.663 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -71.36 87.36 0.41 Allowed Glycine 0 N--CA 1.431 -1.653 0 O-C-N 120.566 -1.334 . . . . 1.0 115.898 -168.657 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 82.2 23.57 56.67 Favored Glycine 0 N--CA 1.429 -1.792 0 C-N-CA 125.379 1.466 . . . . 1.0 112.526 -171.889 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 61.8 t -138.84 135.05 42.92 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.475 0 CA-C-N 118.307 1.053 . . . . 1.0 109.109 -173.253 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 31.1 mt -118.07 142.01 47.86 Favored 'General case' 0 N--CA 1.43 -1.427 0 CA-C-O 122.919 1.343 . . . . 1.0 108.799 166.273 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -138.49 111.3 7.71 Favored 'General case' 0 N--CA 1.43 -1.426 0 O-C-N 120.422 -1.424 . . . . 1.0 108.436 178.032 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 70.3 mt -96.83 105.41 17.07 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.467 0 N-CA-C 107.362 -1.347 . . . . 1.0 107.362 -165.859 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 14.0 m -118.44 131.2 56.28 Favored 'General case' 0 N--CA 1.43 -1.457 0 CA-C-N 118.896 0.771 . . . . 1.0 112.994 -163.053 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 43' ' ' PHE . . . . . . . . . . . . . 1.4 m-85 -99.56 173.68 6.61 Favored 'General case' 0 N--CA 1.43 -1.431 0 O-C-N 120.608 -1.308 . . . . 1.0 111.193 -179.381 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -71.77 -19.03 62.08 Favored 'General case' 0 N--CA 1.429 -1.481 0 O-C-N 119.219 -2.175 . . . . 1.0 113.476 -179.466 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 29.0 t-20 -67.21 -17.97 65.05 Favored 'General case' 0 N--CA 1.429 -1.502 0 C-N-CA 126.811 2.044 . . . . 1.0 113.512 170.731 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 92.34 -14.9 63.5 Favored Glycine 0 N--CA 1.43 -1.74 0 O-C-N 119.962 -1.712 . . . . 1.0 113.683 179.666 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 13.8 m -77.8 167.86 20.86 Favored 'General case' 0 N--CA 1.431 -1.425 0 O-C-N 121.082 -1.246 . . . . 1.0 111.077 172.943 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 12.9 ptpt -169.93 157.68 6.82 Favored 'General case' 0 N--CA 1.43 -1.439 0 O-C-N 121.156 -0.965 . . . . 1.0 113.07 -162.668 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 5.3 mm -101.54 137.11 30.39 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.438 0 C-N-CA 125.791 1.636 . . . . 1.0 107.389 171.823 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 16.1 mm -111.17 116.85 53.61 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.437 0 C-N-CA 125.032 1.333 . . . . 1.0 109.382 -178.013 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 3.0 mt -125.43 124.76 67.68 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.506 0 O-C-N 120.717 -1.239 . . . . 1.0 110.695 179.297 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 52' ' ' ASN . . . . . 0.481 ' H ' ' HD1' ' A' ' 61' ' ' TRP . 26.6 t30 -162.52 172.93 14.7 Favored 'General case' 0 N--CA 1.43 -1.471 0 N-CA-C 103.142 -2.91 . . . . 1.0 103.142 -172.815 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 1.9 ptm180 -139.76 150.57 44.93 Favored 'General case' 0 N--CA 1.429 -1.524 0 CA-C-O 122.546 1.165 . . . . 1.0 112.337 -158.913 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 15.8 mm-40 -107.16 -108.42 0.31 Allowed 'General case' 0 N--CA 1.43 -1.448 0 C-N-CA 124.653 1.181 . . . . 1.0 109.562 -167.173 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 33.2 mm-40 -79.23 135.75 57.6 Favored Pre-proline 0 N--CA 1.43 -1.446 0 CA-C-O 117.718 -1.134 . . . . 1.0 112.799 -172.041 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 98.5 Cg_endo -73.45 62.69 4.46 Favored 'Trans proline' 0 N--CA 1.434 -1.999 0 C-N-CA 123.277 2.651 . . . . 1.0 112.319 162.997 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 73.1 mt -120.32 -103.0 0.41 Allowed 'General case' 0 N--CA 1.429 -1.493 0 N-CA-C 102.841 -3.022 . . . . 1.0 102.841 164.483 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 58' ' ' HIS . . . . . 0.452 ' HE1' ' HG2' ' A' ' 5' ' ' GLU . 1.8 m-70 -132.47 92.02 3.01 Favored 'General case' 0 N--CA 1.429 -1.489 0 N-CA-C 106.622 -1.622 . . . . 1.0 106.622 159.412 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 22.1 tt0 -158.68 122.05 3.84 Favored 'General case' 0 N--CA 1.429 -1.516 0 CA-C-N 121.687 2.04 . . . . 1.0 114.161 173.005 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 86.4 t -133.36 157.57 42.63 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.451 0 C-N-CA 127.031 2.132 . . . . 1.0 109.437 -179.013 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 61' ' ' TRP . . . . . 0.481 ' HD1' ' H ' ' A' ' 52' ' ' ASN . 0.0 OUTLIER -111.36 156.06 22.16 Favored 'General case' 0 N--CA 1.429 -1.505 0 C-N-CA 127.867 2.467 . . . . 1.0 109.755 -174.169 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . 0.277 2.3 pt? -150.91 134.01 16.03 Favored 'General case' 0 N--CA 1.432 -1.364 0 CA-C-N 120.686 1.584 . . . . 1.0 113.916 150.939 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -120.08 147.29 45.03 Favored 'General case' 0 N--CA 1.429 -1.514 0 C-N-CA 125.367 1.467 . . . . 1.0 114.429 -179.557 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 64' ' ' THR . . . . . . . . . . . . . 12.5 t -153.96 -149.52 0.29 Allowed 'General case' 0 N--CA 1.429 -1.509 0 C-N-CA 126.745 2.018 . . . . 1.0 112.388 -172.694 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 5.6 tmtm? -63.56 -53.57 49.64 Favored 'General case' 0 N--CA 1.43 -1.456 0 C-N-CA 130.116 3.366 . . . . 1.0 114.362 -174.404 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 31.3 tt0 -82.24 2.19 33.02 Favored 'General case' 0 N--CA 1.429 -1.492 0 CA-C-O 122.581 1.181 . . . . 1.0 111.602 -177.008 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 117.5 -72.92 0.29 Allowed Glycine 0 N--CA 1.43 -1.732 0 N-CA-C 107.343 -2.303 . . . . 1.0 107.343 -177.4 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 106.06 -173.43 19.85 Favored Glycine 0 N--CA 1.43 -1.733 0 C-N-CA 124.229 0.918 . . . . 1.0 112.486 -176.382 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -162.05 169.83 20.29 Favored 'General case' 0 N--CA 1.431 -1.423 0 N-CA-C 107.284 -1.376 . . . . 1.0 107.284 -173.008 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 19.8 p80 -79.87 159.9 26.25 Favored 'General case' 0 N--CA 1.431 -1.422 0 O-C-N 119.775 -1.828 . . . . 1.0 114.653 174.504 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 71' ' ' PHE . . . . . . . . . . . . 0.3 72.3 t80 -112.21 113.77 26.2 Favored 'General case' 0 N--CA 1.431 -1.402 0 C-N-CA 127.744 2.418 . . . . 1.0 107.019 -158.565 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 5.7 m-20 -134.12 155.1 50.66 Favored 'General case' 0 N--CA 1.43 -1.459 0 CA-C-O 121.851 0.834 . . . . 1.0 110.546 -173.99 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 8.0 tt -97.37 133.53 41.84 Favored 'General case' 0 N--CA 1.431 -1.42 0 O-C-N 119.68 -1.888 . . . . 1.0 111.869 -166.677 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 53.5 tttm -101.81 -56.39 2.29 Favored 'General case' 0 N--CA 1.43 -1.471 0 O-C-N 120.823 -1.173 . . . . 1.0 109.556 174.539 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -157.03 -96.91 0.12 Allowed Glycine 0 N--CA 1.431 -1.677 0 O-C-N 121.035 -1.041 . . . . 1.0 111.346 175.863 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 27.9 m-20 -89.72 16.31 8.17 Favored 'General case' 0 N--CA 1.429 -1.479 0 O-C-N 121.047 -1.266 . . . . 1.0 111.405 179.94 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 32.9 tt0 -166.02 132.83 2.66 Favored 'General case' 0 N--CA 1.43 -1.427 0 N-CA-C 102.046 -3.316 . . . . 1.0 102.046 -161.484 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 78' ' ' TRP . . . . . . . . . . . . . 50.2 m95 -87.75 144.88 26.39 Favored 'General case' 0 N--CA 1.432 -1.37 0 N-CA-C 106.322 -1.732 . . . . 1.0 106.322 175.186 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 9.4 pt -102.35 167.54 2.33 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.485 0 N-CA-C 106.618 -1.623 . . . . 1.0 106.618 174.083 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 1.4 m -89.79 135.65 33.5 Favored 'General case' 0 N--CA 1.429 -1.484 0 O-C-N 120.195 -1.565 . . . . 1.0 107.193 155.29 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 36.8 t70 -59.94 -38.87 83.66 Favored 'General case' 0 N--CA 1.43 -1.447 0 CA-C-N 120.689 1.586 . . . . 1.0 115.069 -174.238 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -9.85 -84.34 0.0 OUTLIER 'General case' 0 N--CA 1.43 -1.467 0 C-N-CA 131.628 3.971 . . . . 1.0 118.457 176.634 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 58.8 m -111.19 -12.79 14.09 Favored 'General case' 0 CA--C 1.489 -1.371 0 O-C-N 120.485 -1.384 . . . . 1.0 109.588 158.126 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 115.85 76.41 0.63 Allowed Glycine 0 N--CA 1.43 -1.763 0 N-CA-C 108.041 -2.023 . . . . 1.0 108.041 -173.509 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 5.2 mm-40 -100.74 -136.4 0.31 Allowed 'General case' 0 N--CA 1.431 -1.419 0 N-CA-C 109.141 -0.688 . . . . 1.0 109.141 -175.583 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 95.5 m -154.2 133.95 12.94 Favored 'General case' 0 N--CA 1.43 -1.445 0 O-C-N 120.156 -1.59 . . . . 1.0 110.402 -171.317 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 1.1 t80 -38.02 -92.13 0.0 OUTLIER 'General case' 0 CA--C 1.489 -1.375 0 C-N-CA 128.432 2.693 . . . . 1.0 115.842 168.895 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 88' ' ' TRP . . . . . . . . . . . . . 50.7 m95 -63.16 -32.69 74.14 Favored 'General case' 0 N--CA 1.431 -1.419 0 C-N-CA 125.649 1.58 . . . . 1.0 113.454 -167.195 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 35.7 t70 -77.96 -42.94 31.24 Favored 'General case' 0 N--CA 1.43 -1.456 0 C-N-CA 125.088 1.355 . . . . 1.0 113.027 -175.898 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 35.0 tp -75.3 -38.9 60.08 Favored 'General case' 0 N--CA 1.43 -1.46 0 O-C-N 119.427 -2.045 . . . . 1.0 111.332 179.335 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 41.9 tp -54.78 -38.64 67.51 Favored 'General case' 0 N--CA 1.43 -1.427 0 C-N-CA 126.33 1.852 . . . . 1.0 113.626 168.106 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 3.4 tm-20 -56.85 -59.9 4.35 Favored 'General case' 0 N--CA 1.429 -1.506 0 C-N-CA 124.611 1.164 . . . . 1.0 112.043 165.875 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 35.9 mt-30 -51.92 -41.81 62.29 Favored 'General case' 0 N--CA 1.43 -1.425 0 N-CA-C 116.28 1.956 . . . . 1.0 116.28 177.394 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -59.19 -58.39 8.84 Favored 'General case' 0 N--CA 1.43 -1.473 0 C-N-CA 126.523 1.929 . . . . 1.0 113.906 172.424 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -62.77 -49.11 76.3 Favored 'General case' 0 N--CA 1.429 -1.507 0 O-C-N 120.41 -1.431 . . . . 1.0 113.446 179.783 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 66.1 m -48.18 -47.55 35.11 Favored 'General case' 0 N--CA 1.43 -1.437 0 C-N-CA 127.859 2.464 . . . . 1.0 114.913 170.501 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 6.6 pt20 -73.4 -30.93 63.59 Favored 'General case' 0 N--CA 1.43 -1.441 0 O-C-N 120.306 -1.496 . . . . 1.0 114.428 -179.222 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 49.7 mt-30 -81.03 -37.93 28.3 Favored 'General case' 0 N--CA 1.431 -1.379 0 O-C-N 120.323 -1.486 . . . . 1.0 113.868 174.715 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -79.42 -42.76 24.73 Favored 'General case' 0 N--CA 1.43 -1.456 0 O-C-N 120.32 -1.488 . . . . 1.0 114.98 -179.686 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . 106.98 17.75 11.35 Favored Glycine 0 N--CA 1.431 -1.695 0 O-C-N 120.683 -1.261 . . . . 1.0 115.762 175.408 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 4.9 tt0 -162.41 152.78 16.81 Favored 'General case' 0 N--CA 1.43 -1.455 0 N-CA-C 104.946 -2.242 . . . . 1.0 104.946 179.527 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 35.1 m -53.48 108.31 0.33 Allowed 'General case' 0 N--CA 1.43 -1.463 0 C-N-CA 125.238 1.415 . . . . 1.0 114.571 175.317 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 49.0 t -89.43 110.49 21.69 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.414 0 CA-C-O 123.258 1.504 . . . . 1.0 108.244 176.892 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 61.5 m -94.19 98.98 11.33 Favored 'General case' 0 N--CA 1.43 -1.46 0 N-CA-C 113.615 0.968 . . . . 1.0 113.615 -162.525 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 88.5 m-85 -89.17 -32.91 17.24 Favored 'General case' 0 N--CA 1.429 -1.485 0 O-C-N 120.961 -1.087 . . . . 1.0 112.884 176.738 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 30.7 mmt180 . . . . . 0 C--O 1.26 1.647 0 N-CA-C 107.3 -1.37 . . . . 1.0 107.3 172.78 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 14.1 ttt . . . . . 0 CA--C 1.489 -1.373 0 CA-C-O 121.891 0.853 . . . . 0.0 110.883 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 62.2 t30 -162.75 163.63 26.67 Favored 'General case' 0 N--CA 1.43 -1.438 0 O-C-N 120.177 -1.577 . . . . 0.0 109.979 -164.028 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 31.1 t70 -64.61 -54.92 24.39 Favored 'General case' 0 N--CA 1.429 -1.48 0 C-N-CA 126.701 2.0 . . . . 0.0 113.678 -175.513 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 9.5 t -65.71 -35.25 80.21 Favored 'General case' 0 N--CA 1.429 -1.479 0 O-C-N 120.066 -1.646 . . . . 0.0 112.696 178.392 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 6.6 tp10 -60.51 -54.93 39.61 Favored 'General case' 0 N--CA 1.431 -1.424 0 C-N-CA 125.433 1.493 . . . . 0.0 112.446 175.616 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 23.2 t80 -46.12 -50.46 15.4 Favored 'General case' 0 N--CA 1.428 -1.54 0 C-N-CA 126.504 1.922 . . . . 0.0 115.2 168.89 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 8.4 t-80 -67.56 -46.01 73.96 Favored 'General case' 0 N--CA 1.429 -1.5 0 O-C-N 121.189 -0.944 . . . . 0.0 113.125 179.775 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 51.1 ttt180 -63.04 -45.82 90.43 Favored 'General case' 0 N--CA 1.431 -1.384 0 O-C-N 120.872 -1.142 . . . . 0.0 113.268 -178.224 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 76.8 mt -58.66 -48.08 82.29 Favored 'General case' 0 N--CA 1.429 -1.476 0 C-N-CA 124.818 1.247 . . . . 0.0 112.774 172.959 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -58.94 -48.75 80.38 Favored 'General case' 0 N--CA 1.432 -1.368 0 C-N-CA 124.549 1.14 . . . . 0.0 113.712 178.402 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -62.7 -36.45 82.97 Favored 'General case' 0 N--CA 1.431 -1.4 0 C-N-CA 124.776 1.23 . . . . 0.0 114.148 175.967 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 27.1 mm-40 -64.72 -47.93 76.49 Favored 'General case' 0 N--CA 1.43 -1.45 0 O-C-N 120.491 -1.381 . . . . 0.0 114.435 174.218 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 2.9 pp -69.1 -40.34 78.44 Favored 'General case' 0 N--CA 1.43 -1.458 0 O-C-N 120.12 -1.613 . . . . 0.0 113.884 175.969 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 0.3 OUTLIER -40.76 -58.87 1.54 Allowed 'General case' 0 N--CA 1.43 -1.442 0 C-N-CA 127.445 2.298 . . . . 0.0 113.8 164.584 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 41.4 tp -63.89 -43.05 97.16 Favored 'General case' 0 N--CA 1.43 -1.468 0 C-N-CA 126.137 1.775 . . . . 0.0 113.515 -178.462 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 58.5 m -61.03 -49.7 76.32 Favored 'General case' 0 N--CA 1.431 -1.408 0 C-N-CA 125.043 1.337 . . . . 0.0 113.269 175.192 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 93.8 mt -55.99 -54.02 31.79 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.447 0 C-N-CA 126.037 1.735 . . . . 0.0 112.943 173.899 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 2.3 tm-20 -56.5 -55.11 37.82 Favored 'General case' 0 N--CA 1.429 -1.485 0 C-N-CA 124.912 1.285 . . . . 0.0 113.213 -178.042 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 34.3 mt-10 -68.13 -35.2 77.72 Favored 'General case' 0 N--CA 1.43 -1.441 0 N-CA-C 116.099 1.889 . . . . 0.0 116.099 -179.382 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 22.7 tpp180 -65.11 -40.06 93.99 Favored 'General case' 0 N--CA 1.43 -1.45 0 O-C-N 119.839 -1.788 . . . . 0.0 112.503 175.743 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 69.1 mt -74.65 -43.1 57.03 Favored 'General case' 0 N--CA 1.431 -1.397 0 N-CA-C 114.354 1.242 . . . . 0.0 114.354 176.91 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 12.5 t70 -54.42 -31.98 56.37 Favored 'General case' 0 N--CA 1.431 -1.415 0 C-N-CA 125.414 1.485 . . . . 0.0 113.697 171.792 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 32.9 t70 -78.51 -15.08 59.0 Favored 'General case' 0 N--CA 1.431 -1.401 0 O-C-N 119.642 -1.911 . . . . 0.0 116.085 174.33 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 24' ' ' TRP . . . . . . . . . . . . . 14.5 t-105 -90.77 121.42 32.63 Favored 'General case' 0 N--CA 1.43 -1.446 0 O-C-N 118.962 -2.336 . . . . 0.0 112.872 -170.347 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 6.5 t70 -120.76 171.77 8.36 Favored 'General case' 0 N--CA 1.43 -1.454 0 O-C-N 119.987 -1.696 . . . . 0.0 110.744 -175.099 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 171.89 -135.42 3.4 Favored Glycine 0 N--CA 1.43 -1.751 0 O-C-N 119.987 -1.695 . . . . 0.0 114.123 -174.971 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 31.5 t0 -84.39 -39.25 19.27 Favored 'General case' 0 N--CA 1.431 -1.39 0 C-N-CA 125.576 1.55 . . . . 0.0 108.667 177.741 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 68.3 m -101.88 143.39 31.83 Favored 'General case' 0 N--CA 1.431 -1.405 0 C-N-CA 124.714 1.206 . . . . 0.0 111.568 -178.363 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 31.2 t0 -86.03 160.12 19.4 Favored 'General case' 0 N--CA 1.43 -1.445 0 O-C-N 121.295 -0.878 . . . . 0.0 109.428 174.554 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -157.35 114.92 0.22 Allowed 'Isoleucine or valine' 0 N--CA 1.43 -1.46 0 CA-C-O 123.067 1.413 . . . . 0.0 107.932 -168.048 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 11.4 m-20 -123.17 131.41 53.67 Favored 'General case' 0 N--CA 1.429 -1.501 0 N-CA-C 107.042 -1.466 . . . . 0.0 107.042 171.334 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 71.3 m -92.64 148.48 22.03 Favored 'General case' 0 N--CA 1.429 -1.503 0 O-C-N 119.471 -2.018 . . . . 0.0 110.431 171.053 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 50.6 mt-10 -102.5 138.12 39.83 Favored 'General case' 0 N--CA 1.43 -1.455 0 C-N-CA 125.54 1.536 . . . . 0.0 109.329 -176.753 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 3.7 mp -124.8 109.08 21.44 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.416 0 CA-C-O 123.745 1.736 . . . . 0.0 107.472 -176.644 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 47.5 t30 -130.73 71.14 1.46 Allowed 'General case' 0 N--CA 1.43 -1.439 0 C-N-CA 125.812 1.645 . . . . 0.0 110.486 179.981 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . 72.27 -101.42 1.05 Allowed Glycine 0 N--CA 1.43 -1.733 0 O-C-N 119.784 -1.822 . . . . 0.0 114.572 174.571 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -105.9 24.55 26.47 Favored Glycine 0 N--CA 1.43 -1.75 0 O-C-N 121.607 -0.937 . . . . 0.0 111.366 173.489 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 95.9 t -122.04 124.71 71.85 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.43 0 C-N-CA 125.539 1.536 . . . . 0.0 107.775 174.532 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 58.3 mt -111.62 140.75 45.98 Favored 'General case' 0 N--CA 1.429 -1.503 0 N-CA-C 107.604 -1.258 . . . . 0.0 107.604 161.83 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 1.2 m -134.57 125.07 26.52 Favored 'General case' 0 N--CA 1.431 -1.38 0 O-C-N 120.292 -1.505 . . . . 0.0 107.979 175.883 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 36.4 mt -96.32 116.62 38.74 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.437 0 N-CA-C 107.236 -1.394 . . . . 0.0 107.236 -175.601 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 86.4 m -127.6 111.61 13.94 Favored 'General case' 0 N--CA 1.43 -1.434 0 CA-C-O 123.713 1.721 . . . . 0.0 113.107 -169.292 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 43' ' ' PHE . . . . . . . . . . . . . 7.5 p90 -120.31 160.14 23.61 Favored 'General case' 0 N--CA 1.43 -1.461 0 C-N-CA 126.546 1.938 . . . . 0.0 112.209 178.938 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 25.8 mt-10 -52.88 -25.55 12.03 Favored 'General case' 0 N--CA 1.431 -1.421 0 N-CA-C 119.402 3.112 . . . . 0.0 119.402 -165.605 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 2.2 t-20 -66.77 -9.19 34.31 Favored 'General case' 0 N--CA 1.429 -1.495 0 C-N-CA 124.625 1.17 . . . . 0.0 113.998 177.686 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 94.56 25.2 16.21 Favored Glycine 0 N--CA 1.43 -1.747 0 O-C-N 120.506 -1.371 . . . . 0.0 110.712 177.107 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 18.3 m -89.52 163.88 15.03 Favored 'General case' 0 N--CA 1.429 -1.479 0 C-N-CA 125.523 1.529 . . . . 0.0 113.298 -170.528 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 36.5 ttmt -151.58 99.37 2.6 Favored 'General case' 0 N--CA 1.431 -1.401 0 O-C-N 121.549 -0.719 . . . . 0.0 111.237 -170.697 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 4.1 mm -101.58 107.91 22.5 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.457 0 N-CA-C 105.028 -2.212 . . . . 0.0 105.028 174.737 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 50' ' ' ILE . . . . . 0.42 HG23 ' HB3' ' A' ' 63' ' ' ALA . 3.4 tp -111.49 120.88 62.99 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.478 0 CA-C-O 123.438 1.59 . . . . 0.0 109.246 -169.824 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 2.4 mt -124.26 120.98 60.71 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.474 0 C-N-CA 125.653 1.581 . . . . 0.0 109.766 -173.994 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 7.5 t-20 -158.42 158.8 34.87 Favored 'General case' 0 N--CA 1.431 -1.389 0 CA-C-O 123.681 1.705 . . . . 0.0 106.843 -172.184 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 37.2 ptt180 -133.25 138.25 46.4 Favored 'General case' 0 N--CA 1.43 -1.454 0 C-N-CA 126.546 1.938 . . . . 0.0 111.077 -163.813 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 13.7 pt20 -100.36 137.58 38.59 Favored 'General case' 0 N--CA 1.43 -1.429 0 CA-C-O 122.496 1.141 . . . . 0.0 108.528 176.977 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 15.5 mm-40 -59.72 -49.02 93.87 Favored Pre-proline 0 N--CA 1.428 -1.531 0 CA-C-O 116.166 -1.874 . . . . 0.0 115.916 174.618 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 88.4 Cg_endo -75.21 139.78 24.16 Favored 'Trans proline' 0 C--N 1.301 -1.972 0 CA-C-N 126.04 3.193 . . . . 0.0 112.056 165.058 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . 0.368 5.5 mp 74.65 127.38 0.04 OUTLIER 'General case' 0 N--CA 1.431 -1.387 0 CA-C-O 124.354 2.026 . . . . 0.0 115.927 -176.22 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 24.1 m80 -76.94 40.24 0.25 Allowed 'General case' 0 N--CA 1.43 -1.438 0 C-N-CA 126.712 2.005 . . . . 0.0 115.016 -177.756 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 7.1 mp0 -127.61 132.18 49.82 Favored 'General case' 0 N--CA 1.43 -1.466 0 C-N-CA 128.591 2.756 . . . . 0.0 107.851 -171.567 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 60' ' ' VAL . . . . . 0.438 ' HB ' ' CE1' ' A' ' 71' ' ' PHE . 29.4 t -113.58 154.49 14.96 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.4 0 O-C-N 119.941 -1.724 . . . . 0.0 108.368 177.745 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 61' ' ' TRP . . . . . 0.436 ' HA ' ' HA ' ' A' ' 70' ' ' HIS 0.28 0.0 OUTLIER -89.3 154.0 20.44 Favored 'General case' 0 N--CA 1.429 -1.477 0 N-CA-C 115.045 1.498 . . . . 0.0 115.045 -178.67 . . . . . . . . 4 4 . 1 . 009 nuclear build full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -117.77 92.31 3.8 Favored 'General case' 0 N--CA 1.43 -1.46 0 N-CA-C 104.916 -2.253 . . . . 0.0 104.916 165.842 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 63' ' ' ALA . . . . . 0.42 ' HB3' HG23 ' A' ' 50' ' ' ILE . . . -104.22 100.89 10.63 Favored 'General case' 0 N--CA 1.431 -1.389 0 CA-C-O 123.689 1.709 . . . . 0.0 110.972 177.534 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 64' ' ' THR . . . . . . . . . . . . . 9.2 t -149.74 172.67 14.72 Favored 'General case' 0 N--CA 1.431 -1.4 0 C-N-CA 126.259 1.824 . . . . 0.0 106.893 -171.234 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 42.4 tptt -78.88 53.36 1.37 Allowed 'General case' 0 N--CA 1.43 -1.468 0 C-N-CA 126.579 1.952 . . . . 0.0 114.77 -166.439 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 38.4 tp60 -130.33 -24.33 2.56 Favored 'General case' 0 N--CA 1.43 -1.434 0 O-C-N 119.992 -1.693 . . . . 0.0 109.363 163.5 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 132.21 112.9 1.44 Allowed Glycine 0 N--CA 1.43 -1.71 0 N-CA-C 107.227 -2.349 . . . . 0.0 107.227 -167.199 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . -71.21 120.48 8.5 Favored Glycine 0 N--CA 1.429 -1.789 0 O-C-N 120.695 -1.473 . . . . 0.0 116.105 -177.195 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 18.6 m-30 -118.11 170.79 8.57 Favored 'General case' 0 N--CA 1.43 -1.459 0 C-N-CA 126.265 1.826 . . . . 0.0 108.7 -175.993 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 70' ' ' HIS . . . . . 0.436 ' HA ' ' HA ' ' A' ' 61' ' ' TRP . 1.5 p-80 -120.74 159.25 25.78 Favored 'General case' 0 N--CA 1.43 -1.465 0 O-C-N 119.226 -2.171 . . . . 0.0 110.93 165.318 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 71' ' ' PHE . . . . . 0.438 ' CE1' ' HB ' ' A' ' 60' ' ' VAL . 0.0 OUTLIER -117.66 153.66 32.94 Favored 'General case' 0 N--CA 1.429 -1.491 0 N-CA-C 117.471 2.397 . . . . 0.0 117.471 -165.43 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 -127.98 145.47 50.96 Favored 'General case' 0 N--CA 1.43 -1.433 0 C-N-CA 124.659 1.184 . . . . 0.0 110.286 178.126 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 60.0 tp -96.1 114.26 25.94 Favored 'General case' 0 N--CA 1.429 -1.477 0 O-C-N 119.883 -1.761 . . . . 0.0 111.609 -178.108 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 74.1 mmtt -82.95 -11.79 57.86 Favored 'General case' 0 N--CA 1.43 -1.451 0 C-N-CA 124.875 1.27 . . . . 0.0 113.185 174.037 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . 121.96 -61.28 0.55 Allowed Glycine 0 N--CA 1.429 -1.768 0 N-CA-C 109.137 -1.585 . . . . 0.0 109.137 178.486 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 6.2 p-10 -89.51 -20.32 23.97 Favored 'General case' 0 N--CA 1.431 -1.392 0 C-N-CA 124.909 1.284 . . . . 0.0 113.162 179.039 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 6.5 tp10 -147.76 136.48 21.86 Favored 'General case' 0 N--CA 1.43 -1.458 0 N-CA-C 107.115 -1.439 . . . . 0.0 107.115 -174.422 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 78' ' ' TRP . . . . . . . . . . . . . 95.7 m95 -80.94 111.22 17.22 Favored 'General case' 0 N--CA 1.431 -1.405 0 N-CA-C 105.927 -1.879 . . . . 0.0 105.927 159.94 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -106.08 155.7 6.96 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.473 0 N-CA-C 105.657 -1.979 . . . . 0.0 105.657 179.658 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 66.4 m -85.4 146.87 26.78 Favored 'General case' 0 N--CA 1.43 -1.457 0 O-C-N 119.597 -1.939 . . . . 0.0 111.946 -175.987 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 51.6 t0 -66.68 -52.07 48.87 Favored 'General case' 0 N--CA 1.43 -1.46 0 C-N-CA 126.011 1.724 . . . . 0.0 112.301 179.261 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 4.4 mmp_? -67.65 129.38 39.73 Favored 'General case' 0 N--CA 1.43 -1.456 0 C-N-CA 124.812 1.245 . . . . 0.0 110.916 173.756 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 71.2 m 70.94 -59.48 0.54 Allowed 'General case' 0 N--CA 1.43 -1.458 0 C-N-CA 126.84 2.056 . . . . 0.0 115.054 -179.175 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 119.99 63.39 0.26 Allowed Glycine 0 N--CA 1.431 -1.665 0 C-N-CA 126.286 1.898 . . . . 0.0 108.751 -172.589 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 15.2 mm-40 -108.64 -152.83 0.5 Allowed 'General case' 0 N--CA 1.43 -1.448 0 N-CA-C 108.092 -1.077 . . . . 0.0 108.092 -170.994 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 8.9 m -150.33 129.83 13.02 Favored 'General case' 0 N--CA 1.431 -1.413 0 O-C-N 119.428 -2.045 . . . . 0.0 109.861 -158.397 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 4.0 t80 -53.12 -81.85 0.01 OUTLIER 'General case' 0 N--CA 1.431 -1.409 0 N-CA-C 119.12 3.008 . . . . 0.0 119.12 -175.945 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 88' ' ' TRP . . . . . . . . . . . . . 84.9 m95 -67.25 -26.43 66.57 Favored 'General case' 0 N--CA 1.43 -1.429 0 O-C-N 119.841 -1.787 . . . . 0.0 113.423 -167.751 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 17.4 t70 -77.94 -36.97 48.65 Favored 'General case' 0 N--CA 1.432 -1.358 0 C-N-CA 126.171 1.788 . . . . 0.0 113.034 179.428 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 42.2 tp -70.76 -44.41 66.79 Favored 'General case' 0 N--CA 1.43 -1.449 0 O-C-N 119.862 -1.774 . . . . 0.0 111.241 173.046 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 9.0 tt -51.03 -48.17 61.53 Favored 'General case' 0 N--CA 1.431 -1.391 0 C-N-CA 127.238 2.215 . . . . 0.0 112.721 171.622 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 23.8 tt0 -53.08 -55.77 21.34 Favored 'General case' 0 N--CA 1.43 -1.438 0 C-N-CA 126.109 1.764 . . . . 0.0 113.468 168.739 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 66.2 tt0 -52.42 -52.91 51.35 Favored 'General case' 0 N--CA 1.428 -1.551 0 C-N-CA 125.424 1.49 . . . . 0.0 113.958 -178.419 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -66.62 -42.45 86.78 Favored 'General case' 0 N--CA 1.43 -1.466 0 N-CA-C 113.926 1.084 . . . . 0.0 113.926 -178.979 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -67.56 -35.82 79.77 Favored 'General case' 0 N--CA 1.43 -1.446 0 O-C-N 120.674 -1.266 . . . . 0.0 113.294 176.516 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 78.9 m -61.05 -47.07 88.07 Favored 'General case' 0 N--CA 1.431 -1.388 0 C-N-CA 125.835 1.654 . . . . 0.0 112.248 174.268 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 16.3 pt20 -78.29 -10.67 59.77 Favored 'General case' 0 N--CA 1.43 -1.456 0 N-CA-C 114.783 1.401 . . . . 0.0 114.783 177.688 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 4.0 mm-40 -76.79 -50.38 13.64 Favored 'General case' 0 N--CA 1.429 -1.495 0 O-C-N 120.261 -1.524 . . . . 0.0 112.913 163.299 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -80.15 -42.97 22.45 Favored 'General case' 0 N--CA 1.43 -1.469 0 N-CA-C 115.493 1.664 . . . . 0.0 115.493 -174.795 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . 95.51 21.43 24.33 Favored Glycine 0 N--CA 1.43 -1.753 0 C-N-CA 124.567 1.08 . . . . 0.0 112.957 -173.713 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 16.4 pt-20 -157.56 164.18 37.59 Favored 'General case' 0 N--CA 1.43 -1.438 0 N-CA-C 105.914 -1.884 . . . . 0.0 105.914 173.399 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 49.1 m -72.43 102.93 3.31 Favored 'General case' 0 N--CA 1.431 -1.4 0 CA-C-N 119.936 1.243 . . . . 0.0 113.053 -173.0 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 4.3 t -98.49 85.68 1.32 Allowed 'Isoleucine or valine' 0 N--CA 1.429 -1.475 0 CA-C-O 123.359 1.552 . . . . 0.0 109.84 -179.024 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 27.9 p -115.84 156.75 25.53 Favored 'General case' 0 N--CA 1.43 -1.454 0 C-N-CA 125.669 1.587 . . . . 0.0 114.064 -170.322 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 29.6 m-85 -102.96 -34.61 8.87 Favored 'General case' 0 N--CA 1.429 -1.493 0 C-N-CA 125.834 1.654 . . . . 0.0 110.011 165.949 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 30.7 mmt180 . . . . . 0 C--O 1.26 1.65 0 O-C-N 121.513 -0.742 . . . . 0.0 109.539 -177.643 . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 68.2 mtm . . . . . 0 CA--C 1.49 -1.352 0 CA-C-O 122.23 1.014 . . . . 1.0 111.518 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 33.9 p-10 -60.8 -36.61 79.48 Favored 'General case' 0 N--CA 1.43 -1.465 0 C-N-CA 126.167 1.787 . . . . 1.0 113.458 170.203 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 11.2 t70 -56.15 -54.36 46.03 Favored 'General case' 0 N--CA 1.43 -1.458 0 C-N-CA 127.554 2.342 . . . . 1.0 112.862 179.297 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 62.5 m -52.92 -53.64 46.39 Favored 'General case' 0 N--CA 1.43 -1.462 0 C-N-CA 126.516 1.926 . . . . 1.0 113.994 176.237 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 5.8 mm-40 -65.17 -49.04 71.36 Favored 'General case' 0 N--CA 1.43 -1.445 0 C-N-CA 125.616 1.566 . . . . 1.0 113.601 -178.034 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 12.9 t80 -61.96 -38.25 87.81 Favored 'General case' 0 N--CA 1.43 -1.43 0 N-CA-C 114.272 1.212 . . . . 1.0 114.272 173.373 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 23.6 t60 -65.56 -37.53 86.96 Favored 'General case' 0 N--CA 1.43 -1.445 0 O-C-N 119.882 -1.761 . . . . 1.0 113.2 176.422 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 1.7 tpm_? -59.12 -54.5 46.27 Favored 'General case' 0 N--CA 1.431 -1.422 0 C-N-CA 125.565 1.546 . . . . 1.0 112.353 171.796 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 81.5 mt -57.03 -49.13 76.74 Favored 'General case' 0 N--CA 1.429 -1.506 0 C-N-CA 125.043 1.337 . . . . 1.0 113.806 174.629 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -56.67 -48.34 77.82 Favored 'General case' 0 N--CA 1.431 -1.384 0 C-N-CA 127.087 2.155 . . . . 1.0 114.511 -178.283 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -59.78 -52.57 64.89 Favored 'General case' 0 N--CA 1.429 -1.502 0 O-C-N 121.29 -0.881 . . . . 1.0 112.498 171.639 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 39.6 mt-30 -55.2 -45.9 75.86 Favored 'General case' 0 N--CA 1.43 -1.458 0 N-CA-C 117.839 2.533 . . . . 1.0 117.839 177.637 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 4.0 pp -65.67 -38.51 89.52 Favored 'General case' 0 N--CA 1.43 -1.474 0 O-C-N 120.707 -1.246 . . . . 1.0 113.669 175.679 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 0.1 OUTLIER -49.84 -56.52 10.09 Favored 'General case' 0 N--CA 1.429 -1.506 0 N-CA-C 113.988 1.107 . . . . 1.0 113.988 167.894 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 38.1 mt -56.46 -44.21 80.31 Favored 'General case' 0 N--CA 1.43 -1.431 0 CA-C-O 122.183 0.992 . . . . 1.0 113.313 178.743 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 14.9 m -57.56 -54.21 49.44 Favored 'General case' 0 N--CA 1.431 -1.411 0 C-N-CA 125.047 1.339 . . . . 1.0 113.323 178.981 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 80.9 mt -59.62 -46.86 92.79 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.416 0 C-N-CA 126.879 2.072 . . . . 1.0 113.541 177.213 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 26.1 mt-10 -52.67 -57.61 9.52 Favored 'General case' 0 N--CA 1.43 -1.469 0 C-N-CA 126.225 1.81 . . . . 1.0 112.248 176.526 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -53.45 -54.93 29.86 Favored 'General case' 0 CA--C 1.489 -1.391 0 C-N-CA 125.174 1.39 . . . . 1.0 113.545 174.421 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 3.4 tpt180 -57.9 -49.05 78.05 Favored 'General case' 0 N--CA 1.431 -1.42 0 N-CA-C 114.992 1.479 . . . . 1.0 114.992 -171.508 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -80.9 -32.82 34.63 Favored 'General case' 0 N--CA 1.43 -1.458 0 N-CA-C 114.255 1.206 . . . . 1.0 114.255 177.84 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 15.0 t70 -56.02 -49.32 74.0 Favored 'General case' 0 N--CA 1.428 -1.532 0 O-C-N 119.738 -1.851 . . . . 1.0 114.064 172.448 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 13.6 t70 -52.83 -45.41 67.31 Favored 'General case' 0 N--CA 1.43 -1.427 0 C-N-CA 128.081 2.553 . . . . 1.0 117.206 -175.356 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 24' ' ' TRP . . . . . . . . . . . . . 76.9 t-105 -43.9 -65.12 0.54 Allowed 'General case' 0 N--CA 1.43 -1.472 0 C-N-CA 127.677 2.391 . . . . 1.0 116.57 -169.594 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 40.4 t0 59.34 70.03 0.67 Allowed 'General case' 0 N--CA 1.43 -1.46 0 C-N-CA 126.653 1.981 . . . . 1.0 114.161 173.231 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -99.65 -134.29 8.44 Favored Glycine 0 N--CA 1.429 -1.818 0 CA-C-O 122.823 1.235 . . . . 1.0 113.386 -175.45 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -72.69 -34.52 67.22 Favored 'General case' 0 N--CA 1.43 -1.447 0 C-N-CA 125.024 1.329 . . . . 1.0 109.64 174.547 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 36.1 m -89.3 148.84 23.33 Favored 'General case' 0 N--CA 1.43 -1.429 0 CA-C-O 122.899 1.333 . . . . 1.0 113.033 -179.926 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 22.5 t0 -76.84 172.84 12.47 Favored 'General case' 0 N--CA 1.431 -1.381 0 C-N-CA 125.187 1.395 . . . . 1.0 110.135 170.432 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 5.4 tp -157.04 114.78 0.23 Allowed 'Isoleucine or valine' 0 N--CA 1.43 -1.464 0 CA-C-O 123.477 1.608 . . . . 1.0 108.253 -164.78 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 7.5 t0 -131.68 102.31 5.84 Favored 'General case' 0 N--CA 1.431 -1.388 0 O-C-N 120.507 -1.371 . . . . 1.0 108.806 170.767 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 27.3 p -89.58 124.45 34.56 Favored 'General case' 0 N--CA 1.431 -1.424 0 O-C-N 120.241 -1.537 . . . . 1.0 111.669 -178.697 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 5.2 mm-40 -94.34 135.13 36.09 Favored 'General case' 0 N--CA 1.429 -1.478 0 O-C-N 120.087 -1.633 . . . . 1.0 110.623 -177.191 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 1.6 tp -131.42 115.89 30.31 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.422 0 C-N-CA 126.758 2.023 . . . . 1.0 107.357 -176.929 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 4.9 t-20 -147.66 81.42 1.51 Allowed 'General case' 0 N--CA 1.431 -1.423 0 O-C-N 121.62 -0.675 . . . . 1.0 111.374 172.281 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . 68.27 -70.49 0.34 Allowed Glycine 0 N--CA 1.429 -1.808 0 C-N-CA 126.777 2.132 . . . . 1.0 118.221 167.815 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -119.5 -3.07 12.93 Favored Glycine 0 N--CA 1.43 -1.762 0 C-N-CA 126.125 1.821 . . . . 1.0 112.24 179.693 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 21.5 t -120.99 123.78 70.85 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.457 0 CA-C-N 118.538 1.169 . . . . 1.0 109.689 -177.707 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 42.1 mt -110.23 135.67 50.63 Favored 'General case' 0 N--CA 1.431 -1.408 0 O-C-N 120.286 -1.509 . . . . 1.0 108.707 163.254 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -136.91 107.51 6.54 Favored 'General case' 0 N--CA 1.431 -1.407 0 N-CA-C 107.183 -1.414 . . . . 1.0 107.183 -178.329 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 6.5 mt -100.46 114.62 39.8 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.513 0 O-C-N 119.457 -2.027 . . . . 1.0 108.664 -168.075 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 23.0 m -116.03 131.94 56.8 Favored 'General case' 0 N--CA 1.43 -1.436 0 CA-C-O 121.473 0.654 . . . . 1.0 111.265 -167.102 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 43' ' ' PHE . . . . . . . . . . . . 0.263 0.2 OUTLIER -120.55 173.03 7.42 Favored 'General case' 0 N--CA 1.429 -1.486 0 C-N-CA 124.624 1.17 . . . . 1.0 112.481 177.142 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -57.88 -33.32 68.59 Favored 'General case' 0 N--CA 1.431 -1.418 0 N-CA-C 118.256 2.687 . . . . 1.0 118.256 -160.097 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -69.46 -13.78 62.53 Favored 'General case' 0 N--CA 1.43 -1.459 0 C-N-CA 125.543 1.537 . . . . 1.0 113.283 -179.775 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 82.27 38.32 13.12 Favored Glycine 0 N--CA 1.429 -1.772 0 O-C-N 119.868 -1.77 . . . . 1.0 109.228 -168.793 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 68.8 m -120.86 151.61 39.43 Favored 'General case' 0 CA--C 1.489 -1.4 0 N-CA-C 106.145 -1.798 . . . . 1.0 106.145 179.456 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 47.6 pttt -161.3 165.64 28.82 Favored 'General case' 0 N--CA 1.431 -1.411 0 N-CA-C 113.905 1.076 . . . . 1.0 113.905 -165.54 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 5.7 mm -112.86 135.23 52.95 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.506 0 C-N-CA 127.327 2.251 . . . . 1.0 106.269 175.517 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 3.2 mm -117.88 114.46 45.42 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.466 0 C-N-CA 124.577 1.151 . . . . 1.0 108.737 -179.912 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 4.7 mt -128.08 128.25 68.62 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.5 0 CA-C-O 123.006 1.384 . . . . 1.0 111.617 -176.902 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 52' ' ' ASN . . . . . 0.459 ' H ' ' HD1' ' A' ' 61' ' ' TRP . 14.0 t-20 -160.96 174.41 13.83 Favored 'General case' 0 N--CA 1.43 -1.452 0 N-CA-C 102.809 -3.034 . . . . 1.0 102.809 -178.349 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 12.6 ptt180 -142.46 135.26 28.25 Favored 'General case' 0 CA--C 1.489 -1.374 0 N-CA-C 108.66 -0.867 . . . . 1.0 108.66 -169.263 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 55.2 mm-40 -139.46 67.02 1.39 Allowed 'General case' 0 N--CA 1.431 -1.393 0 N-CA-C 106.892 -1.522 . . . . 1.0 106.892 -171.401 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 55' ' ' GLU . . . . . 0.426 ' H ' ' HG3' ' A' ' 55' ' ' GLU . 1.0 OUTLIER -70.91 126.82 92.17 Favored Pre-proline 0 N--CA 1.43 -1.438 0 N-CA-C 117.24 2.311 . . . . 1.0 117.24 -157.655 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 49.6 Cg_endo -76.63 -55.62 0.06 OUTLIER 'Trans proline' 0 C--N 1.299 -2.069 0 C-N-CA 122.052 1.835 . . . . 1.0 109.812 150.908 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 57' ' ' LEU . . . . . 0.419 ' HB2' ' H ' ' A' ' 58' ' ' HIS . 40.8 mt -115.96 -93.23 0.5 Allowed 'General case' 0 N--CA 1.429 -1.508 0 C-N-CA 124.932 1.293 . . . . 1.0 109.307 -177.692 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 58' ' ' HIS . . . . . 0.419 ' H ' ' HB2' ' A' ' 57' ' ' LEU . 51.4 m170 -132.76 78.96 1.82 Allowed 'General case' 0 N--CA 1.43 -1.436 0 C-N-CA 126.68 1.992 . . . . 1.0 106.604 175.892 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 12.0 tt0 -138.47 140.43 39.23 Favored 'General case' 0 N--CA 1.43 -1.45 0 O-C-N 119.908 -1.745 . . . . 1.0 108.252 -170.389 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 48.9 t -119.85 154.43 22.71 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.381 0 N-CA-C 106.198 -1.778 . . . . 1.0 106.198 -177.611 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 61' ' ' TRP . . . . . 0.459 ' HD1' ' H ' ' A' ' 52' ' ' ASN . 0.0 OUTLIER -99.42 148.44 24.21 Favored 'General case' 0 N--CA 1.43 -1.45 0 O-C-N 120.555 -1.341 . . . . 1.0 110.092 178.228 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -133.55 92.21 2.95 Favored 'General case' 0 N--CA 1.429 -1.477 0 O-C-N 120.38 -1.45 . . . . 1.0 111.829 176.862 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -103.71 149.9 24.54 Favored 'General case' 0 N--CA 1.43 -1.429 0 CA-C-O 123.628 1.68 . . . . 1.0 112.011 173.712 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 64' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -151.15 -82.92 0.09 Allowed 'General case' 0 N--CA 1.43 -1.438 0 N-CA-C 107.197 -1.409 . . . . 1.0 107.197 -171.161 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 42.8 tttp -122.88 -59.03 1.63 Allowed 'General case' 0 N--CA 1.43 -1.431 0 C-N-CA 123.696 0.798 . . . . 1.0 111.881 178.432 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 51.7 tt0 -121.1 -23.35 5.83 Favored 'General case' 0 N--CA 1.431 -1.417 0 N-CA-C 112.969 0.729 . . . . 1.0 112.969 -160.066 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . -90.84 -83.79 1.41 Allowed Glycine 0 N--CA 1.431 -1.668 0 O-C-N 120.627 -1.295 . . . . 1.0 114.762 -175.958 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 74.69 51.1 8.37 Favored Glycine 0 N--CA 1.43 -1.748 0 O-C-N 121.375 -1.074 . . . . 1.0 112.845 -166.425 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 11.0 m-30 -99.44 125.78 45.22 Favored 'General case' 0 N--CA 1.429 -1.475 0 O-C-N 121.257 -1.143 . . . . 1.0 108.648 -169.358 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 18.7 p80 -92.37 156.45 17.22 Favored 'General case' 0 N--CA 1.43 -1.459 0 O-C-N 120.214 -1.554 . . . . 1.0 112.072 179.26 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 50.9 p90 -144.13 142.9 30.85 Favored 'General case' 0 N--CA 1.43 -1.448 0 N-CA-C 115.164 1.542 . . . . 1.0 115.164 -156.381 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -119.54 155.69 31.71 Favored 'General case' 0 N--CA 1.429 -1.476 0 C-N-CA 126.834 2.054 . . . . 1.0 110.866 -172.001 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 58.5 tp -92.35 117.4 29.86 Favored 'General case' 0 N--CA 1.43 -1.426 0 O-C-N 120.318 -1.489 . . . . 1.0 111.427 178.801 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 68.3 mmtt -79.99 -45.74 17.89 Favored 'General case' 0 N--CA 1.43 -1.473 0 O-C-N 120.746 -1.221 . . . . 1.0 113.122 170.034 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -174.92 -76.18 0.05 OUTLIER Glycine 0 N--CA 1.43 -1.73 0 O-C-N 121.001 -1.062 . . . . 1.0 112.453 -179.459 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 4.0 p-10 -101.67 0.33 35.94 Favored 'General case' 0 N--CA 1.429 -1.509 0 C-N-CA 124.876 1.27 . . . . 1.0 112.149 173.675 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 20.6 pt-20 -153.44 148.8 27.08 Favored 'General case' 0 N--CA 1.431 -1.404 0 N-CA-C 106.127 -1.805 . . . . 1.0 106.127 -174.764 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 78' ' ' TRP . . . . . . . . . . . . . 27.4 m95 -97.86 135.36 39.72 Favored 'General case' 0 N--CA 1.43 -1.442 0 N-CA-C 106.982 -1.488 . . . . 1.0 106.982 177.413 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 3.1 mt -104.87 134.38 46.45 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.426 0 C-N-CA 125.502 1.521 . . . . 1.0 107.186 177.832 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 75.4 m -82.58 127.6 33.51 Favored 'General case' 0 N--CA 1.432 -1.368 0 CA-C-N 115.403 -0.817 . . . . 1.0 108.841 -179.376 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 30.1 t70 -70.08 -37.9 75.57 Favored 'General case' 0 N--CA 1.43 -1.438 0 C-N-CA 124.16 0.984 . . . . 1.0 112.827 -166.894 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -75.51 121.0 21.71 Favored 'General case' 0 N--CA 1.43 -1.461 0 O-C-N 121.234 -0.916 . . . . 1.0 110.017 176.743 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 83' ' ' SER . . . . . . . . . . . . 0.378 80.2 p 72.59 -53.2 0.7 Allowed 'General case' 0 N--CA 1.43 -1.449 0 C-N-CA 128.065 2.546 . . . . 1.0 115.954 -173.028 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 116.54 80.12 0.79 Allowed Glycine 0 N--CA 1.43 -1.719 0 N-CA-C 109.123 -1.591 . . . . 1.0 109.123 -176.375 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 4.6 mm-40 -135.11 -156.02 0.69 Allowed 'General case' 0 N--CA 1.43 -1.458 0 N-CA-C 105.467 -2.049 . . . . 1.0 105.467 -172.158 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 18.8 m -145.71 137.64 25.31 Favored 'General case' 0 N--CA 1.431 -1.413 0 O-C-N 119.866 -1.771 . . . . 1.0 109.087 -154.267 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 1.3 t80 -30.72 -91.23 0.0 OUTLIER 'General case' 0 N--CA 1.43 -1.447 0 C-N-CA 128.702 2.801 . . . . 1.0 118.309 176.551 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 88' ' ' TRP . . . . . . . . . . . . . 56.0 m95 -73.72 -28.09 61.53 Favored 'General case' 0 N--CA 1.43 -1.463 0 O-C-N 120.794 -1.191 . . . . 1.0 111.499 -169.653 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 59.3 m-20 -74.75 -38.82 62.13 Favored 'General case' 0 N--CA 1.429 -1.506 0 C-N-CA 124.603 1.161 . . . . 1.0 114.06 -178.636 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 58.2 tp -69.64 -45.5 68.32 Favored 'General case' 0 N--CA 1.43 -1.435 0 O-C-N 119.611 -1.931 . . . . 1.0 109.79 174.338 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 60.9 tp -50.93 -44.84 60.36 Favored 'General case' 0 N--CA 1.43 -1.469 0 C-N-CA 125.678 1.591 . . . . 1.0 114.35 170.278 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 2.9 tm-20 -55.78 -49.04 74.24 Favored 'General case' 0 N--CA 1.431 -1.384 0 C-N-CA 126.495 1.918 . . . . 1.0 113.505 172.193 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 1.8 tm0? -61.27 -50.92 71.08 Favored 'General case' 0 N--CA 1.429 -1.499 0 N-CA-C 114.253 1.205 . . . . 1.0 114.253 176.288 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -54.43 -44.26 72.29 Favored 'General case' 0 N--CA 1.431 -1.41 0 C-N-CA 128.019 2.528 . . . . 1.0 115.256 174.544 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -72.97 -45.82 55.82 Favored 'General case' 0 N--CA 1.431 -1.418 0 O-C-N 120.299 -1.5 . . . . 1.0 113.868 178.203 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 91.9 m -50.52 -45.77 56.85 Favored 'General case' 0 N--CA 1.428 -1.549 0 C-N-CA 127.125 2.17 . . . . 1.0 112.891 168.997 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 2.7 tp60 -57.28 -54.75 43.29 Favored 'General case' 0 N--CA 1.432 -1.371 0 C-N-CA 126.31 1.844 . . . . 1.0 113.188 172.795 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 10.1 mm100 -58.41 -45.18 88.91 Favored 'General case' 0 N--CA 1.43 -1.449 0 N-CA-C 116.345 1.98 . . . . 1.0 116.345 176.648 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -78.51 -43.21 27.43 Favored 'General case' 0 N--CA 1.429 -1.481 0 O-C-N 120.302 -1.499 . . . . 1.0 113.402 -178.926 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . 97.27 13.69 44.45 Favored Glycine 0 N--CA 1.431 -1.699 0 C-N-CA 125.085 1.326 . . . . 1.0 111.7 -172.98 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 8.0 tt0 -157.13 144.99 19.12 Favored 'General case' 0 N--CA 1.43 -1.455 0 N-CA-C 106.226 -1.768 . . . . 1.0 106.226 -174.665 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 57.0 m -58.86 119.2 6.74 Favored 'General case' 0 N--CA 1.429 -1.515 0 C-N-CA 125.078 1.351 . . . . 1.0 114.51 -178.726 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 92.2 t -96.19 130.42 44.88 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.45 0 C-N-CA 125.53 1.532 . . . . 1.0 108.816 -179.025 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 7.5 t -93.2 96.76 10.21 Favored 'General case' 0 N--CA 1.429 -1.487 0 C-N-CA 125.449 1.5 . . . . 1.0 114.448 -170.346 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 14.9 m-85 -118.23 -18.97 9.16 Favored 'General case' 0 N--CA 1.431 -1.421 0 C-N-CA 124.87 1.268 . . . . 1.0 111.278 172.17 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.26 1.658 0 O-C-N 120.965 -1.085 . . . . 1.0 113.849 -168.911 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 11.8 tpt . . . . . 0 CA--C 1.489 -1.387 0 CA-C-O 121.81 0.814 . . . . 1.0 111.087 . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 80.6 m-20 -109.89 76.09 0.97 Allowed 'General case' 0 N--CA 1.431 -1.413 0 O-C-N 120.905 -1.122 . . . . 1.0 111.081 -172.164 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 9.0 t70 -68.5 -42.31 78.79 Favored 'General case' 0 N--CA 1.429 -1.52 0 C-N-CA 124.635 1.174 . . . . 1.0 114.08 -172.328 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 15.9 t -64.17 -43.63 94.53 Favored 'General case' 0 N--CA 1.429 -1.478 0 O-C-N 120.473 -1.392 . . . . 1.0 112.904 175.846 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 9.4 mm-40 -55.02 -58.32 8.12 Favored 'General case' 0 N--CA 1.43 -1.433 0 C-N-CA 124.893 1.277 . . . . 1.0 113.168 172.908 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 31.3 t80 -50.59 -57.65 7.68 Favored 'General case' 0 N--CA 1.43 -1.426 0 N-CA-C 114.625 1.343 . . . . 1.0 114.625 172.873 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 37.4 m80 -65.07 -38.98 92.54 Favored 'General case' 0 N--CA 1.43 -1.436 0 N-CA-C 115.759 1.763 . . . . 1.0 115.759 -175.588 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 47.6 mtt-85 -62.79 -53.5 53.29 Favored 'General case' 0 N--CA 1.43 -1.432 0 CA-C-N 120.239 1.381 . . . . 1.0 112.972 172.14 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 98.2 mt -62.11 -42.86 99.65 Favored 'General case' 0 N--CA 1.43 -1.465 0 O-C-N 120.752 -1.217 . . . . 1.0 113.571 -178.394 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -62.78 -36.27 82.54 Favored 'General case' 0 N--CA 1.431 -1.424 0 N-CA-C 114.424 1.268 . . . . 1.0 114.424 174.965 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 10.8 t70 -61.17 -45.18 95.66 Favored 'General case' 0 N--CA 1.429 -1.491 0 O-C-N 120.569 -1.332 . . . . 1.0 111.762 172.741 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 29.4 mm100 -57.19 -39.85 76.2 Favored 'General case' 0 N--CA 1.429 -1.49 0 N-CA-C 115.019 1.488 . . . . 1.0 115.019 173.759 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 28.5 mt -59.78 -52.49 65.24 Favored 'General case' 0 N--CA 1.43 -1.452 0 O-C-N 120.312 -1.493 . . . . 1.0 112.942 171.436 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 0.7 OUTLIER -42.67 -56.11 3.28 Favored 'General case' 0 N--CA 1.43 -1.466 0 C-N-CA 127.028 2.131 . . . . 1.0 114.305 174.606 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 44.1 mt -60.32 -48.8 80.19 Favored 'General case' 0 N--CA 1.429 -1.51 0 C-N-CA 124.437 1.095 . . . . 1.0 113.701 176.279 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 24.1 m -64.67 -45.88 84.84 Favored 'General case' 0 N--CA 1.43 -1.43 0 C-N-CA 124.831 1.253 . . . . 1.0 113.539 -175.132 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 65.7 mt -59.53 -51.23 75.17 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.499 0 C-N-CA 126.018 1.727 . . . . 1.0 111.024 175.821 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 4.8 tt0 -55.62 -51.2 67.99 Favored 'General case' 0 N--CA 1.43 -1.438 0 N-CA-C 112.972 0.731 . . . . 1.0 112.972 176.064 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 13.0 tt0 -60.49 -44.75 95.61 Favored 'General case' 0 N--CA 1.429 -1.522 0 N-CA-C 115.3 1.592 . . . . 1.0 115.3 -178.493 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -67.54 -39.14 85.01 Favored 'General case' 0 N--CA 1.431 -1.42 0 O-C-N 119.925 -1.734 . . . . 1.0 112.465 178.113 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 15.2 mt -62.1 -57.11 12.78 Favored 'General case' 0 N--CA 1.431 -1.393 0 N-CA-C 114.628 1.344 . . . . 1.0 114.628 170.724 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 7.6 t70 -52.92 -37.99 61.35 Favored 'General case' 0 N--CA 1.432 -1.368 0 C-N-CA 127.092 2.157 . . . . 1.0 114.962 179.441 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 29.0 t70 -74.96 -0.42 18.66 Favored 'General case' 0 N--CA 1.429 -1.485 0 O-C-N 120.102 -1.624 . . . . 1.0 115.109 179.81 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 24' ' ' TRP . . . . . . . . . . . . . 68.4 t-105 -75.27 129.38 37.34 Favored 'General case' 0 N--CA 1.431 -1.385 0 O-C-N 118.433 -2.667 . . . . 1.0 112.496 172.237 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 34.3 m-20 -117.74 136.5 53.33 Favored 'General case' 0 N--CA 1.43 -1.465 0 N-CA-C 106.788 -1.56 . . . . 1.0 106.788 167.814 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -172.31 -149.01 6.46 Favored Glycine 0 N--CA 1.431 -1.672 0 N-CA-C 110.043 -1.223 . . . . 1.0 110.043 178.724 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 1.5 t70 -79.36 -28.8 41.98 Favored 'General case' 0 N--CA 1.43 -1.462 0 CA-C-O 122.293 1.044 . . . . 1.0 110.694 179.867 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 96.1 p -86.31 -164.41 1.04 Allowed 'General case' 0 N--CA 1.43 -1.465 0 C-N-CA 127.873 2.469 . . . . 1.0 113.749 -179.677 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 3.4 t70 -142.29 179.09 7.13 Favored 'General case' 0 N--CA 1.43 -1.444 0 O-C-N 120.313 -1.492 . . . . 1.0 109.851 176.21 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 7.4 tp -162.77 113.82 0.09 OUTLIER 'Isoleucine or valine' 0 N--CA 1.431 -1.411 0 CA-C-O 123.247 1.498 . . . . 1.0 110.626 -175.149 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -121.36 107.27 12.3 Favored 'General case' 0 N--CA 1.43 -1.458 0 O-C-N 120.363 -1.46 . . . . 1.0 108.991 169.593 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 91.2 m -87.03 139.02 30.99 Favored 'General case' 0 N--CA 1.43 -1.425 0 O-C-N 119.588 -1.945 . . . . 1.0 109.224 164.752 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -105.93 140.13 39.41 Favored 'General case' 0 N--CA 1.43 -1.429 0 C-N-CA 126.083 1.753 . . . . 1.0 110.85 -171.249 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 5.0 mm -115.32 106.85 21.35 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.453 0 C-N-CA 125.333 1.453 . . . . 1.0 107.796 -170.758 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 69.2 m-80 -128.36 -179.37 4.99 Favored 'General case' 0 N--CA 1.429 -1.481 0 O-C-N 120.465 -1.397 . . . . 1.0 110.636 176.069 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -73.22 94.86 0.73 Allowed Glycine 0 N--CA 1.431 -1.666 0 O-C-N 120.112 -1.618 . . . . 1.0 114.326 -167.174 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 78.19 25.33 61.89 Favored Glycine 0 N--CA 1.43 -1.741 0 C-N-CA 125.855 1.693 . . . . 1.0 112.675 -173.067 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 54.8 t -139.82 129.37 28.95 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.454 0 C-N-CA 124.176 0.99 . . . . 1.0 110.45 -167.139 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 14.4 mt -111.69 132.41 54.63 Favored 'General case' 0 N--CA 1.43 -1.445 0 N-CA-C 108.159 -1.052 . . . . 1.0 108.159 154.814 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 2.7 m -124.99 119.89 30.02 Favored 'General case' 0 N--CA 1.429 -1.481 0 N-CA-C 106.989 -1.486 . . . . 1.0 106.989 178.644 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 73.7 mt -93.92 120.53 43.47 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.437 0 O-C-N 120.767 -1.208 . . . . 1.0 108.206 -168.919 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 43.4 p -126.64 129.11 47.85 Favored 'General case' 0 N--CA 1.43 -1.438 0 CA-C-O 122.183 0.992 . . . . 1.0 111.619 178.577 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 43' ' ' PHE . . . . . . . . . . . . . 7.2 p90 -120.28 168.41 11.29 Favored 'General case' 0 N--CA 1.431 -1.424 0 O-C-N 120.372 -1.455 . . . . 1.0 109.57 172.563 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -64.52 -28.88 69.95 Favored 'General case' 0 N--CA 1.431 -1.423 0 N-CA-C 116.16 1.911 . . . . 1.0 116.16 -166.981 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 15.8 m-80 -66.82 -4.94 10.4 Favored 'General case' 0 N--CA 1.43 -1.461 0 C-N-CA 126.068 1.747 . . . . 1.0 114.824 173.181 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 103.23 15.74 22.69 Favored Glycine 0 N--CA 1.43 -1.717 0 O-C-N 120.063 -1.648 . . . . 1.0 116.894 158.874 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 3.2 t -91.86 -175.77 4.23 Favored 'General case' 0 N--CA 1.431 -1.404 0 CA-C-N 118.54 1.17 . . . . 1.0 113.639 -178.072 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -160.81 99.44 1.24 Allowed 'General case' 0 N--CA 1.43 -1.461 0 CA-C-O 122.967 1.365 . . . . 1.0 110.938 -174.401 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -107.58 119.95 58.08 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.443 0 N-CA-C 105.798 -1.927 . . . . 1.0 105.798 -174.468 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 3.7 tp -112.95 128.65 69.58 Favored 'Isoleucine or valine' 0 CA--C 1.488 -1.408 0 O-C-N 119.611 -1.931 . . . . 1.0 111.789 -165.897 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 4.1 mt -124.99 127.59 72.5 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.489 0 C-N-CA 126.749 2.02 . . . . 1.0 110.558 -179.173 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 52' ' ' ASN . . . . . 0.487 ' H ' ' HD1' ' A' ' 61' ' ' TRP . 6.8 t-20 -162.47 169.71 19.92 Favored 'General case' 0 N--CA 1.431 -1.416 0 N-CA-C 105.347 -2.094 . . . . 1.0 105.347 -165.706 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 34.4 ttp180 -155.03 136.17 13.91 Favored 'General case' 0 N--CA 1.431 -1.418 0 O-C-N 120.761 -1.212 . . . . 1.0 110.754 -156.651 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 4.7 mm100 -97.26 127.59 43.35 Favored 'General case' 0 N--CA 1.429 -1.512 0 N-CA-C 107.115 -1.439 . . . . 1.0 107.115 177.673 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 87.4 mt-10 -58.58 -37.62 56.32 Favored Pre-proline 0 N--CA 1.429 -1.502 0 CA-C-O 114.812 -2.518 . . . . 1.0 117.004 167.132 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 68.5 Cg_endo -79.33 155.85 25.34 Favored 'Trans proline' 0 N--CA 1.434 -2.025 0 CA-C-N 127.694 3.783 . . . . 1.0 111.793 161.379 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . 0.361 5.5 mp 67.06 134.94 0.02 OUTLIER 'General case' 0 N--CA 1.431 -1.411 0 CA-C-O 124.553 2.12 . . . . 1.0 115.95 -174.213 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 22.0 m170 -76.15 41.72 0.24 Allowed 'General case' 0 N--CA 1.429 -1.51 0 C-N-CA 126.416 1.886 . . . . 1.0 114.869 -176.23 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 2.1 pt20 -146.91 158.34 43.89 Favored 'General case' 0 N--CA 1.431 -1.379 0 O-C-N 119.402 -2.061 . . . . 1.0 110.073 -171.657 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 93.0 t -118.28 162.28 16.48 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.402 0 N-CA-C 107.03 -1.47 . . . . 1.0 107.03 -177.305 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 61' ' ' TRP . . . . . 0.487 ' HD1' ' H ' ' A' ' 52' ' ' ASN . 0.0 OUTLIER -104.17 153.24 21.19 Favored 'General case' 0 N--CA 1.43 -1.453 0 O-C-N 119.654 -1.904 . . . . 1.0 109.907 178.963 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 2.0 pt? -143.68 126.39 16.08 Favored 'General case' 0 N--CA 1.431 -1.408 0 O-C-N 120.24 -1.538 . . . . 1.0 108.564 158.897 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -120.18 146.79 45.67 Favored 'General case' 0 N--CA 1.429 -1.499 0 CA-C-O 122.46 1.124 . . . . 1.0 112.486 176.09 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 64' ' ' THR . . . . . . . . . . . . . 72.0 p -136.52 -148.99 0.3 Allowed 'General case' 0 N--CA 1.429 -1.513 0 C-N-CA 125.702 1.601 . . . . 1.0 110.503 -152.206 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 12.2 tmtt? -60.7 -67.5 0.39 Allowed 'General case' 0 N--CA 1.429 -1.498 0 C-N-CA 126.654 1.982 . . . . 1.0 112.675 173.817 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 13.1 tt0 -131.0 -22.04 2.62 Favored 'General case' 0 N--CA 1.43 -1.433 0 O-C-N 121.098 -1.001 . . . . 1.0 113.458 176.97 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . -82.98 -99.29 0.52 Allowed Glycine 0 N--CA 1.43 -1.719 0 O-C-N 119.838 -1.789 . . . . 1.0 114.033 -176.397 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 69.3 149.01 0.29 Allowed Glycine 0 N--CA 1.43 -1.72 0 N-CA-C 116.261 1.264 . . . . 1.0 116.261 -171.951 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 1.4 t80 -166.44 169.19 14.16 Favored 'General case' 0 N--CA 1.43 -1.448 0 N-CA-C 107.408 -1.33 . . . . 1.0 107.408 168.262 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 3.7 p-80 -95.23 159.29 15.08 Favored 'General case' 0 N--CA 1.429 -1.492 0 O-C-N 120.17 -1.582 . . . . 1.0 111.811 172.817 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 43.5 p90 -138.48 133.49 32.78 Favored 'General case' 0 N--CA 1.43 -1.471 0 N-CA-C 114.817 1.414 . . . . 1.0 114.817 -158.825 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 43.0 m-20 -105.43 176.28 5.22 Favored 'General case' 0 N--CA 1.431 -1.422 0 C-N-CA 126.361 1.865 . . . . 1.0 109.445 -176.403 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 45.8 tp -110.6 125.46 53.43 Favored 'General case' 0 N--CA 1.431 -1.397 0 O-C-N 119.588 -1.945 . . . . 1.0 110.551 177.974 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 94.5 mttt -73.91 -99.13 0.01 OUTLIER 'General case' 0 N--CA 1.43 -1.472 0 O-C-N 120.645 -1.285 . . . . 1.0 112.238 154.3 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -131.46 -57.51 0.09 OUTLIER Glycine 0 N--CA 1.43 -1.74 0 O-C-N 120.165 -1.584 . . . . 1.0 113.544 -174.547 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 48.6 m-20 -111.34 3.63 18.41 Favored 'General case' 0 N--CA 1.43 -1.469 0 C-N-CA 125.724 1.609 . . . . 1.0 109.99 178.535 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -147.91 120.89 8.79 Favored 'General case' 0 N--CA 1.429 -1.522 0 N-CA-C 105.484 -2.043 . . . . 1.0 105.484 -162.038 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 78' ' ' TRP . . . . . . . . . . . . . 71.5 m95 -84.41 124.39 31.27 Favored 'General case' 0 N--CA 1.431 -1.406 0 N-CA-C 104.099 -2.556 . . . . 1.0 104.099 168.435 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 79' ' ' ILE . . . . . 0.404 ' HB ' ' HB2' ' A' ' 85' ' ' GLU . 0.1 OUTLIER -126.01 139.17 52.29 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.474 0 O-C-N 119.92 -1.738 . . . . 1.0 110.304 -166.589 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 79.9 m -78.09 134.79 37.67 Favored 'General case' 0 N--CA 1.429 -1.488 0 O-C-N 119.837 -1.789 . . . . 1.0 113.306 -174.767 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 25.7 t0 -81.86 55.07 2.62 Favored 'General case' 0 N--CA 1.431 -1.413 0 O-C-N 120.145 -1.597 . . . . 1.0 113.532 -174.401 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -149.82 -152.1 0.42 Allowed 'General case' 0 N--CA 1.43 -1.466 0 O-C-N 120.126 -1.609 . . . . 1.0 108.381 -175.7 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 58.2 p -72.62 -19.74 61.4 Favored 'General case' 0 N--CA 1.43 -1.451 0 O-C-N 119.909 -1.745 . . . . 1.0 114.582 -175.216 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -132.36 78.98 0.35 Allowed Glycine 0 N--CA 1.432 -1.628 0 N-CA-C 109.189 -1.564 . . . . 1.0 109.189 -173.93 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 85' ' ' GLU . . . . . 0.404 ' HB2' ' HB ' ' A' ' 79' ' ' ILE . 11.8 pt-20 -73.42 88.38 1.59 Allowed 'General case' 0 N--CA 1.431 -1.411 0 N-CA-C 116.334 1.976 . . . . 1.0 116.334 -174.566 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 24.8 m -166.63 124.52 1.37 Allowed 'General case' 0 N--CA 1.429 -1.498 0 C-N-CA 125.245 1.418 . . . . 1.0 111.485 172.942 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 3.0 t80 -53.63 -81.97 0.01 OUTLIER 'General case' 0 N--CA 1.43 -1.449 0 C-N-CA 127.031 2.133 . . . . 1.0 116.129 176.617 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 88' ' ' TRP . . . . . . . . . . . . . 0.3 OUTLIER -64.38 -35.11 79.83 Favored 'General case' 0 N--CA 1.43 -1.458 0 O-C-N 120.343 -1.473 . . . . 1.0 114.095 -170.344 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -68.01 -33.1 73.96 Favored 'General case' 0 N--CA 1.429 -1.476 0 C-N-CA 125.136 1.374 . . . . 1.0 114.64 175.577 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 52.8 tp -71.78 -44.44 63.99 Favored 'General case' 0 N--CA 1.429 -1.478 0 O-C-N 119.387 -2.071 . . . . 1.0 110.791 173.204 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 8.1 tt -52.54 -43.12 64.98 Favored 'General case' 0 N--CA 1.43 -1.474 0 C-N-CA 126.571 1.948 . . . . 1.0 113.575 170.985 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 4.9 tt0 -53.09 -60.31 3.45 Favored 'General case' 0 N--CA 1.429 -1.488 0 C-N-CA 126.503 1.921 . . . . 1.0 112.548 168.216 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 20.1 tt0 -52.28 -48.26 65.39 Favored 'General case' 0 N--CA 1.431 -1.414 0 C-N-CA 125.032 1.333 . . . . 1.0 114.314 -177.51 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -55.92 -57.53 11.69 Favored 'General case' 0 N--CA 1.429 -1.519 0 C-N-CA 127.961 2.504 . . . . 1.0 116.16 171.246 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -73.79 -37.0 65.1 Favored 'General case' 0 N--CA 1.43 -1.44 0 O-C-N 118.945 -2.347 . . . . 1.0 112.891 -173.964 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 3.1 m -62.35 -40.12 95.36 Favored 'General case' 0 N--CA 1.43 -1.465 0 C-N-CA 125.141 1.376 . . . . 1.0 112.533 170.8 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 3.0 pt20 -67.59 -30.85 70.56 Favored 'General case' 0 N--CA 1.429 -1.502 0 O-C-N 120.424 -1.422 . . . . 1.0 113.989 178.05 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 15.9 mm-40 -74.07 -47.43 36.62 Favored 'General case' 0 N--CA 1.43 -1.469 0 N-CA-C 114.816 1.413 . . . . 1.0 114.816 168.729 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -72.19 -42.45 65.8 Favored 'General case' 0 N--CA 1.429 -1.502 0 N-CA-C 115.933 1.827 . . . . 1.0 115.933 -176.502 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . 92.31 29.07 11.7 Favored Glycine 0 N--CA 1.43 -1.766 0 C-N-CA 125.078 1.323 . . . . 1.0 113.159 -177.442 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 11.9 pt-20 -167.95 171.65 9.58 Favored 'General case' 0 N--CA 1.43 -1.432 0 O-C-N 121.514 -0.992 . . . . 1.0 110.372 -170.256 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 16.5 m -67.48 121.46 15.86 Favored 'General case' 0 N--CA 1.43 -1.433 0 O-C-N 120.827 -1.171 . . . . 1.0 111.144 176.531 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 9.8 p -98.39 160.42 3.15 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.492 0 C-N-CA 125.107 1.363 . . . . 1.0 107.984 -178.799 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 11.5 t -109.08 107.51 17.85 Favored 'General case' 0 N--CA 1.429 -1.513 0 O-C-N 121.025 -1.047 . . . . 1.0 112.875 -165.706 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 34.5 p90 -138.95 -37.54 0.52 Allowed 'General case' 0 N--CA 1.431 -1.398 0 O-C-N 120.515 -1.365 . . . . 1.0 113.056 -172.232 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 4.9 mtm180 . . . . . 0 C--O 1.259 1.595 0 C-N-CA 124.857 1.263 . . . . 1.0 110.034 177.484 . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 51.9 mtt . . . . . 0 CA--C 1.491 -1.293 0 CA-C-O 121.242 0.544 . . . . 1.0 112.282 . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 48.8 m-80 49.59 83.66 0.04 OUTLIER 'General case' 0 N--CA 1.43 -1.46 0 N-CA-C 117.309 2.337 . . . . 1.0 117.309 173.093 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 30.4 t70 -56.26 -49.4 74.3 Favored 'General case' 0 N--CA 1.43 -1.433 0 C-N-CA 125.978 1.711 . . . . 1.0 113.189 -178.225 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 12.9 m -58.95 -38.15 78.38 Favored 'General case' 0 N--CA 1.43 -1.462 0 N-CA-C 114.598 1.333 . . . . 1.0 114.598 -179.812 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 29.0 tt0 -67.67 -54.44 19.52 Favored 'General case' 0 N--CA 1.431 -1.411 0 C-N-CA 125.04 1.336 . . . . 1.0 111.907 176.051 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 1.1 t80 -49.23 -47.79 46.09 Favored 'General case' 0 N--CA 1.431 -1.4 0 C-N-CA 125.93 1.692 . . . . 1.0 113.94 170.182 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 1.0 OUTLIER -57.12 -50.17 73.62 Favored 'General case' 0 N--CA 1.431 -1.392 0 O-C-N 120.239 -1.538 . . . . 1.0 114.231 173.905 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 26.3 ttm-85 -62.24 -47.67 83.38 Favored 'General case' 0 N--CA 1.431 -1.407 0 CA-C-N 119.463 1.028 . . . . 1.0 112.406 -179.376 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 90.6 mt -55.17 -57.53 11.37 Favored 'General case' 0 N--CA 1.429 -1.481 0 C-N-CA 126.534 1.933 . . . . 1.0 112.167 173.172 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -53.52 -47.36 69.99 Favored 'General case' 0 N--CA 1.429 -1.516 0 O-C-N 120.563 -1.335 . . . . 1.0 114.024 178.863 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -61.85 -40.69 96.22 Favored 'General case' 0 N--CA 1.43 -1.437 0 N-CA-C 113.942 1.089 . . . . 1.0 113.942 178.643 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . 0.25 11.6 pt20 -71.87 -38.41 70.04 Favored 'General case' 0 N--CA 1.43 -1.467 0 N-CA-C 114.833 1.42 . . . . 1.0 114.833 175.452 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 82.8 mt -62.13 -50.5 71.66 Favored 'General case' 0 N--CA 1.43 -1.452 0 O-C-N 120.186 -1.572 . . . . 1.0 111.171 174.67 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 0.1 OUTLIER -52.25 -49.97 62.99 Favored 'General case' 0 N--CA 1.43 -1.445 0 C-N-CA 126.079 1.752 . . . . 1.0 111.903 177.264 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 55.2 tp -58.79 -54.01 51.95 Favored 'General case' 0 N--CA 1.431 -1.395 0 C-N-CA 125.441 1.496 . . . . 1.0 113.554 174.413 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 75.0 m -58.68 -57.16 14.22 Favored 'General case' 0 N--CA 1.431 -1.404 0 C-N-CA 124.716 1.207 . . . . 1.0 113.296 178.442 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 29.8 mt -50.74 -52.9 15.25 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.402 0 C-N-CA 125.711 1.604 . . . . 1.0 114.32 176.072 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 29.9 tt0 -57.96 -54.09 50.9 Favored 'General case' 0 N--CA 1.43 -1.429 0 O-C-N 120.709 -1.244 . . . . 1.0 113.639 178.169 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 7.0 tp10 -75.42 -32.45 60.72 Favored 'General case' 0 N--CA 1.431 -1.415 0 N-CA-C 114.838 1.422 . . . . 1.0 114.838 -172.142 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 20.0 tpt180 -75.87 -33.48 59.99 Favored 'General case' 0 N--CA 1.43 -1.434 0 O-C-N 119.943 -1.723 . . . . 1.0 112.981 175.686 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -76.66 -31.83 57.58 Favored 'General case' 0 N--CA 1.43 -1.428 0 O-C-N 120.269 -1.519 . . . . 1.0 110.927 175.659 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 19.7 t70 -58.86 -65.39 0.67 Allowed 'General case' 0 N--CA 1.43 -1.434 0 C-N-CA 125.959 1.704 . . . . 1.0 113.976 168.38 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 32.3 t70 -84.92 112.31 20.45 Favored 'General case' 0 N--CA 1.43 -1.433 0 CA-C-O 123.11 1.433 . . . . 1.0 111.426 178.826 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 24' ' ' TRP . . . . . . . . . . . . . 51.8 t-105 -132.95 -166.1 1.71 Allowed 'General case' 0 N--CA 1.431 -1.412 0 C-N-CA 125.429 1.492 . . . . 1.0 108.108 -174.167 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 5.7 t0 -138.86 85.59 2.09 Favored 'General case' 0 N--CA 1.429 -1.481 0 N-CA-C 106.006 -1.85 . . . . 1.0 106.006 172.211 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -161.12 -159.83 10.29 Favored Glycine 0 N--CA 1.43 -1.74 0 O-C-N 120.428 -1.42 . . . . 1.0 112.916 -173.315 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 9.1 t0 -113.1 -34.59 5.65 Favored 'General case' 0 N--CA 1.431 -1.397 0 C-N-CA 125.387 1.475 . . . . 1.0 111.096 -177.705 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 49.3 m -60.28 149.82 32.26 Favored 'General case' 0 N--CA 1.43 -1.43 0 C-N-CA 125.79 1.636 . . . . 1.0 113.602 178.032 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 2.4 t70 -110.11 151.54 27.11 Favored 'General case' 0 N--CA 1.431 -1.407 0 O-C-N 120.966 -1.084 . . . . 1.0 109.356 174.277 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 50.8 mm -139.83 115.68 8.49 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.426 0 C-N-CA 126.811 2.044 . . . . 1.0 105.487 -161.245 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 41.8 m-20 -119.55 100.65 7.41 Favored 'General case' 0 N--CA 1.432 -1.373 0 CA-C-O 122.126 0.965 . . . . 1.0 109.27 167.51 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 24.7 t -73.95 137.73 43.75 Favored 'General case' 0 N--CA 1.43 -1.446 0 O-C-N 119.372 -2.08 . . . . 1.0 111.363 162.585 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -94.66 149.51 21.17 Favored 'General case' 0 N--CA 1.429 -1.507 0 C-N-CA 126.625 1.97 . . . . 1.0 108.679 179.81 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 3.3 mp -135.51 106.6 6.5 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.439 0 CA-C-O 123.787 1.756 . . . . 1.0 109.278 -171.345 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 4.7 m120 -113.09 172.34 7.0 Favored 'General case' 0 N--CA 1.431 -1.418 0 N-CA-C 106.829 -1.545 . . . . 1.0 106.829 167.109 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -69.75 85.09 0.28 Allowed Glycine 0 N--CA 1.43 -1.729 0 N-CA-C 117.019 1.568 . . . . 1.0 117.019 -168.745 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 94.87 12.47 55.42 Favored Glycine 0 N--CA 1.431 -1.698 0 C-N-CA 126.19 1.853 . . . . 1.0 112.882 -177.27 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 44.9 t -132.28 131.88 60.72 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.452 0 N-CA-C 107.083 -1.451 . . . . 1.0 107.083 -175.6 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 68.5 mt -121.77 137.94 54.56 Favored 'General case' 0 N--CA 1.43 -1.436 0 O-C-N 120.698 -1.251 . . . . 1.0 109.558 174.187 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -128.68 107.18 9.47 Favored 'General case' 0 N--CA 1.432 -1.372 0 N-CA-C 107.193 -1.41 . . . . 1.0 107.193 -174.654 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 42.6 mt -89.55 122.67 41.15 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.451 0 O-C-N 119.456 -2.027 . . . . 1.0 109.355 -167.397 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 27.2 p -123.9 135.01 53.43 Favored 'General case' 0 N--CA 1.43 -1.465 0 CA-C-O 122.114 0.959 . . . . 1.0 113.389 -179.741 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 43' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -121.41 171.74 8.55 Favored 'General case' 0 N--CA 1.43 -1.459 0 O-C-N 120.444 -1.41 . . . . 1.0 111.534 173.406 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 14.7 mm-40 -52.12 -32.69 36.51 Favored 'General case' 0 N--CA 1.43 -1.446 0 N-CA-C 118.495 2.776 . . . . 1.0 118.495 -169.694 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 31.5 t30 -66.05 -12.41 55.11 Favored 'General case' 0 N--CA 1.432 -1.367 0 N-CA-C 114.783 1.401 . . . . 1.0 114.783 175.712 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 90.04 17.27 54.18 Favored Glycine 0 N--CA 1.43 -1.718 0 O-C-N 120.14 -1.6 . . . . 1.0 111.528 -179.485 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 73.4 m -91.72 157.8 16.72 Favored 'General case' 0 N--CA 1.429 -1.486 0 C-N-CA 126.019 1.728 . . . . 1.0 110.907 -174.074 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 5.2 ptmm? -149.21 121.47 8.39 Favored 'General case' 0 N--CA 1.431 -1.381 0 N-CA-C 114.089 1.144 . . . . 1.0 114.089 -151.211 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 1.7 mm -116.1 134.91 57.98 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.491 0 N-CA-C 107.012 -1.477 . . . . 1.0 107.012 176.415 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 3.5 tp -125.13 119.67 56.3 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.504 0 CA-C-N 121.887 2.13 . . . . 1.0 110.543 -179.969 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 3.9 mt -130.57 125.83 59.61 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.394 0 CA-C-O 123.588 1.661 . . . . 1.0 113.098 -167.728 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 8.4 t30 -161.8 175.73 11.62 Favored 'General case' 0 N--CA 1.43 -1.445 0 N-CA-C 105.661 -1.977 . . . . 1.0 105.661 -171.302 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 1.4 ptp85 -108.86 153.97 22.77 Favored 'General case' 0 N--CA 1.43 -1.471 0 O-C-N 120.04 -1.663 . . . . 1.0 111.966 -173.444 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 15.7 mm100 -103.92 86.05 2.52 Favored 'General case' 0 N--CA 1.43 -1.429 0 C-N-CA 125.0 1.32 . . . . 1.0 108.187 173.209 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . 0.281 28.6 tt0 -61.43 -39.34 61.38 Favored Pre-proline 0 N--CA 1.43 -1.46 0 N-CA-C 118.923 2.934 . . . . 1.0 118.923 -161.682 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 77.0 Cg_exo -64.62 -7.71 15.33 Favored 'Trans proline' 0 C--N 1.298 -2.086 0 CA-C-N 126.474 3.348 . . . . 1.0 117.198 -178.447 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 57' ' ' LEU . . . . . 0.503 HD12 HE22 ' A' ' 59' ' ' GLN . 61.4 mt -117.75 -113.08 0.34 Allowed 'General case' 0 N--CA 1.43 -1.437 0 CA-C-N 120.115 1.325 . . . . 1.0 110.395 173.972 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 3.3 t-80 -146.53 -30.23 0.37 Allowed 'General case' 0 N--CA 1.431 -1.411 0 C-N-CA 124.784 1.234 . . . . 1.0 111.484 -168.221 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 59' ' ' GLN . . . . . 0.503 HE22 HD12 ' A' ' 57' ' ' LEU . 16.5 pm0 -80.88 152.58 28.06 Favored 'General case' 0 N--CA 1.431 -1.409 0 CA-C-O 124.977 2.323 . . . . 1.0 116.845 -169.967 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 59.5 t -91.29 147.29 5.35 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.469 0 CA-C-N 113.008 -1.905 . . . . 1.0 108.096 171.615 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 61' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -106.8 148.06 28.94 Favored 'General case' 0 N--CA 1.43 -1.462 0 O-C-N 120.139 -1.601 . . . . 1.0 107.972 175.681 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 2.4 pt? -146.49 115.93 7.11 Favored 'General case' 0 N--CA 1.428 -1.536 0 CA-C-O 123.248 1.499 . . . . 1.0 111.122 166.019 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 63' ' ' ALA . . . . . 0.415 ' HA ' ' HA2' ' A' ' 68' ' ' GLY . . . -100.29 140.27 34.78 Favored 'General case' 0 N--CA 1.431 -1.39 0 CA-C-O 123.255 1.502 . . . . 1.0 113.779 172.644 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 64' ' ' THR . . . . . . . . . . . . . 9.0 t -151.86 -167.15 2.7 Favored 'General case' 0 N--CA 1.431 -1.421 0 C-N-CA 126.364 1.866 . . . . 1.0 107.318 -169.137 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 33.1 tptt -69.49 -29.96 67.73 Favored 'General case' 0 N--CA 1.43 -1.466 0 N-CA-C 116.286 1.958 . . . . 1.0 116.286 -165.847 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 11.1 tt0 -77.7 -13.3 59.94 Favored 'General case' 0 N--CA 1.429 -1.485 0 O-C-N 120.208 -1.557 . . . . 1.0 113.874 176.079 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 146.67 -56.42 0.51 Allowed Glycine 0 N--CA 1.43 -1.748 0 O-C-N 119.529 -1.982 . . . . 1.0 112.133 174.123 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 68' ' ' GLY . . . . . 0.415 ' HA2' ' HA ' ' A' ' 63' ' ' ALA . . . 123.67 124.44 2.9 Favored Glycine 0 N--CA 1.43 -1.714 0 O-C-N 121.723 -0.869 . . . . 1.0 115.002 -176.704 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 19.6 m-30 -120.56 170.16 9.67 Favored 'General case' 0 N--CA 1.43 -1.442 0 C-N-CA 125.727 1.611 . . . . 1.0 107.392 -177.227 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 28.4 p80 -114.54 159.34 20.51 Favored 'General case' 0 N--CA 1.43 -1.434 0 O-C-N 119.796 -1.815 . . . . 1.0 111.905 170.221 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 71' ' ' PHE . . . . . . . . . . . . 0.259 20.0 t80 -118.48 113.27 21.08 Favored 'General case' 0 N--CA 1.432 -1.361 0 C-N-CA 127.291 2.236 . . . . 1.0 108.587 -160.607 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -128.58 166.45 18.83 Favored 'General case' 0 N--CA 1.429 -1.49 0 C-N-CA 124.713 1.205 . . . . 1.0 108.689 -170.371 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -112.35 121.31 44.5 Favored 'General case' 0 N--CA 1.43 -1.447 0 O-C-N 119.02 -2.3 . . . . 1.0 112.865 -163.633 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 12.1 mmtm -110.97 79.64 1.22 Allowed 'General case' 0 N--CA 1.431 -1.399 0 O-C-N 120.057 -1.652 . . . . 1.0 110.143 167.572 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . 72.36 -79.92 0.64 Allowed Glycine 0 N--CA 1.431 -1.675 0 C-N-CA 125.668 1.604 . . . . 1.0 115.93 173.452 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -116.75 -7.49 11.49 Favored 'General case' 0 N--CA 1.429 -1.504 0 C-N-CA 125.233 1.413 . . . . 1.0 110.862 -178.739 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 53.9 mt-10 -131.16 125.47 33.11 Favored 'General case' 0 N--CA 1.43 -1.469 0 N-CA-C 105.537 -2.023 . . . . 1.0 105.537 -171.687 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 78' ' ' TRP . . . . . 0.411 ' HB2' ' HB3' ' A' ' 87' ' ' PHE . 71.3 m95 -82.82 111.51 18.8 Favored 'General case' 0 N--CA 1.43 -1.428 0 N-CA-C 107.391 -1.337 . . . . 1.0 107.391 174.472 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 8.6 mt -90.21 124.85 43.04 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.433 0 CA-C-O 124.032 1.872 . . . . 1.0 107.437 178.373 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 80' ' ' CYS . . . . . 0.409 ' HB2' ' HB2' ' A' ' 85' ' ' GLU . 38.5 m -76.96 121.36 23.36 Favored 'General case' 0 N--CA 1.429 -1.496 0 CA-C-N 113.971 -1.468 . . . . 1.0 108.7 177.935 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 11.8 t70 -71.75 -41.62 68.23 Favored 'General case' 0 N--CA 1.429 -1.51 0 N-CA-C 114.634 1.346 . . . . 1.0 114.634 -154.223 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 24.1 mmt85 -70.94 129.63 39.52 Favored 'General case' 0 N--CA 1.43 -1.46 0 O-C-N 121.195 -0.941 . . . . 1.0 109.057 173.545 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 83' ' ' SER . . . . . . . . . . . . 0.257 29.6 t 69.8 -71.09 0.13 Allowed 'General case' 0 N--CA 1.43 -1.446 0 C-N-CA 125.91 1.684 . . . . 1.0 112.21 -159.482 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 120.85 68.09 0.27 Allowed Glycine 0 N--CA 1.431 -1.663 0 N-CA-C 108.066 -2.013 . . . . 1.0 108.066 -168.467 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 85' ' ' GLU . . . . . 0.409 ' HB2' ' HB2' ' A' ' 80' ' ' CYS . 60.1 mm-40 -113.83 -145.48 0.4 Allowed 'General case' 0 N--CA 1.429 -1.477 0 C-N-CA 124.737 1.215 . . . . 1.0 108.306 -171.252 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 93.2 m -150.57 133.99 16.38 Favored 'General case' 0 N--CA 1.43 -1.474 0 O-C-N 119.561 -1.962 . . . . 1.0 108.945 -160.685 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 87' ' ' PHE . . . . . 0.411 ' HB3' ' HB2' ' A' ' 78' ' ' TRP 0.278 0.0 OUTLIER -39.91 -85.95 0.0 OUTLIER 'General case' 0 N--CA 1.43 -1.447 0 N-CA-C 120.373 3.471 . . . . 1.0 120.373 179.923 . . . . . . . . 4 4 . 1 . 012 nuclear build full ' A' A ' 88' ' ' TRP . . . . . . . . . . . . . 65.9 m95 -68.85 -29.62 67.97 Favored 'General case' 0 N--CA 1.43 -1.433 0 O-C-N 120.682 -1.261 . . . . 1.0 113.321 -172.956 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 24.0 m-20 -71.31 -38.81 71.73 Favored 'General case' 0 N--CA 1.429 -1.485 0 O-C-N 120.987 -1.071 . . . . 1.0 113.607 175.87 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 45.3 tp -69.06 -44.07 73.35 Favored 'General case' 0 N--CA 1.43 -1.447 0 O-C-N 119.817 -1.802 . . . . 1.0 110.658 175.987 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 10.2 tt -49.14 -50.55 37.0 Favored 'General case' 0 N--CA 1.43 -1.429 0 C-N-CA 126.494 1.917 . . . . 1.0 113.371 172.272 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 37.4 tt0 -54.97 -57.93 9.68 Favored 'General case' 0 N--CA 1.431 -1.41 0 C-N-CA 126.706 2.002 . . . . 1.0 113.133 171.694 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 30.4 tt0 -50.58 -48.27 57.65 Favored 'General case' 0 CA--C 1.488 -1.414 0 C-N-CA 127.337 2.255 . . . . 1.0 114.595 178.364 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -65.85 -45.96 80.25 Favored 'General case' 0 N--CA 1.431 -1.421 0 C-N-CA 127.39 2.276 . . . . 1.0 114.377 174.919 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -63.19 -43.87 96.98 Favored 'General case' 0 N--CA 1.43 -1.46 0 O-C-N 120.03 -1.669 . . . . 1.0 112.97 177.453 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 15.5 m -55.46 -43.41 75.43 Favored 'General case' 0 N--CA 1.43 -1.472 0 C-N-CA 126.17 1.788 . . . . 1.0 114.087 170.017 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 2.2 pt20 -72.41 -28.55 63.05 Favored 'General case' 0 N--CA 1.43 -1.439 0 N-CA-C 114.893 1.442 . . . . 1.0 114.893 177.154 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 14.3 mm-40 -66.91 -57.37 7.09 Favored 'General case' 0 N--CA 1.43 -1.47 0 O-C-N 120.906 -1.122 . . . . 1.0 111.992 171.235 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -80.02 -46.21 17.01 Favored 'General case' 0 N--CA 1.43 -1.448 0 N-CA-C 115.723 1.749 . . . . 1.0 115.723 -172.323 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . 87.6 49.52 3.86 Favored Glycine 0 N--CA 1.43 -1.721 0 O-C-N 120.935 -1.103 . . . . 1.0 112.048 -168.37 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 19.3 tt0 -164.81 159.53 18.59 Favored 'General case' 0 N--CA 1.429 -1.513 0 N-CA-C 106.252 -1.759 . . . . 1.0 106.252 -176.268 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 45.9 m -72.16 99.09 2.26 Favored 'General case' 0 N--CA 1.431 -1.406 0 O-C-N 119.554 -1.966 . . . . 1.0 110.681 166.227 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 46.2 t -110.51 112.7 41.71 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.433 0 N-CA-C 105.643 -1.984 . . . . 1.0 105.643 178.066 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 7.5 t -141.42 176.44 8.86 Favored 'General case' 0 N--CA 1.431 -1.413 0 O-C-N 121.328 -0.857 . . . . 1.0 109.591 -171.043 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 5.7 m-85 -111.69 -14.99 13.53 Favored 'General case' 0 N--CA 1.43 -1.439 0 C-N-CA 125.147 1.379 . . . . 1.0 110.288 174.418 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 37.1 mmt180 . . . . . 0 C--O 1.26 1.649 0 O-C-N 120.619 -1.301 . . . . 1.0 111.554 -176.87 . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 46.8 ttp . . . . . 0 CA--C 1.489 -1.394 0 CA-C-O 121.079 0.466 . . . . 1.0 111.878 . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 1.4 t-20 -106.7 -172.25 2.05 Favored 'General case' 0 N--CA 1.43 -1.426 0 O-C-N 120.294 -1.504 . . . . 1.0 113.251 -166.024 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . 0.266 1.3 p-10 -61.54 -48.9 78.93 Favored 'General case' 0 N--CA 1.431 -1.395 0 N-CA-C 116.153 1.908 . . . . 1.0 116.153 -164.752 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 63.2 p -61.97 -37.53 85.11 Favored 'General case' 0 N--CA 1.43 -1.44 0 C-N-CA 124.855 1.262 . . . . 1.0 113.04 179.146 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 28.9 mt-10 -69.85 -49.61 50.72 Favored 'General case' 0 N--CA 1.43 -1.435 0 C-N-CA 126.501 1.92 . . . . 1.0 112.102 179.725 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 2.3 m-85 -60.14 -38.6 83.6 Favored 'General case' 0 N--CA 1.431 -1.392 0 C-N-CA 124.177 0.991 . . . . 1.0 112.93 172.815 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 25.2 t60 -65.76 -48.38 72.02 Favored 'General case' 0 N--CA 1.43 -1.459 0 C-N-CA 125.744 1.618 . . . . 1.0 111.792 177.684 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 41.8 ttp-105 -56.03 -57.04 13.81 Favored 'General case' 0 N--CA 1.431 -1.425 0 C-N-CA 124.808 1.243 . . . . 1.0 112.888 177.708 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 36.9 mt -57.74 -42.06 83.12 Favored 'General case' 0 N--CA 1.431 -1.412 0 C-N-CA 124.212 1.005 . . . . 1.0 113.235 178.147 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -57.23 -57.96 10.32 Favored 'General case' 0 N--CA 1.431 -1.376 0 C-N-CA 124.3 1.04 . . . . 1.0 113.123 173.006 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 14.6 t70 -54.43 -45.75 73.07 Favored 'General case' 0 CA--C 1.489 -1.396 0 C-N-CA 125.613 1.565 . . . . 1.0 113.877 -177.005 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 18.4 mt-30 -57.23 -55.2 37.88 Favored 'General case' 0 N--CA 1.431 -1.424 0 N-CA-C 115.194 1.553 . . . . 1.0 115.194 170.694 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 3.1 pp -70.9 -37.04 72.96 Favored 'General case' 0 N--CA 1.43 -1.463 0 O-C-N 119.738 -1.851 . . . . 1.0 115.789 -178.113 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 0.8 OUTLIER -43.91 -60.15 1.96 Allowed 'General case' 0 N--CA 1.429 -1.489 0 C-N-CA 128.155 2.582 . . . . 1.0 112.425 165.859 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 50.7 tp -62.01 -42.72 99.46 Favored 'General case' 0 N--CA 1.429 -1.478 0 C-N-CA 124.299 1.04 . . . . 1.0 113.611 178.396 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 87.4 m -55.44 -52.07 64.8 Favored 'General case' 0 N--CA 1.431 -1.41 0 C-N-CA 125.609 1.564 . . . . 1.0 112.986 176.61 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 78.0 mt -58.78 -52.26 62.26 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.462 0 C-N-CA 125.825 1.65 . . . . 1.0 112.27 175.71 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 2.1 tt0 -56.2 -49.93 72.66 Favored 'General case' 0 N--CA 1.43 -1.432 0 N-CA-C 114.194 1.183 . . . . 1.0 114.194 -177.729 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 34.1 tt0 -65.32 -48.54 72.72 Favored 'General case' 0 N--CA 1.43 -1.436 0 O-C-N 120.928 -1.108 . . . . 1.0 113.637 178.361 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 7.9 tpt180 -61.8 -49.83 74.76 Favored 'General case' 0 N--CA 1.43 -1.454 0 C-N-CA 124.045 0.938 . . . . 1.0 112.647 -176.843 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 11.2 mp -72.62 -30.2 64.13 Favored 'General case' 0 N--CA 1.43 -1.45 0 C-N-CA 124.494 1.118 . . . . 1.0 113.733 -177.756 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 7.9 t70 -66.48 -51.97 51.08 Favored 'General case' 0 N--CA 1.429 -1.509 0 O-C-N 120.371 -1.455 . . . . 1.0 113.506 171.356 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 2.0 t70 -69.82 -24.35 63.45 Favored 'General case' 0 N--CA 1.429 -1.494 0 O-C-N 120.15 -1.594 . . . . 1.0 113.597 -176.525 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 24' ' ' TRP . . . . . . . . . . . . . 59.3 t-105 -45.9 -54.01 8.9 Favored 'General case' 0 N--CA 1.429 -1.492 0 C-N-CA 128.201 2.6 . . . . 1.0 116.989 178.366 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 28.6 t0 66.27 173.6 0.24 Allowed 'General case' 0 N--CA 1.429 -1.492 0 C-N-CA 127.033 2.133 . . . . 1.0 112.884 -175.406 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -168.3 -151.83 7.31 Favored Glycine 0 N--CA 1.429 -1.801 0 O-C-N 119.053 -2.279 . . . . 1.0 112.574 -172.599 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 36.7 t70 -83.45 -47.23 11.61 Favored 'General case' 0 N--CA 1.43 -1.427 0 N-CA-C 107.697 -1.223 . . . . 1.0 107.697 161.736 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 83.2 p -87.62 167.61 13.75 Favored 'General case' 0 N--CA 1.429 -1.506 0 C-N-CA 124.807 1.243 . . . . 1.0 110.988 173.566 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 29' ' ' ASP . . . . . 0.457 ' H ' ' HG2' ' A' ' 44' ' ' GLU . 2.9 t70 -110.09 179.21 4.17 Favored 'General case' 0 N--CA 1.43 -1.453 0 O-C-N 120.763 -1.211 . . . . 1.0 109.583 -173.016 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -157.61 129.24 0.95 Allowed 'Isoleucine or valine' 0 N--CA 1.43 -1.46 0 CA-C-O 123.117 1.437 . . . . 1.0 108.933 -161.874 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 26.7 m-20 -132.72 105.31 7.1 Favored 'General case' 0 N--CA 1.429 -1.489 0 C-N-CA 126.707 2.003 . . . . 1.0 110.343 170.041 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 10.4 t -85.23 142.44 29.41 Favored 'General case' 0 N--CA 1.43 -1.469 0 O-C-N 118.92 -2.362 . . . . 1.0 110.809 170.811 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 2.2 tp10 -113.5 137.88 50.92 Favored 'General case' 0 N--CA 1.428 -1.546 0 C-N-CA 124.13 0.972 . . . . 1.0 109.9 178.708 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 5.1 tp -117.44 121.03 66.63 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.428 0 C-N-CA 126.516 1.926 . . . . 1.0 107.079 178.759 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 32.0 m120 -124.77 -176.33 3.51 Favored 'General case' 0 N--CA 1.43 -1.45 0 C-N-CA 126.1 1.76 . . . . 1.0 108.52 168.31 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -65.52 91.08 0.13 Allowed Glycine 0 N--CA 1.43 -1.703 0 O-C-N 120.105 -1.622 . . . . 1.0 116.047 -171.0 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 85.65 2.93 86.62 Favored Glycine 0 N--CA 1.429 -1.815 0 C-N-CA 125.115 1.341 . . . . 1.0 113.898 -176.258 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 33.4 t -124.53 125.38 70.07 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.449 0 C-N-CA 124.045 0.938 . . . . 1.0 109.983 -168.88 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 27.7 mt -115.73 130.63 56.92 Favored 'General case' 0 N--CA 1.43 -1.462 0 CA-C-O 122.623 1.202 . . . . 1.0 108.239 165.242 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 5.2 p -120.87 119.44 32.67 Favored 'General case' 0 N--CA 1.429 -1.482 0 N-CA-C 106.995 -1.483 . . . . 1.0 106.995 170.773 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 33.5 mt -92.82 113.09 27.19 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.455 0 N-CA-C 106.8 -1.556 . . . . 1.0 106.8 -177.203 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -99.35 128.04 45.43 Favored 'General case' 0 N--CA 1.43 -1.464 0 N-CA-C 108.434 -0.95 . . . . 1.0 108.434 -175.979 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 43' ' ' PHE . . . . . . . . . . . . . 5.4 p90 -116.14 151.06 36.38 Favored 'General case' 0 N--CA 1.43 -1.435 0 N-CA-C 107.394 -1.336 . . . . 1.0 107.394 171.386 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 44' ' ' GLU . . . . . 0.457 ' HG2' ' H ' ' A' ' 29' ' ' ASP . 0.2 OUTLIER -71.18 -13.42 61.92 Favored 'General case' 0 N--CA 1.43 -1.444 0 N-CA-C 116.334 1.976 . . . . 1.0 116.334 -153.986 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 19.7 t-20 -64.95 -19.56 66.02 Favored 'General case' 0 N--CA 1.43 -1.447 0 C-N-CA 127.457 2.303 . . . . 1.0 113.219 172.909 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 102.32 13.81 29.85 Favored Glycine 0 N--CA 1.429 -1.796 0 O-C-N 120.37 -1.456 . . . . 1.0 114.186 170.145 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 3.5 m -112.3 174.02 6.08 Favored 'General case' 0 N--CA 1.43 -1.458 0 C-N-CA 124.473 1.109 . . . . 1.0 109.036 172.083 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 20.9 pttm -156.9 148.92 22.85 Favored 'General case' 0 N--CA 1.431 -1.393 0 O-C-N 120.938 -1.101 . . . . 1.0 113.378 -160.863 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 49' ' ' ILE . . . . . 0.415 HD13 HG23 ' A' ' 64' ' ' THR . 7.5 mm -97.13 138.44 22.07 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.454 0 N-CA-C 106.355 -1.72 . . . . 1.0 106.355 171.171 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 4.1 mm -122.77 115.89 47.21 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.473 0 CA-C-N 119.598 1.09 . . . . 1.0 110.233 -175.953 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 2.1 mt -129.4 126.22 63.19 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.501 0 O-C-N 120.536 -1.352 . . . . 1.0 110.61 176.868 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 52' ' ' ASN . . . . . 0.55 ' H ' ' HD1' ' A' ' 61' ' ' TRP . 15.1 p30 -151.2 165.47 33.82 Favored 'General case' 0 N--CA 1.429 -1.509 0 CA-C-O 122.971 1.367 . . . . 1.0 108.592 176.923 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 40.1 ptt85 -148.78 152.44 36.55 Favored 'General case' 0 N--CA 1.431 -1.41 0 CA-C-N 114.474 -1.239 . . . . 1.0 108.877 -172.67 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 68.8 mm-40 -116.4 107.99 15.48 Favored 'General case' 0 N--CA 1.429 -1.478 0 N-CA-C 107.026 -1.472 . . . . 1.0 107.026 171.46 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 15.5 tt0 -58.95 -41.61 89.45 Favored Pre-proline 0 N--CA 1.43 -1.435 0 N-CA-C 116.112 1.893 . . . . 1.0 116.112 -172.504 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 83.7 Cg_exo -69.25 -18.49 39.39 Favored 'Trans proline' 0 N--CA 1.433 -2.052 0 CA-C-N 126.173 3.24 . . . . 1.0 117.79 178.185 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . 0.381 3.9 pp -96.72 -14.41 22.05 Favored 'General case' 0 N--CA 1.431 -1.414 0 N-CA-C 116.744 2.127 . . . . 1.0 116.744 -170.766 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 5.9 m170 73.23 52.96 0.13 Allowed 'General case' 0 N--CA 1.43 -1.436 0 C-N-CA 125.003 1.321 . . . . 1.0 114.536 174.095 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 34.0 tt0 -162.05 158.26 24.66 Favored 'General case' 0 N--CA 1.43 -1.438 0 C-N-CA 124.515 1.126 . . . . 1.0 108.079 172.45 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 55.0 t -119.38 152.76 21.87 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.48 0 C-N-CA 126.106 1.762 . . . . 1.0 110.408 178.997 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 61' ' ' TRP . . . . . 0.55 ' HD1' ' H ' ' A' ' 52' ' ' ASN . 0.0 OUTLIER -104.84 152.59 22.42 Favored 'General case' 0 N--CA 1.43 -1.448 0 C-N-CA 125.463 1.505 . . . . 1.0 109.471 176.026 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -145.12 97.02 2.94 Favored 'General case' 0 N--CA 1.431 -1.401 0 O-C-N 120.804 -1.185 . . . . 1.0 110.548 -176.874 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -122.6 149.18 44.33 Favored 'General case' 0 N--CA 1.431 -1.416 0 O-C-N 119.708 -1.87 . . . . 1.0 115.993 179.508 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 64' ' ' THR . . . . . 0.415 HG23 HD13 ' A' ' 49' ' ' ILE . 5.9 m -151.24 -94.69 0.06 Allowed 'General case' 0 N--CA 1.429 -1.482 0 C-N-CA 125.504 1.522 . . . . 1.0 111.269 175.041 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 10.7 tmtt? -99.59 -44.26 6.2 Favored 'General case' 0 N--CA 1.43 -1.448 0 C-N-CA 125.217 1.407 . . . . 1.0 110.387 -172.555 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 33.3 mm-40 -70.33 -23.57 62.85 Favored 'General case' 0 N--CA 1.43 -1.469 0 N-CA-C 113.831 1.048 . . . . 1.0 113.831 -174.403 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 136.75 -39.62 1.62 Allowed Glycine 0 N--CA 1.43 -1.757 0 O-C-N 121.398 -0.814 . . . . 1.0 111.9 166.774 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 140.95 123.86 1.99 Allowed Glycine 0 N--CA 1.43 -1.718 0 CA-C-O 122.279 0.933 . . . . 1.0 113.434 -179.842 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 21.5 m-30 -115.55 170.09 8.68 Favored 'General case' 0 N--CA 1.431 -1.424 0 C-N-CA 126.383 1.873 . . . . 1.0 107.189 176.744 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -115.29 161.02 19.07 Favored 'General case' 0 N--CA 1.43 -1.451 0 O-C-N 120.366 -1.459 . . . . 1.0 110.032 168.2 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 71' ' ' PHE . . . . . . . . . . . . 0.279 28.7 t80 -140.1 126.16 19.75 Favored 'General case' 0 N--CA 1.431 -1.413 0 C-N-CA 123.836 0.854 . . . . 1.0 109.889 -151.437 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 35.0 m-20 -136.73 156.51 48.42 Favored 'General case' 0 N--CA 1.43 -1.453 0 CA-C-O 121.994 0.902 . . . . 1.0 111.48 179.401 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 67.9 tp -84.69 136.72 33.61 Favored 'General case' 0 N--CA 1.43 -1.454 0 O-C-N 120.411 -1.431 . . . . 1.0 111.757 173.007 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 72.4 mmtt -89.19 -86.17 0.19 Allowed 'General case' 0 N--CA 1.43 -1.455 0 C-N-CA 124.868 1.267 . . . . 1.0 110.282 161.907 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -138.09 -55.31 0.05 OUTLIER Glycine 0 N--CA 1.428 -1.856 0 O-C-N 120.723 -1.235 . . . . 1.0 112.732 175.451 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 78.7 m-20 -97.2 -20.15 18.12 Favored 'General case' 0 N--CA 1.43 -1.467 0 C-N-CA 124.663 1.185 . . . . 1.0 110.755 173.742 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 26.6 tt0 -133.98 121.33 21.47 Favored 'General case' 0 N--CA 1.43 -1.441 0 N-CA-C 107.168 -1.419 . . . . 1.0 107.168 -151.673 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 78' ' ' TRP . . . . . . . . . . . . . 48.7 m95 -83.72 107.14 15.96 Favored 'General case' 0 N--CA 1.431 -1.403 0 N-CA-C 106.626 -1.62 . . . . 1.0 106.626 167.251 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER -93.2 154.28 3.25 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.467 0 CA-C-O 123.425 1.583 . . . . 1.0 107.142 178.885 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 59.2 m -84.08 125.59 32.26 Favored 'General case' 0 N--CA 1.431 -1.422 0 O-C-N 120.65 -1.281 . . . . 1.0 108.153 173.191 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 38.5 t70 -69.57 -53.77 17.29 Favored 'General case' 0 N--CA 1.43 -1.46 0 C-N-CA 126.38 1.872 . . . . 1.0 110.621 -173.551 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -76.46 137.23 39.56 Favored 'General case' 0 N--CA 1.428 -1.535 0 C-N-CA 125.961 1.704 . . . . 1.0 108.515 177.655 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 48.9 m 73.11 -59.63 0.56 Allowed 'General case' 0 N--CA 1.429 -1.52 0 C-N-CA 125.966 1.707 . . . . 1.0 113.161 -170.846 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 112.09 92.28 2.05 Favored Glycine 0 N--CA 1.429 -1.767 0 N-CA-C 109.008 -1.637 . . . . 1.0 109.008 -177.522 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -153.22 -154.04 0.51 Allowed 'General case' 0 N--CA 1.429 -1.485 0 CA-C-N 118.67 1.235 . . . . 1.0 109.513 -170.409 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 51.7 m -150.38 131.57 14.48 Favored 'General case' 0 N--CA 1.429 -1.489 0 O-C-N 120.671 -1.268 . . . . 1.0 109.501 -157.451 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . 0.26 0.0 OUTLIER -36.53 -91.63 0.0 OUTLIER 'General case' 0 N--CA 1.43 -1.462 0 N-CA-C 121.45 3.87 . . . . 1.0 121.45 178.827 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 88' ' ' TRP . . . . . . . . . . . . . 91.6 m95 -63.68 -27.87 69.52 Favored 'General case' 0 N--CA 1.429 -1.509 0 O-C-N 120.009 -1.682 . . . . 1.0 113.146 -173.198 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 3.2 t70 -68.9 -44.25 73.59 Favored 'General case' 0 N--CA 1.431 -1.41 0 C-N-CA 126.125 1.77 . . . . 1.0 112.601 175.857 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 45.1 tp -66.05 -45.15 82.42 Favored 'General case' 0 N--CA 1.43 -1.469 0 O-C-N 120.44 -1.413 . . . . 1.0 111.037 177.57 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 26.3 tp -55.92 -43.14 77.07 Favored 'General case' 0 N--CA 1.43 -1.475 0 C-N-CA 124.528 1.131 . . . . 1.0 113.472 175.868 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 34.6 tt0 -60.53 -47.49 85.93 Favored 'General case' 0 N--CA 1.431 -1.412 0 C-N-CA 126.254 1.821 . . . . 1.0 112.889 173.036 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 24.0 tt0 -59.18 -54.32 48.23 Favored 'General case' 0 N--CA 1.429 -1.48 0 C-N-CA 126.652 1.981 . . . . 1.0 113.45 177.538 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -54.05 -41.89 68.61 Favored 'General case' 0 N--CA 1.429 -1.48 0 C-N-CA 127.972 2.509 . . . . 1.0 114.264 175.328 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -73.94 -51.72 15.17 Favored 'General case' 0 N--CA 1.43 -1.436 0 N-CA-C 114.781 1.4 . . . . 1.0 114.781 178.546 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 1.6 t -61.16 -26.35 67.64 Favored 'General case' 0 N--CA 1.43 -1.464 0 O-C-N 119.236 -2.165 . . . . 1.0 114.1 175.809 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 7.5 tp-100 -62.65 -70.0 0.23 Allowed 'General case' 0 N--CA 1.43 -1.453 0 C-N-CA 126.31 1.844 . . . . 1.0 112.431 168.139 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 18.4 mt-30 -76.98 -48.31 18.37 Favored 'General case' 0 N--CA 1.43 -1.434 0 N-CA-C 116.411 2.004 . . . . 1.0 116.411 -175.369 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -73.5 -36.5 65.77 Favored 'General case' 0 N--CA 1.431 -1.414 0 O-C-N 120.059 -1.651 . . . . 1.0 112.067 -177.464 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . 93.1 28.3 12.08 Favored Glycine 0 N--CA 1.43 -1.719 0 C-N-CA 123.927 0.775 . . . . 1.0 113.956 171.981 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 27.7 mt-10 -145.91 168.92 19.67 Favored 'General case' 0 N--CA 1.431 -1.421 0 O-C-N 121.821 -0.811 . . . . 1.0 111.401 -172.749 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 6.8 m -78.91 78.92 5.33 Favored 'General case' 0 N--CA 1.431 -1.399 0 CA-C-O 122.792 1.282 . . . . 1.0 110.61 173.554 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 47.4 t -93.05 93.36 4.13 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.436 0 C-N-CA 126.687 1.995 . . . . 1.0 106.73 174.571 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 7.9 t -140.47 166.37 24.89 Favored 'General case' 0 N--CA 1.429 -1.48 0 CA-C-N 115.324 -0.853 . . . . 1.0 110.609 -175.367 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -120.3 -12.79 8.97 Favored 'General case' 0 N--CA 1.43 -1.444 0 C-N-CA 125.061 1.345 . . . . 1.0 109.714 175.935 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 75.6 mtm180 . . . . . 0 C--O 1.26 1.617 0 O-C-N 120.519 -1.363 . . . . 1.0 111.839 -174.174 . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 90.6 mtp . . . . . 0 CA--C 1.489 -1.377 0 N-CA-C 113.189 0.811 . . . . 1.0 113.189 . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 7.3 m120 -59.18 -45.61 90.6 Favored 'General case' 0 N--CA 1.429 -1.481 0 C-N-CA 127.495 2.318 . . . . 1.0 114.117 -178.034 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 3.1 m-20 -59.33 -54.42 47.0 Favored 'General case' 0 N--CA 1.431 -1.391 0 C-N-CA 125.612 1.565 . . . . 1.0 111.656 176.581 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 23.1 t -57.7 -45.21 85.99 Favored 'General case' 0 N--CA 1.431 -1.411 0 C-N-CA 126.344 1.857 . . . . 1.0 113.558 177.01 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 88.0 tt0 -54.74 -60.51 3.26 Favored 'General case' 0 N--CA 1.431 -1.402 0 C-N-CA 126.08 1.752 . . . . 1.0 113.723 176.051 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 1.1 t80 -67.31 -25.21 65.91 Favored 'General case' 0 N--CA 1.43 -1.444 0 N-CA-C 115.4 1.63 . . . . 1.0 115.4 179.934 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 16.7 t60 -64.75 -46.01 84.03 Favored 'General case' 0 N--CA 1.43 -1.444 0 C-N-CA 125.935 1.694 . . . . 1.0 113.42 171.355 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 18.4 mmm180 -61.59 -48.89 78.88 Favored 'General case' 0 N--CA 1.431 -1.425 0 C-N-CA 124.958 1.303 . . . . 1.0 112.576 174.625 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 90.6 mt -57.07 -41.02 78.0 Favored 'General case' 0 N--CA 1.43 -1.431 0 C-N-CA 124.379 1.072 . . . . 1.0 113.133 174.449 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -58.88 -53.33 59.58 Favored 'General case' 0 N--CA 1.431 -1.413 0 C-N-CA 125.948 1.699 . . . . 1.0 113.349 176.304 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -56.04 -41.81 75.57 Favored 'General case' 0 N--CA 1.431 -1.399 0 N-CA-C 114.003 1.112 . . . . 1.0 114.003 176.432 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 97.1 mm-40 -63.0 -51.07 68.25 Favored 'General case' 0 N--CA 1.431 -1.415 0 N-CA-C 114.614 1.338 . . . . 1.0 114.614 174.961 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 3.6 pp -70.57 -39.72 73.74 Favored 'General case' 0 N--CA 1.429 -1.5 0 O-C-N 120.135 -1.603 . . . . 1.0 114.517 -179.925 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 0.2 OUTLIER -50.83 -49.89 57.78 Favored 'General case' 0 N--CA 1.43 -1.472 0 C-N-CA 125.789 1.636 . . . . 1.0 113.682 168.78 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 45.2 tp -62.51 -47.45 83.89 Favored 'General case' 0 N--CA 1.43 -1.461 0 O-C-N 121.402 -0.811 . . . . 1.0 112.673 177.167 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 20.2 m -64.75 -50.31 67.36 Favored 'General case' 0 N--CA 1.43 -1.43 0 C-N-CA 124.544 1.138 . . . . 1.0 114.069 -177.376 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 79.9 mt -54.62 -49.37 67.79 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.474 0 O-C-N 119.781 -1.825 . . . . 1.0 114.593 169.447 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 22.8 tt0 -59.35 -47.28 86.02 Favored 'General case' 0 N--CA 1.429 -1.495 0 O-C-N 120.555 -1.341 . . . . 1.0 112.175 177.006 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 3.5 tt0 -56.53 -40.63 75.4 Favored 'General case' 0 N--CA 1.43 -1.453 0 C-N-CA 125.053 1.341 . . . . 1.0 113.801 175.012 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 49.8 tpt85 -57.92 -51.05 71.23 Favored 'General case' 0 N--CA 1.429 -1.476 0 O-C-N 119.309 -2.119 . . . . 1.0 113.255 172.06 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 4.6 mm? -72.71 -47.15 49.5 Favored 'General case' 0 N--CA 1.431 -1.387 0 N-CA-C 114.329 1.233 . . . . 1.0 114.329 -176.924 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 19.0 t70 -74.4 -49.15 23.73 Favored 'General case' 0 N--CA 1.43 -1.448 0 C-N-CA 125.605 1.562 . . . . 1.0 114.092 -175.012 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 13.6 t70 -84.45 -39.75 18.56 Favored 'General case' 0 N--CA 1.43 -1.452 0 O-C-N 120.446 -1.408 . . . . 1.0 113.124 -170.944 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 24' ' ' TRP . . . . . . . . . . . . . 4.5 t90 -85.67 106.48 16.98 Favored 'General case' 0 N--CA 1.43 -1.44 0 O-C-N 119.803 -1.811 . . . . 1.0 108.982 172.38 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 1.4 t70 -80.95 -172.05 3.51 Favored 'General case' 0 N--CA 1.431 -1.418 0 CA-C-O 123.179 1.466 . . . . 1.0 113.645 -165.018 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -166.39 -171.05 32.09 Favored Glycine 0 N--CA 1.43 -1.745 0 O-C-N 119.815 -1.803 . . . . 1.0 111.637 -172.191 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 1.7 t70 -83.28 -39.12 21.24 Favored 'General case' 0 N--CA 1.43 -1.461 0 O-C-N 121.429 -1.042 . . . . 1.0 110.789 178.501 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 22.6 m -81.92 160.33 23.42 Favored 'General case' 0 N--CA 1.429 -1.482 0 CA-C-O 122.279 1.038 . . . . 1.0 111.709 174.36 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 1.8 t70 -76.59 175.85 8.89 Favored 'General case' 0 N--CA 1.43 -1.434 0 C-N-CA 125.205 1.402 . . . . 1.0 111.057 176.094 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 10.2 tp -159.74 115.22 0.16 Allowed 'Isoleucine or valine' 0 N--CA 1.43 -1.44 0 CA-C-O 123.54 1.638 . . . . 1.0 111.005 -167.254 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 36.9 m-20 -125.26 102.68 7.56 Favored 'General case' 0 N--CA 1.43 -1.459 0 O-C-N 120.648 -1.282 . . . . 1.0 109.696 169.129 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 36.7 m -94.14 125.14 38.59 Favored 'General case' 0 N--CA 1.429 -1.482 0 O-C-N 119.18 -2.2 . . . . 1.0 111.093 166.289 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -90.36 131.93 35.87 Favored 'General case' 0 N--CA 1.429 -1.493 0 C-N-CA 125.074 1.35 . . . . 1.0 110.906 -176.298 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 3.3 mm -105.56 105.77 19.29 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.489 0 C-N-CA 126.479 1.912 . . . . 1.0 106.238 -178.836 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -132.89 63.81 1.63 Allowed 'General case' 0 N--CA 1.429 -1.475 0 O-C-N 121.392 -0.818 . . . . 1.0 111.613 -176.129 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . 33.46 67.4 0.22 Allowed Glycine 0 N--CA 1.43 -1.748 0 C-N-CA 128.671 3.034 . . . . 1.0 119.559 169.467 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 114.89 -22.67 12.4 Favored Glycine 0 N--CA 1.431 -1.645 0 N-CA-C 111.031 -0.827 . . . . 1.0 111.031 -173.933 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 72.8 t -109.63 137.22 42.81 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.424 0 C-N-CA 124.676 1.19 . . . . 1.0 108.269 173.889 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 42.8 mt -119.57 129.75 54.8 Favored 'General case' 0 N--CA 1.43 -1.464 0 O-C-N 120.812 -1.18 . . . . 1.0 108.923 154.557 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -122.95 118.14 27.15 Favored 'General case' 0 N--CA 1.429 -1.48 0 CA-C-O 122.91 1.338 . . . . 1.0 108.237 177.103 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 81.7 mt -97.3 128.38 48.62 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.439 0 O-C-N 120.638 -1.289 . . . . 1.0 108.398 -172.763 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 69.5 p -129.62 122.19 28.58 Favored 'General case' 0 N--CA 1.429 -1.517 0 CA-C-O 122.018 0.913 . . . . 1.0 113.205 175.271 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 43' ' ' PHE . . . . . . . . . . . . . 5.2 p90 -120.49 167.73 12.07 Favored 'General case' 0 N--CA 1.431 -1.412 0 C-N-CA 125.003 1.321 . . . . 1.0 109.544 166.138 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 40.4 mt-10 -52.4 -36.1 53.37 Favored 'General case' 0 N--CA 1.431 -1.418 0 N-CA-C 118.63 2.826 . . . . 1.0 118.63 -171.308 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 74.1 m-20 -67.47 -4.22 10.75 Favored 'General case' 0 N--CA 1.429 -1.516 0 O-C-N 120.229 -1.545 . . . . 1.0 115.095 177.495 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 75.54 22.46 75.29 Favored Glycine 0 N--CA 1.432 -1.597 0 O-C-N 120.073 -1.642 . . . . 1.0 115.536 160.881 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 53.5 m -73.65 -47.06 42.77 Favored 'General case' 0 N--CA 1.43 -1.447 0 C-N-CA 124.622 1.169 . . . . 1.0 112.956 -175.175 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 86.0 mttt 75.54 107.55 0.08 Allowed 'General case' 0 N--CA 1.429 -1.479 0 C-N-CA 126.889 2.076 . . . . 1.0 114.768 170.697 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 2.7 mm -102.18 136.23 35.35 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.429 0 N-CA-C 107.367 -1.346 . . . . 1.0 107.367 -177.095 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 9.3 mm -126.18 105.25 14.18 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.437 0 C-N-CA 124.075 0.95 . . . . 1.0 109.359 -169.587 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 3.5 mt -126.88 128.25 70.63 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.416 0 O-C-N 120.249 -1.532 . . . . 1.0 109.936 -170.823 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 51.8 t-20 -161.87 170.84 18.74 Favored 'General case' 0 N--CA 1.43 -1.469 0 N-CA-C 105.197 -2.149 . . . . 1.0 105.197 -167.856 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -156.61 138.03 13.93 Favored 'General case' 0 N--CA 1.43 -1.465 0 O-C-N 121.185 -0.947 . . . . 1.0 113.194 -163.674 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 86.9 mm-40 -99.33 105.21 17.18 Favored 'General case' 0 N--CA 1.431 -1.416 0 C-N-CA 125.71 1.604 . . . . 1.0 109.096 166.574 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . 0.272 9.7 tt0 -65.64 -52.46 43.3 Favored Pre-proline 0 N--CA 1.431 -1.379 0 N-CA-C 116.891 2.182 . . . . 1.0 116.891 -164.419 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 51.7 Cg_exo -68.57 -21.0 40.33 Favored 'Trans proline' 0 C--N 1.299 -2.071 0 CA-C-N 126.3 3.286 . . . . 1.0 115.342 -177.591 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 32.3 mt -74.96 -25.52 58.92 Favored 'General case' 0 N--CA 1.429 -1.495 0 CA-C-N 119.507 1.048 . . . . 1.0 112.019 -174.955 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 25.5 m170 79.38 30.42 0.3 Allowed 'General case' 0 N--CA 1.431 -1.423 0 C-N-CA 128.056 2.543 . . . . 1.0 113.018 -178.767 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 65.1 mt-30 -120.02 132.63 55.53 Favored 'General case' 0 N--CA 1.43 -1.427 0 O-C-N 120.271 -1.518 . . . . 1.0 110.292 176.283 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 8.0 t -90.44 151.57 3.47 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.404 0 N-CA-C 106.515 -1.661 . . . . 1.0 106.515 163.178 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 61' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -111.38 145.65 38.52 Favored 'General case' 0 N--CA 1.43 -1.439 0 O-C-N 120.28 -1.512 . . . . 1.0 107.769 168.866 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 2.6 pt? -138.12 111.25 7.86 Favored 'General case' 0 N--CA 1.432 -1.361 0 O-C-N 120.966 -1.083 . . . . 1.0 108.299 173.471 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 63' ' ' ALA . . . . . 0.453 ' HA ' ' HA2' ' A' ' 68' ' ' GLY . . . -101.6 144.08 30.78 Favored 'General case' 0 N--CA 1.429 -1.48 0 CA-C-O 123.626 1.679 . . . . 1.0 112.291 169.808 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 64' ' ' THR . . . . . . . . . . . . . 39.1 p -150.61 -165.82 2.37 Favored 'General case' 0 N--CA 1.43 -1.431 0 CA-C-N 113.034 -1.894 . . . . 1.0 107.991 -145.973 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 11.7 mmtt -65.13 -43.37 92.17 Favored 'General case' 0 N--CA 1.43 -1.47 0 N-CA-C 115.025 1.491 . . . . 1.0 115.025 168.583 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 29.6 mp0 -79.12 -25.56 42.94 Favored 'General case' 0 N--CA 1.43 -1.462 0 O-C-N 120.208 -1.558 . . . . 1.0 115.075 -170.208 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 159.69 -48.5 0.4 Allowed Glycine 0 N--CA 1.43 -1.735 0 O-C-N 120.37 -1.456 . . . . 1.0 114.557 176.001 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 68' ' ' GLY . . . . . 0.453 ' HA2' ' HA ' ' A' ' 63' ' ' ALA . . . 120.39 121.36 2.87 Favored Glycine 0 N--CA 1.43 -1.725 0 CA-C-O 122.569 1.094 . . . . 1.0 114.901 -179.575 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 23.0 m-30 -122.37 171.09 9.31 Favored 'General case' 0 N--CA 1.429 -1.493 0 C-N-CA 125.499 1.52 . . . . 1.0 108.879 -177.253 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 3.6 p-80 -122.57 161.73 23.15 Favored 'General case' 0 N--CA 1.43 -1.434 0 O-C-N 120.293 -1.505 . . . . 1.0 109.384 169.102 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 71' ' ' PHE . . . . . . . . . . . . 0.286 37.3 t80 -139.43 122.29 16.59 Favored 'General case' 0 N--CA 1.431 -1.398 0 C-N-CA 124.116 0.967 . . . . 1.0 111.57 -145.953 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 11.9 m-20 -129.16 148.86 51.13 Favored 'General case' 0 N--CA 1.43 -1.426 0 C-N-CA 125.329 1.452 . . . . 1.0 113.044 -177.312 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 3.0 tm? -84.42 114.64 22.05 Favored 'General case' 0 N--CA 1.43 -1.457 0 C-N-CA 127.041 2.136 . . . . 1.0 111.699 -179.592 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 76.7 tttt -89.48 -52.6 4.94 Favored 'General case' 0 N--CA 1.43 -1.47 0 O-C-N 120.959 -1.088 . . . . 1.0 110.931 174.463 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -164.65 -78.79 0.04 OUTLIER Glycine 0 N--CA 1.43 -1.76 0 O-C-N 120.688 -1.258 . . . . 1.0 114.069 177.052 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 50.9 m-20 -96.03 -5.25 41.5 Favored 'General case' 0 N--CA 1.43 -1.45 0 O-C-N 120.366 -1.667 . . . . 1.0 111.357 -176.634 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 5.0 mt-10 -159.05 161.27 36.49 Favored 'General case' 0 CA--C 1.488 -1.404 0 N-CA-C 101.428 -3.545 . . . . 1.0 101.428 -176.286 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 78' ' ' TRP . . . . . . . . . . . . . 23.6 m95 -94.44 142.15 27.76 Favored 'General case' 0 N--CA 1.43 -1.439 0 N-CA-C 104.409 -2.441 . . . . 1.0 104.409 175.066 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 0.6 OUTLIER -93.71 149.93 4.14 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.399 0 N-CA-C 105.374 -2.084 . . . . 1.0 105.374 169.844 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 80' ' ' CYS . . . . . 0.417 ' HB2' ' HB2' ' A' ' 85' ' ' GLU . 90.0 m -88.61 114.39 25.18 Favored 'General case' 0 N--CA 1.43 -1.474 0 N-CA-C 106.383 -1.71 . . . . 1.0 106.383 169.972 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 21.1 t70 -61.54 -55.2 33.58 Favored 'General case' 0 N--CA 1.431 -1.414 0 C-N-CA 127.6 2.36 . . . . 1.0 113.949 -162.536 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -51.07 -61.34 2.29 Favored 'General case' 0 N--CA 1.43 -1.451 0 C-N-CA 126.675 1.99 . . . . 1.0 115.603 -165.878 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 68.4 m -85.01 -31.96 23.19 Favored 'General case' 0 N--CA 1.431 -1.396 0 O-C-N 120.558 -1.339 . . . . 1.0 111.95 174.934 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 97.51 79.93 1.5 Allowed Glycine 0 N--CA 1.43 -1.7 0 N-CA-C 109.699 -1.36 . . . . 1.0 109.699 -169.215 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 85' ' ' GLU . . . . . 0.417 ' HB2' ' HB2' ' A' ' 80' ' ' CYS . 36.8 mm-40 -142.32 -161.14 1.19 Allowed 'General case' 0 N--CA 1.428 -1.554 0 N-CA-C 106.967 -1.494 . . . . 1.0 106.967 -174.439 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 89.5 m -137.96 142.8 40.51 Favored 'General case' 0 N--CA 1.429 -1.495 0 O-C-N 119.727 -1.858 . . . . 1.0 109.863 -161.233 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 1.1 t80 -38.63 -94.37 0.0 OUTLIER 'General case' 0 N--CA 1.43 -1.461 0 C-N-CA 128.005 2.522 . . . . 1.0 117.807 177.055 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 88' ' ' TRP . . . . . 0.446 ' HB2' ' HG2' ' A' ' 106' ' ' ARG . 19.1 m95 -76.12 -26.53 56.45 Favored 'General case' 0 N--CA 1.43 -1.462 0 O-C-N 120.308 -1.495 . . . . 1.0 111.331 -166.968 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -59.85 -50.66 72.91 Favored 'General case' 0 N--CA 1.43 -1.461 0 C-N-CA 125.857 1.663 . . . . 1.0 113.554 172.258 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 46.3 tp -68.5 -43.67 76.36 Favored 'General case' 0 N--CA 1.43 -1.462 0 O-C-N 119.652 -1.905 . . . . 1.0 111.077 179.0 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 10.3 tt -50.53 -49.85 54.74 Favored 'General case' 0 N--CA 1.43 -1.427 0 C-N-CA 125.636 1.574 . . . . 1.0 113.449 172.749 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 16.8 tt0 -55.57 -49.08 73.67 Favored 'General case' 0 N--CA 1.43 -1.465 0 C-N-CA 127.018 2.127 . . . . 1.0 113.281 173.943 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 51.0 mt-30 -60.36 -48.3 82.34 Favored 'General case' 0 N--CA 1.431 -1.393 0 O-C-N 120.766 -1.209 . . . . 1.0 113.743 175.944 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -58.78 -49.33 78.06 Favored 'General case' 0 N--CA 1.43 -1.438 0 C-N-CA 125.378 1.471 . . . . 1.0 113.171 174.277 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -59.94 -45.91 91.1 Favored 'General case' 0 N--CA 1.429 -1.509 0 C-N-CA 126.143 1.777 . . . . 1.0 114.115 177.576 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 96.4 m -60.93 -36.47 79.41 Favored 'General case' 0 N--CA 1.431 -1.399 0 C-N-CA 125.713 1.605 . . . . 1.0 112.526 178.25 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -69.05 -59.62 2.92 Favored 'General case' 0 N--CA 1.428 -1.528 0 C-N-CA 124.388 1.075 . . . . 1.0 113.317 170.243 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 5.4 pt20 -76.54 -19.64 57.71 Favored 'General case' 0 N--CA 1.431 -1.406 0 N-CA-C 116.016 1.858 . . . . 1.0 116.016 -166.134 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -97.92 -35.98 10.31 Favored 'General case' 0 N--CA 1.431 -1.408 0 C-N-CA 124.793 1.237 . . . . 1.0 112.224 169.579 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . 106.95 10.76 27.63 Favored Glycine 0 N--CA 1.429 -1.77 0 N-CA-C 116.222 1.249 . . . . 1.0 116.222 170.048 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 6.7 pt-20 -149.34 160.98 42.95 Favored 'General case' 0 N--CA 1.43 -1.425 0 N-CA-C 105.655 -1.979 . . . . 1.0 105.655 -177.416 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 18.4 m -65.8 111.43 3.25 Favored 'General case' 0 N--CA 1.429 -1.482 0 CA-C-N 120.804 1.638 . . . . 1.0 112.177 -178.595 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 60.7 t -94.86 107.68 19.78 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.415 0 CA-C-O 122.993 1.378 . . . . 1.0 109.394 -178.005 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 70.0 m -80.2 106.15 12.0 Favored 'General case' 0 N--CA 1.43 -1.456 0 C-N-CA 124.622 1.169 . . . . 1.0 111.336 -176.516 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -140.58 -12.02 1.02 Allowed 'General case' 0 N--CA 1.43 -1.458 0 C-N-CA 123.133 0.573 . . . . 1.0 109.875 168.625 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 106' ' ' ARG . . . . . 0.446 ' HG2' ' HB2' ' A' ' 88' ' ' TRP . 0.0 OUTLIER . . . . . 0 C--O 1.261 1.69 0 C-N-CA 126.592 1.957 . . . . 1.0 110.882 179.212 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 66.6 mtt . . . . . 0 CA--C 1.49 -1.347 0 CA-C-O 121.44 0.638 . . . . 1.0 111.829 . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 17.9 t-20 -114.7 56.35 0.73 Allowed 'General case' 0 N--CA 1.43 -1.434 0 O-C-N 120.532 -1.355 . . . . 1.0 110.238 -178.314 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -64.0 -30.79 71.84 Favored 'General case' 0 CA--C 1.489 -1.402 0 C-N-CA 126.095 1.758 . . . . 1.0 114.614 -176.136 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 48.0 p -65.45 -46.87 78.17 Favored 'General case' 0 N--CA 1.43 -1.441 0 O-C-N 120.483 -1.386 . . . . 1.0 113.882 174.971 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 40.2 tt0 -68.03 -44.69 75.9 Favored 'General case' 0 N--CA 1.431 -1.422 0 O-C-N 120.606 -1.308 . . . . 1.0 112.723 176.668 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 28.3 t80 -50.4 -49.38 54.76 Favored 'General case' 0 N--CA 1.43 -1.439 0 N-CA-C 114.123 1.157 . . . . 1.0 114.123 168.856 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 1.2 t60 -61.03 -38.6 86.69 Favored 'General case' 0 N--CA 1.429 -1.498 0 O-C-N 120.649 -1.282 . . . . 1.0 114.382 175.048 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 1.2 mpt_? -56.26 -56.94 14.81 Favored 'General case' 0 N--CA 1.43 -1.426 0 CA-C-N 120.629 1.558 . . . . 1.0 112.185 172.816 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 80.4 mt -63.96 -41.57 97.54 Favored 'General case' 0 N--CA 1.429 -1.492 0 N-CA-C 114.135 1.161 . . . . 1.0 114.135 -179.161 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -67.18 -41.31 86.11 Favored 'General case' 0 N--CA 1.43 -1.474 0 C-N-CA 125.446 1.498 . . . . 1.0 114.774 -179.472 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -66.41 -38.76 88.19 Favored 'General case' 0 N--CA 1.431 -1.409 0 O-C-N 120.305 -1.497 . . . . 1.0 112.025 172.346 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 3.6 mt-30 -56.38 -54.09 49.63 Favored 'General case' 0 N--CA 1.43 -1.442 0 N-CA-C 115.829 1.788 . . . . 1.0 115.829 170.142 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 4.3 pp -63.91 -39.31 93.88 Favored 'General case' 0 N--CA 1.429 -1.479 0 N-CA-C 114.469 1.285 . . . . 1.0 114.469 179.387 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 7.3 m0 -49.71 -49.5 47.55 Favored 'General case' 0 N--CA 1.429 -1.481 0 N-CA-C 114.552 1.315 . . . . 1.0 114.552 168.759 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 41.9 tp -61.54 -51.52 68.23 Favored 'General case' 0 N--CA 1.429 -1.507 0 C-N-CA 124.21 1.004 . . . . 1.0 113.618 176.251 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 17.0 m -57.07 -43.08 81.75 Favored 'General case' 0 N--CA 1.43 -1.464 0 C-N-CA 125.613 1.565 . . . . 1.0 113.978 177.384 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 87.9 mt -59.12 -49.9 81.67 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.504 0 O-C-N 120.573 -1.33 . . . . 1.0 113.162 173.144 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 72.5 tt0 -63.02 -48.58 78.14 Favored 'General case' 0 N--CA 1.43 -1.473 0 O-C-N 120.594 -1.316 . . . . 1.0 112.715 -179.86 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 27.0 mm-40 -48.44 -59.72 3.25 Favored 'General case' 0 N--CA 1.428 -1.537 0 C-N-CA 126.569 1.948 . . . . 1.0 114.316 172.527 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 3.1 tpm_? -62.79 -37.82 88.19 Favored 'General case' 0 N--CA 1.43 -1.451 0 N-CA-C 113.8 1.037 . . . . 1.0 113.8 -176.627 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 4.3 mm? -70.65 -44.63 66.71 Favored 'General case' 0 N--CA 1.43 -1.456 0 O-C-N 120.482 -1.386 . . . . 1.0 113.7 177.084 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 25.5 t70 -68.24 -39.3 82.32 Favored 'General case' 0 N--CA 1.429 -1.475 0 O-C-N 120.775 -1.203 . . . . 1.0 113.542 -178.54 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 35.8 t70 -64.84 -26.59 68.4 Favored 'General case' 0 N--CA 1.43 -1.475 0 C-N-CA 125.841 1.656 . . . . 1.0 113.624 178.681 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 24' ' ' TRP . . . . . . . . . . . . . 0.1 OUTLIER -99.46 -145.84 0.33 Allowed 'General case' 0 N--CA 1.429 -1.48 0 N-CA-C 115.074 1.509 . . . . 1.0 115.074 -167.939 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . 0.306 0.9 OUTLIER 55.35 -157.44 0.23 Allowed 'General case' 0 N--CA 1.43 -1.449 0 C-N-CA 128.819 2.848 . . . . 1.0 116.221 -175.282 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 155.67 -44.85 0.54 Allowed Glycine 0 N--CA 1.432 -1.613 0 O-C-N 120.464 -1.397 . . . . 1.0 112.247 -179.019 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -77.68 -30.87 52.2 Favored 'General case' 0 N--CA 1.432 -1.368 0 CA-C-O 122.165 0.983 . . . . 1.0 111.595 -178.51 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 63.4 m -112.64 166.26 11.51 Favored 'General case' 0 N--CA 1.43 -1.435 0 C-N-CA 124.652 1.181 . . . . 1.0 110.136 174.742 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 29.8 t70 -93.5 141.22 28.71 Favored 'General case' 0 N--CA 1.43 -1.446 0 N-CA-C 106.904 -1.517 . . . . 1.0 106.904 167.421 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 5.8 tp -141.99 124.06 13.56 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.463 0 C-N-CA 126.376 1.871 . . . . 1.0 106.01 -169.558 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 13.7 t70 -140.48 128.55 22.16 Favored 'General case' 0 N--CA 1.43 -1.467 0 O-C-N 120.611 -1.306 . . . . 1.0 110.058 169.044 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 43.3 t -95.1 131.81 40.69 Favored 'General case' 0 N--CA 1.43 -1.43 0 O-C-N 120.018 -1.676 . . . . 1.0 108.074 173.509 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 23.3 mt-10 -107.62 140.27 40.9 Favored 'General case' 0 N--CA 1.429 -1.506 0 O-C-N 120.99 -1.069 . . . . 1.0 108.762 -170.242 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 3.1 tp -114.58 109.38 28.27 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.44 0 N-CA-C 105.617 -1.994 . . . . 1.0 105.617 167.011 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 77.5 m-20 -125.73 126.1 44.06 Favored 'General case' 0 N--CA 1.43 -1.427 0 N-CA-C 106.889 -1.523 . . . . 1.0 106.889 168.522 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . 67.42 -103.68 0.99 Allowed Glycine 0 N--CA 1.43 -1.728 0 C-N-CA 125.039 1.304 . . . . 1.0 112.607 -174.963 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -139.73 25.44 2.7 Favored Glycine 0 N--CA 1.43 -1.738 0 C-N-CA 124.186 0.898 . . . . 1.0 111.408 171.839 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 46.9 t -112.23 130.53 65.75 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.516 0 N-CA-C 106.97 -1.493 . . . . 1.0 106.97 179.063 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 23.9 mt -99.73 120.34 39.57 Favored 'General case' 0 N--CA 1.429 -1.499 0 CA-C-O 123.208 1.48 . . . . 1.0 107.883 172.141 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 1.6 p -113.76 122.33 46.77 Favored 'General case' 0 N--CA 1.43 -1.454 0 N-CA-C 106.995 -1.483 . . . . 1.0 106.995 179.63 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 61.7 mt -93.89 112.62 27.09 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.431 0 N-CA-C 105.787 -1.931 . . . . 1.0 105.787 -177.794 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 27.2 p -121.77 126.41 48.8 Favored 'General case' 0 N--CA 1.43 -1.448 0 CA-C-O 122.441 1.115 . . . . 1.0 113.221 -167.919 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 43' ' ' PHE . . . . . . . . . . . . . 3.0 p90 -120.77 167.76 12.14 Favored 'General case' 0 N--CA 1.43 -1.443 0 CA-C-O 122.749 1.261 . . . . 1.0 111.59 178.675 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -56.61 -33.01 65.85 Favored 'General case' 0 N--CA 1.43 -1.435 0 C-N-CA 127.953 2.501 . . . . 1.0 117.037 -170.077 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 70.9 m-80 -67.09 -15.8 63.94 Favored 'General case' 0 N--CA 1.431 -1.425 0 N-CA-C 115.037 1.495 . . . . 1.0 115.037 175.427 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 88.2 13.13 64.43 Favored Glycine 0 N--CA 1.431 -1.64 0 O-C-N 119.676 -1.89 . . . . 1.0 115.475 167.447 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 56.8 m -98.65 149.89 22.33 Favored 'General case' 0 N--CA 1.429 -1.504 0 N-CA-C 107.336 -1.357 . . . . 1.0 107.336 167.693 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -128.49 150.88 49.97 Favored 'General case' 0 N--CA 1.429 -1.5 0 O-C-N 121.378 -0.826 . . . . 1.0 110.063 -168.236 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 3.1 mm -105.17 133.31 49.77 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.508 0 N-CA-C 105.527 -2.027 . . . . 1.0 105.527 166.546 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 50' ' ' ILE . . . . . 0.478 ' HB ' ' HB3' ' A' ' 63' ' ' ALA . 5.7 mm -116.64 117.74 56.47 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.484 0 CA-C-N 119.733 1.151 . . . . 1.0 109.617 -173.158 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 3.2 mt -126.93 116.27 44.13 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.432 0 CA-C-O 124.047 1.88 . . . . 1.0 112.179 -175.469 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 52' ' ' ASN . . . . . 0.636 ' H ' ' HD1' ' A' ' 61' ' ' TRP . 56.2 t30 -141.82 170.63 15.35 Favored 'General case' 0 N--CA 1.43 -1.449 0 C-N-CA 128.354 2.662 . . . . 1.0 106.27 -179.274 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -154.29 130.89 10.66 Favored 'General case' 0 N--CA 1.431 -1.408 0 CA-C-O 122.834 1.302 . . . . 1.0 109.289 -170.365 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 28.9 mm-40 -89.73 129.87 36.08 Favored 'General case' 0 N--CA 1.429 -1.477 0 N-CA-C 106.531 -1.655 . . . . 1.0 106.531 175.921 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 67.6 mt-10 -63.75 -47.99 80.56 Favored Pre-proline 0 N--CA 1.431 -1.42 0 N-CA-C 116.687 2.106 . . . . 1.0 116.687 -179.606 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 97.3 Cg_endo -74.52 153.39 44.26 Favored 'Trans proline' 0 C--N 1.299 -2.036 0 CA-C-N 126.531 3.368 . . . . 1.0 111.388 163.403 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . 0.388 5.4 mp 72.57 143.05 0.06 Allowed 'General case' 0 N--CA 1.43 -1.457 0 CA-C-O 124.754 2.216 . . . . 1.0 113.445 -168.203 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 21.2 m170 -88.93 44.32 1.2 Allowed 'General case' 0 N--CA 1.43 -1.446 0 C-N-CA 125.318 1.447 . . . . 1.0 112.904 -175.899 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 11.7 pt20 -140.0 145.44 37.81 Favored 'General case' 0 N--CA 1.43 -1.456 0 O-C-N 120.045 -1.66 . . . . 1.0 110.53 -172.077 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 86.7 t -111.88 156.08 13.05 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.457 0 N-CA-C 107.023 -1.473 . . . . 1.0 107.023 -178.679 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 61' ' ' TRP . . . . . 0.636 ' HD1' ' H ' ' A' ' 52' ' ' ASN . 0.0 OUTLIER -102.06 152.35 21.08 Favored 'General case' 0 N--CA 1.43 -1.455 0 O-C-N 120.054 -1.653 . . . . 1.0 113.011 174.784 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 75.6 mt -127.91 107.54 9.94 Favored 'General case' 0 CA--C 1.488 -1.409 0 N-CA-C 106.994 -1.484 . . . . 1.0 106.994 166.175 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 63' ' ' ALA . . . . . 0.478 ' HB3' ' HB ' ' A' ' 50' ' ' ILE . . . -95.19 145.14 25.25 Favored 'General case' 0 N--CA 1.429 -1.476 0 CA-C-O 122.801 1.286 . . . . 1.0 111.16 163.288 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 64' ' ' THR . . . . . . . . . . . . . 69.2 p -150.3 -168.1 3.01 Favored 'General case' 0 N--CA 1.43 -1.462 0 C-N-CA 126.182 1.793 . . . . 1.0 108.617 -150.583 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 7.1 tmtm? -62.12 -46.82 87.33 Favored 'General case' 0 N--CA 1.431 -1.411 0 C-N-CA 125.889 1.676 . . . . 1.0 112.435 174.693 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 48.9 tt0 -78.04 -24.51 47.75 Favored 'General case' 0 N--CA 1.429 -1.519 0 N-CA-C 114.516 1.302 . . . . 1.0 114.516 -170.718 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 151.06 -53.14 0.49 Allowed Glycine 0 N--CA 1.43 -1.725 0 O-C-N 120.893 -1.129 . . . . 1.0 110.89 176.963 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 134.83 162.06 9.67 Favored Glycine 0 N--CA 1.43 -1.736 0 CA-C-O 122.818 1.232 . . . . 1.0 115.839 174.448 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 4.7 m-85 -135.32 161.99 33.85 Favored 'General case' 0 N--CA 1.43 -1.442 0 C-N-CA 126.415 1.886 . . . . 1.0 107.148 -173.318 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 25.0 p80 -114.98 159.72 20.43 Favored 'General case' 0 N--CA 1.43 -1.433 0 O-C-N 119.797 -1.815 . . . . 1.0 108.586 156.025 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 37.3 p90 -136.96 141.47 42.61 Favored 'General case' 0 N--CA 1.43 -1.471 0 N-CA-C 114.694 1.368 . . . . 1.0 114.694 -168.755 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 8.9 m-20 -121.63 175.81 6.03 Favored 'General case' 0 N--CA 1.429 -1.491 0 C-N-CA 126.448 1.899 . . . . 1.0 110.391 -170.495 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 27.1 tp -113.82 110.25 19.84 Favored 'General case' 0 N--CA 1.429 -1.521 0 O-C-N 119.718 -1.864 . . . . 1.0 113.072 -174.616 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 12.2 mmmt -68.41 -42.46 78.96 Favored 'General case' 0 N--CA 1.431 -1.379 0 O-C-N 120.497 -1.377 . . . . 1.0 112.641 168.45 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . 165.08 -86.9 0.1 Allowed Glycine 0 N--CA 1.43 -1.764 0 N-CA-C 110.074 -1.211 . . . . 1.0 110.074 176.997 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 11.6 t0 -91.82 29.65 1.52 Allowed 'General case' 0 N--CA 1.43 -1.46 0 O-C-N 120.988 -1.301 . . . . 1.0 111.96 176.659 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 2.1 pt-20 -169.07 124.61 0.89 Allowed 'General case' 0 N--CA 1.429 -1.484 0 C-N-CA 126.33 1.852 . . . . 1.0 106.523 -173.772 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 78' ' ' TRP . . . . . . . . . . . . . 89.9 m95 -80.46 130.67 35.3 Favored 'General case' 0 N--CA 1.43 -1.462 0 N-CA-C 106.339 -1.726 . . . . 1.0 106.339 162.627 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -124.55 141.12 45.73 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.436 0 O-C-N 119.313 -2.117 . . . . 1.0 109.866 -173.777 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 21.2 m -81.64 121.17 26.01 Favored 'General case' 0 N--CA 1.429 -1.492 0 O-C-N 120.243 -1.535 . . . . 1.0 113.21 -172.572 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 30.0 t70 -83.11 58.33 4.38 Favored 'General case' 0 N--CA 1.43 -1.465 0 O-C-N 119.769 -1.832 . . . . 1.0 112.467 -173.172 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 15.6 tpt85 -170.45 101.29 0.26 Allowed 'General case' 0 N--CA 1.43 -1.437 0 O-C-N 120.433 -1.417 . . . . 1.0 110.053 178.039 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 4.3 t 79.48 -50.28 0.4 Allowed 'General case' 0 N--CA 1.43 -1.463 0 C-N-CA 126.695 1.998 . . . . 1.0 116.121 169.039 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -153.79 96.15 0.16 Allowed Glycine 0 N--CA 1.43 -1.732 0 O-C-N 120.214 -1.554 . . . . 1.0 110.015 -172.593 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 5.5 pt-20 -82.43 102.71 11.48 Favored 'General case' 0 N--CA 1.428 -1.539 0 N-CA-C 117.99 2.589 . . . . 1.0 117.99 -162.834 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 10.4 m -165.66 126.71 1.89 Allowed 'General case' 0 N--CA 1.43 -1.458 0 O-C-N 119.543 -1.973 . . . . 1.0 113.339 172.333 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 3.0 t80 -57.09 -84.34 0.01 OUTLIER 'General case' 0 N--CA 1.43 -1.438 0 N-CA-C 118.018 2.599 . . . . 1.0 118.018 177.192 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 88' ' ' TRP . . . . . . . . . . . . . 46.7 m95 -61.38 -27.81 68.79 Favored 'General case' 0 N--CA 1.431 -1.424 0 C-N-CA 125.876 1.67 . . . . 1.0 113.324 -167.295 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -77.27 -45.03 27.69 Favored 'General case' 0 N--CA 1.429 -1.492 0 C-N-CA 126.685 1.994 . . . . 1.0 112.896 179.558 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 25.6 tp -71.36 -38.89 71.56 Favored 'General case' 0 N--CA 1.429 -1.489 0 O-C-N 118.875 -2.391 . . . . 1.0 112.734 176.951 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 17.7 tp -51.58 -44.98 62.96 Favored 'General case' 0 N--CA 1.431 -1.391 0 C-N-CA 126.608 1.963 . . . . 1.0 114.483 168.027 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 38.5 tt0 -56.66 -47.18 80.37 Favored 'General case' 0 N--CA 1.431 -1.407 0 C-N-CA 126.318 1.847 . . . . 1.0 113.93 170.168 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 38.1 tt0 -57.05 -50.77 71.73 Favored 'General case' 0 N--CA 1.43 -1.448 0 C-N-CA 125.63 1.572 . . . . 1.0 114.427 176.938 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -56.56 -48.49 77.21 Favored 'General case' 0 N--CA 1.429 -1.478 0 C-N-CA 126.148 1.779 . . . . 1.0 114.121 173.969 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -65.69 -48.77 70.91 Favored 'General case' 0 N--CA 1.431 -1.415 0 O-C-N 120.339 -1.476 . . . . 1.0 113.682 179.45 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 94.0 m -47.13 -51.45 18.05 Favored 'General case' 0 N--CA 1.43 -1.465 0 C-N-CA 127.38 2.272 . . . . 1.0 113.97 173.986 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 8.4 pt20 -72.98 -37.02 67.19 Favored 'General case' 0 N--CA 1.431 -1.421 0 N-CA-C 114.692 1.368 . . . . 1.0 114.692 -179.173 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 41.7 mt-30 -71.22 -42.08 69.37 Favored 'General case' 0 N--CA 1.431 -1.411 0 N-CA-C 115.655 1.724 . . . . 1.0 115.655 178.741 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -82.82 -41.21 19.36 Favored 'General case' 0 N--CA 1.431 -1.421 0 N-CA-C 113.622 0.971 . . . . 1.0 113.622 -179.604 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . 89.59 42.69 5.39 Favored Glycine 0 N--CA 1.431 -1.669 0 O-C-N 120.667 -1.271 . . . . 1.0 112.984 -177.991 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 4.3 tp10 -158.92 164.85 35.27 Favored 'General case' 0 N--CA 1.43 -1.468 0 N-CA-C 103.252 -2.869 . . . . 1.0 103.252 -177.291 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 90.4 m -76.88 87.21 3.45 Favored 'General case' 0 N--CA 1.431 -1.383 0 CA-C-N 120.533 1.515 . . . . 1.0 109.339 169.666 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 18.0 t -95.45 84.01 1.53 Allowed 'Isoleucine or valine' 0 N--CA 1.43 -1.426 0 CA-C-O 124.297 1.999 . . . . 1.0 108.73 -179.265 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 71.5 p -96.72 168.07 10.73 Favored 'General case' 0 N--CA 1.431 -1.403 0 C-N-CA 126.783 2.033 . . . . 1.0 111.114 -177.6 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 20.2 m-85 -104.57 -27.05 12.1 Favored 'General case' 0 N--CA 1.429 -1.479 0 O-C-N 120.768 -1.207 . . . . 1.0 109.278 162.134 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 16.5 mmm-85 . . . . . 0 C--O 1.259 1.602 0 C-N-CA 124.354 1.061 . . . . 1.0 111.409 -170.957 . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 20.9 mmt . . . . . 0 CA--C 1.49 -1.344 0 CA-C-O 121.937 0.875 . . . . 1.0 110.646 . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 29.2 m-80 -114.01 44.18 1.7 Allowed 'General case' 0 N--CA 1.43 -1.468 0 O-C-N 119.996 -1.69 . . . . 1.0 109.782 -179.477 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 28.3 p-10 -69.71 -56.23 7.77 Favored 'General case' 0 CA--C 1.488 -1.408 0 C-N-CA 125.586 1.554 . . . . 1.0 113.777 -176.357 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 33.4 m -59.46 -45.07 92.67 Favored 'General case' 0 N--CA 1.431 -1.403 0 C-N-CA 124.698 1.199 . . . . 1.0 112.417 174.146 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 8.4 mm-40 -52.5 -63.29 1.19 Allowed 'General case' 0 N--CA 1.429 -1.482 0 C-N-CA 126.491 1.916 . . . . 1.0 113.137 178.297 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 7.6 m-85 -62.12 -27.59 69.04 Favored 'General case' 0 N--CA 1.43 -1.462 0 N-CA-C 115.838 1.792 . . . . 1.0 115.838 177.089 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 0.7 OUTLIER -61.52 -52.6 63.8 Favored 'General case' 0 N--CA 1.429 -1.475 0 N-CA-C 114.441 1.274 . . . . 1.0 114.441 171.792 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 35.4 mtm180 -69.63 -39.14 77.33 Favored 'General case' 0 N--CA 1.431 -1.375 0 O-C-N 120.474 -1.391 . . . . 1.0 113.973 -179.793 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 66.7 mt -58.55 -41.7 86.19 Favored 'General case' 0 N--CA 1.431 -1.42 0 C-N-CA 125.05 1.34 . . . . 1.0 113.223 173.648 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -62.99 -45.91 90.17 Favored 'General case' 0 N--CA 1.429 -1.483 0 C-N-CA 125.312 1.445 . . . . 1.0 112.668 176.293 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 8.2 t70 -53.69 -57.53 10.48 Favored 'General case' 0 N--CA 1.43 -1.463 0 C-N-CA 124.42 1.088 . . . . 1.0 113.242 174.846 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 16.7 pt20 -64.1 -37.49 87.64 Favored 'General case' 0 N--CA 1.429 -1.478 0 N-CA-C 116.267 1.951 . . . . 1.0 116.267 -177.907 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 3.3 pp -65.06 -43.54 91.89 Favored 'General case' 0 N--CA 1.43 -1.44 0 O-C-N 120.174 -1.578 . . . . 1.0 113.376 174.928 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 23.1 m0 -52.62 -50.67 62.65 Favored 'General case' 0 N--CA 1.431 -1.413 0 N-CA-C 115.329 1.603 . . . . 1.0 115.329 173.222 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 25.3 mt -59.06 -48.4 81.75 Favored 'General case' 0 N--CA 1.429 -1.483 0 CA-C-O 121.944 0.878 . . . . 1.0 112.854 176.456 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 47.7 m -66.6 -45.82 77.94 Favored 'General case' 0 N--CA 1.43 -1.436 0 N-CA-C 114.456 1.28 . . . . 1.0 114.456 -175.748 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 96.7 mt -58.03 -45.9 88.07 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.462 0 O-C-N 119.988 -1.695 . . . . 1.0 112.143 172.677 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 8.0 tt0 -58.91 -48.3 81.94 Favored 'General case' 0 N--CA 1.43 -1.442 0 O-C-N 121.626 -0.671 . . . . 1.0 112.59 176.705 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 33.7 tt0 -58.47 -44.87 89.48 Favored 'General case' 0 N--CA 1.431 -1.41 0 C-N-CA 125.161 1.384 . . . . 1.0 114.107 177.92 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -53.52 -52.52 59.37 Favored 'General case' 0 N--CA 1.43 -1.453 0 C-N-CA 124.184 0.994 . . . . 1.0 112.344 174.656 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 35.4 mt -69.99 -51.04 35.71 Favored 'General case' 0 N--CA 1.431 -1.412 0 N-CA-C 113.658 0.985 . . . . 1.0 113.658 -176.429 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 23.0 t70 -62.9 -41.92 99.61 Favored 'General case' 0 N--CA 1.429 -1.495 0 N-CA-C 115.146 1.536 . . . . 1.0 115.146 -178.174 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 23.6 t70 -74.01 -26.1 60.26 Favored 'General case' 0 N--CA 1.43 -1.438 0 O-C-N 120.182 -1.574 . . . . 1.0 113.066 -179.04 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 24' ' ' TRP . . . . . . . . . . . . . 67.7 t-105 -72.26 136.64 46.37 Favored 'General case' 0 N--CA 1.43 -1.471 0 O-C-N 119.742 -1.849 . . . . 1.0 112.63 177.569 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 34.3 t70 -138.95 150.26 45.69 Favored 'General case' 0 N--CA 1.43 -1.445 0 N-CA-C 106.926 -1.509 . . . . 1.0 106.926 179.273 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -163.91 -121.88 0.58 Allowed Glycine 0 N--CA 1.43 -1.757 0 O-C-N 121.29 -0.881 . . . . 1.0 111.599 -174.822 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 4.2 t0 -92.0 -32.25 15.29 Favored 'General case' 0 N--CA 1.43 -1.471 0 C-N-CA 125.357 1.463 . . . . 1.0 108.614 172.293 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 18.3 p -95.14 166.94 11.67 Favored 'General case' 0 N--CA 1.429 -1.482 0 C-N-CA 126.499 1.92 . . . . 1.0 111.591 179.335 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 2.6 t70 -132.03 178.91 6.42 Favored 'General case' 0 N--CA 1.43 -1.453 0 C-N-CA 124.677 1.191 . . . . 1.0 109.272 177.018 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 9.3 tp -157.21 134.02 2.2 Favored 'Isoleucine or valine' 0 N--CA 1.428 -1.542 0 C-N-CA 125.43 1.492 . . . . 1.0 107.072 -154.632 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 2.1 t70 -143.81 106.67 4.48 Favored 'General case' 0 N--CA 1.429 -1.495 0 O-C-N 120.241 -1.537 . . . . 1.0 109.445 162.783 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 71.2 m -90.68 132.62 35.68 Favored 'General case' 0 N--CA 1.431 -1.42 0 O-C-N 120.513 -1.367 . . . . 1.0 111.171 175.571 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 35.2 tt0 -107.27 132.01 53.57 Favored 'General case' 0 N--CA 1.43 -1.474 0 C-N-CA 126.365 1.866 . . . . 1.0 109.769 -168.138 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 2.8 tp -117.2 109.03 26.37 Favored 'Isoleucine or valine' 0 N--CA 1.428 -1.535 0 CA-C-O 124.547 2.118 . . . . 1.0 108.236 -172.314 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 3.5 t-20 -108.29 79.35 1.25 Allowed 'General case' 0 N--CA 1.429 -1.483 0 C-N-CA 125.575 1.55 . . . . 1.0 108.288 173.98 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . 75.52 -80.17 1.04 Allowed Glycine 0 N--CA 1.429 -1.771 0 O-C-N 120.326 -1.484 . . . . 1.0 114.998 173.291 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -142.66 37.35 1.54 Allowed Glycine 0 N--CA 1.43 -1.766 0 N-CA-C 108.987 -1.645 . . . . 1.0 108.987 173.384 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 69.7 t -133.67 117.77 28.02 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.404 0 N-CA-C 104.519 -2.4 . . . . 1.0 104.519 176.383 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -110.08 137.32 48.0 Favored 'General case' 0 N--CA 1.431 -1.42 0 CA-C-O 123.728 1.728 . . . . 1.0 111.781 177.042 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -133.06 125.2 29.1 Favored 'General case' 0 N--CA 1.429 -1.479 0 N-CA-C 106.142 -1.799 . . . . 1.0 106.142 -170.174 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 86.1 mt -99.89 134.07 40.6 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.481 0 N-CA-C 107.534 -1.284 . . . . 1.0 107.534 -169.192 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -131.7 126.67 35.13 Favored 'General case' 0 N--CA 1.431 -1.414 0 N-CA-C 112.643 0.609 . . . . 1.0 112.643 174.944 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 43' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -108.15 167.51 9.95 Favored 'General case' 0 N--CA 1.431 -1.405 0 C-N-CA 125.482 1.513 . . . . 1.0 109.437 174.278 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 70.3 mt-10 -55.86 -26.19 45.79 Favored 'General case' 0 N--CA 1.429 -1.484 0 N-CA-C 117.059 2.244 . . . . 1.0 117.059 179.644 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 27.7 t-20 -63.87 -18.15 63.88 Favored 'General case' 0 N--CA 1.43 -1.442 0 C-N-CA 126.374 1.869 . . . . 1.0 112.828 176.363 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 96.32 -6.32 65.82 Favored Glycine 0 N--CA 1.431 -1.652 0 O-C-N 120.311 -1.493 . . . . 1.0 111.313 176.345 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -79.18 166.36 22.29 Favored 'General case' 0 N--CA 1.431 -1.424 0 C-N-CA 128.033 2.533 . . . . 1.0 111.265 -177.914 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 10.5 ptpt -157.17 148.14 21.67 Favored 'General case' 0 N--CA 1.431 -1.417 0 O-C-N 120.672 -1.267 . . . . 1.0 113.599 -162.434 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 9.2 mm -123.6 142.83 38.89 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.445 0 N-CA-C 105.703 -1.962 . . . . 1.0 105.703 175.672 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 50' ' ' ILE . . . . . 0.551 HG23 ' HB3' ' A' ' 63' ' ' ALA . 4.1 tp -126.5 129.06 71.77 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.509 0 CA-C-N 120.753 1.615 . . . . 1.0 110.076 175.606 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 3.3 mt -124.99 124.84 68.52 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.464 0 C-N-CA 127.689 2.396 . . . . 1.0 111.139 -177.263 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 52' ' ' ASN . . . . . 0.526 ' H ' ' HD1' ' A' ' 61' ' ' TRP . 40.9 t30 -160.04 173.14 16.29 Favored 'General case' 0 N--CA 1.43 -1.456 0 C-N-CA 128.802 2.841 . . . . 1.0 104.564 -173.901 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -153.35 147.99 26.23 Favored 'General case' 0 N--CA 1.429 -1.48 0 O-C-N 119.629 -1.92 . . . . 1.0 113.333 -154.455 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 34.1 mm-40 -121.13 97.63 5.61 Favored 'General case' 0 N--CA 1.43 -1.453 0 C-N-CA 125.361 1.465 . . . . 1.0 112.002 -172.51 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 18.9 tt0 -69.6 -39.89 12.83 Favored Pre-proline 0 N--CA 1.431 -1.416 0 N-CA-C 116.574 2.064 . . . . 1.0 116.574 -174.988 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 52.7 Cg_exo -71.16 -22.62 25.59 Favored 'Trans proline' 0 N--CA 1.433 -2.072 0 CA-C-N 126.228 3.26 . . . . 1.0 114.844 174.794 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 33.2 mt -94.04 -30.92 14.44 Favored 'General case' 0 N--CA 1.431 -1.412 0 C-N-CA 122.895 0.478 . . . . 1.0 111.312 -168.581 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 1.3 m-70 85.67 56.5 0.01 OUTLIER 'General case' 0 N--CA 1.43 -1.425 0 C-N-CA 127.581 2.352 . . . . 1.0 110.102 176.826 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -156.23 157.66 36.22 Favored 'General case' 0 N--CA 1.43 -1.449 0 O-C-N 120.409 -1.432 . . . . 1.0 109.71 -178.468 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 79.2 t -121.06 151.43 24.12 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.511 0 N-CA-C 105.63 -1.989 . . . . 1.0 105.63 173.045 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 61' ' ' TRP . . . . . 0.526 ' HD1' ' H ' ' A' ' 52' ' ' ASN . 0.0 OUTLIER -102.21 151.76 21.83 Favored 'General case' 0 N--CA 1.43 -1.467 0 CA-C-N 121.122 1.783 . . . . 1.0 114.275 177.291 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 61.5 mt -123.28 101.72 7.53 Favored 'General case' 0 N--CA 1.43 -1.428 0 N-CA-C 107.03 -1.47 . . . . 1.0 107.03 166.503 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 63' ' ' ALA . . . . . 0.551 ' HB3' HG23 ' A' ' 50' ' ' ILE . . . -102.05 112.91 25.73 Favored 'General case' 0 N--CA 1.43 -1.435 0 O-C-N 121.05 -1.032 . . . . 1.0 110.517 170.889 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 64' ' ' THR . . . . . . . . . . . . . 77.1 p -119.62 -122.44 0.29 Allowed 'General case' 0 N--CA 1.43 -1.472 0 C-N-CA 126.749 2.02 . . . . 1.0 113.652 -156.782 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 13.7 tmtt? -96.69 -66.33 0.91 Allowed 'General case' 0 N--CA 1.43 -1.426 0 C-N-CA 126.047 1.739 . . . . 1.0 110.726 -170.678 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 20.0 tt0 -77.62 -24.0 49.69 Favored 'General case' 0 N--CA 1.429 -1.487 0 O-C-N 121.26 -0.9 . . . . 1.0 112.694 -176.773 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 172.08 -60.39 0.16 Allowed Glycine 0 N--CA 1.431 -1.68 0 O-C-N 120.398 -1.439 . . . . 1.0 110.18 178.855 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 88.1 170.18 45.74 Favored Glycine 0 N--CA 1.431 -1.678 0 C-N-CA 123.766 0.698 . . . . 1.0 112.521 -177.893 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -166.23 171.79 11.85 Favored 'General case' 0 N--CA 1.429 -1.475 0 C-N-CA 125.986 1.715 . . . . 1.0 110.065 179.398 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 70' ' ' HIS . . . . . 0.445 ' HA ' ' HA ' ' A' ' 61' ' ' TRP . 10.7 p80 -75.68 159.33 31.26 Favored 'General case' 0 N--CA 1.431 -1.393 0 N-CA-C 115.736 1.754 . . . . 1.0 115.736 -178.161 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 47.2 p90 -121.01 137.02 54.85 Favored 'General case' 0 N--CA 1.429 -1.48 0 N-CA-C 114.427 1.269 . . . . 1.0 114.427 -179.912 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 3.3 m-20 -127.56 172.58 10.6 Favored 'General case' 0 N--CA 1.43 -1.462 0 C-N-CA 126.642 1.977 . . . . 1.0 108.364 -174.246 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 19.2 mt -101.01 116.24 32.37 Favored 'General case' 0 N--CA 1.43 -1.442 0 O-C-N 119.837 -1.789 . . . . 1.0 111.893 178.228 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 39.7 mmtm -67.74 -47.71 68.51 Favored 'General case' 0 N--CA 1.429 -1.495 0 O-C-N 120.743 -1.223 . . . . 1.0 111.491 151.889 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . 179.69 -81.81 0.06 OUTLIER Glycine 0 N--CA 1.431 -1.696 0 O-C-N 120.176 -1.578 . . . . 1.0 114.159 176.502 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -89.7 -8.3 52.66 Favored 'General case' 0 N--CA 1.43 -1.474 0 C-N-CA 125.386 1.474 . . . . 1.0 109.173 170.383 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 16.0 mt-10 -124.39 123.01 39.24 Favored 'General case' 0 N--CA 1.429 -1.485 0 N-CA-C 103.797 -2.668 . . . . 1.0 103.797 -172.227 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 78' ' ' TRP . . . . . . . . . . . . . 81.4 m95 -86.31 135.35 33.57 Favored 'General case' 0 N--CA 1.43 -1.464 0 N-CA-C 105.508 -2.034 . . . . 1.0 105.508 164.317 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -129.7 153.17 38.42 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.472 0 O-C-N 119.98 -1.7 . . . . 1.0 107.936 -171.551 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 64.3 m -85.91 147.24 26.35 Favored 'General case' 0 N--CA 1.43 -1.43 0 O-C-N 120.46 -1.4 . . . . 1.0 112.591 -177.48 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 28.3 t70 -63.77 -39.94 95.49 Favored 'General case' 0 N--CA 1.431 -1.404 0 O-C-N 119.7 -1.875 . . . . 1.0 115.679 -174.242 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 12.3 ptm180 -130.5 177.22 7.52 Favored 'General case' 0 N--CA 1.43 -1.436 0 O-C-N 120.699 -1.251 . . . . 1.0 112.016 174.839 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 83' ' ' SER . . . . . . . . . . . . 0.408 9.5 p 72.3 -55.96 0.66 Allowed 'General case' 0 N--CA 1.43 -1.444 0 C-N-CA 128.554 2.742 . . . . 1.0 117.418 171.145 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -168.48 93.95 0.11 Allowed Glycine 0 N--CA 1.431 -1.684 0 N-CA-C 109.712 -1.355 . . . . 1.0 109.712 178.73 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 10.5 pt-20 -72.33 96.69 1.9 Allowed 'General case' 0 N--CA 1.431 -1.407 0 N-CA-C 118.064 2.616 . . . . 1.0 118.064 -166.053 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 57.4 m -167.33 125.92 1.32 Allowed 'General case' 0 N--CA 1.429 -1.49 0 O-C-N 119.347 -2.096 . . . . 1.0 110.836 171.6 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . 0.294 0.1 OUTLIER -51.03 -86.14 0.0 OUTLIER 'General case' 0 N--CA 1.429 -1.475 0 N-CA-C 117.195 2.294 . . . . 1.0 117.195 173.539 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 88' ' ' TRP . . . . . . . . . . . . . 22.3 m95 -58.96 -39.95 83.23 Favored 'General case' 0 N--CA 1.431 -1.422 0 CA-C-N 121.2 1.818 . . . . 1.0 113.584 -173.27 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 9.3 t70 -67.69 -39.96 84.41 Favored 'General case' 0 N--CA 1.43 -1.455 0 N-CA-C 114.388 1.255 . . . . 1.0 114.388 -176.82 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 30.3 tp -76.03 -41.61 50.38 Favored 'General case' 0 N--CA 1.43 -1.438 0 O-C-N 119.098 -2.251 . . . . 1.0 112.483 177.363 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -48.01 -47.38 33.35 Favored 'General case' 0 CA--C 1.489 -1.394 0 C-N-CA 127.495 2.318 . . . . 1.0 113.376 166.835 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 1.3 tp10 -56.52 -51.9 66.77 Favored 'General case' 0 N--CA 1.43 -1.426 0 C-N-CA 127.105 2.162 . . . . 1.0 113.29 170.387 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 7.2 tt0 -52.47 -51.06 61.27 Favored 'General case' 0 N--CA 1.43 -1.464 0 O-C-N 120.668 -1.27 . . . . 1.0 112.866 174.539 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -53.19 -48.73 67.83 Favored 'General case' 0 N--CA 1.43 -1.432 0 N-CA-C 115.034 1.494 . . . . 1.0 115.034 172.706 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -64.45 -53.5 47.3 Favored 'General case' 0 N--CA 1.429 -1.495 0 O-C-N 120.135 -1.603 . . . . 1.0 113.255 178.989 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 96' ' ' THR . . . . . 0.602 HG22 ' H ' ' A' ' 103' ' ' VAL . 47.5 p -59.4 -38.04 79.56 Favored 'General case' 0 CA--C 1.488 -1.431 0 C-N-CA 126.543 1.937 . . . . 1.0 114.051 179.439 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 5.8 pt20 -78.65 -27.19 45.23 Favored 'General case' 0 N--CA 1.429 -1.476 0 N-CA-C 114.871 1.434 . . . . 1.0 114.871 177.944 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 12.4 mm100 -74.67 -38.74 62.35 Favored 'General case' 0 N--CA 1.431 -1.421 0 O-C-N 120.22 -1.55 . . . . 1.0 112.129 170.718 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -79.86 -46.31 17.08 Favored 'General case' 0 N--CA 1.43 -1.45 0 N-CA-C 114.928 1.455 . . . . 1.0 114.928 179.669 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . 122.5 0.1 10.25 Favored Glycine 0 N--CA 1.431 -1.659 0 N-CA-C 116.475 1.35 . . . . 1.0 116.475 174.433 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 11.2 pt-20 -153.56 174.33 14.58 Favored 'General case' 0 N--CA 1.429 -1.499 0 CA-C-N 119.355 1.577 . . . . 1.0 110.223 -178.813 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 16.9 m -74.2 121.62 21.52 Favored 'General case' 0 N--CA 1.43 -1.452 0 O-C-N 120.736 -1.228 . . . . 1.0 112.738 177.928 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 103' ' ' VAL . . . . . 0.602 ' H ' HG22 ' A' ' 96' ' ' THR . 40.5 t -120.87 134.92 62.71 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.458 0 N-CA-C 102.284 -3.228 . . . . 1.0 102.284 -175.195 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 43.7 p -106.73 129.02 54.68 Favored 'General case' 0 N--CA 1.43 -1.457 0 N-CA-C 115.218 1.562 . . . . 1.0 115.218 -166.336 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -139.69 -35.8 0.52 Allowed 'General case' 0 N--CA 1.43 -1.434 0 C-N-CA 127.155 2.182 . . . . 1.0 108.938 167.959 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 2.9 tmm_? . . . . . 0 C--O 1.26 1.609 0 C-N-CA 125.737 1.615 . . . . 1.0 112.859 -167.59 . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 13.4 tpt . . . . . 0 CA--C 1.491 -1.304 0 CA-C-O 120.752 0.311 . . . . 1.0 110.441 . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 43.1 m-80 -68.19 -49.06 63.31 Favored 'General case' 0 N--CA 1.43 -1.453 0 C-N-CA 124.61 1.164 . . . . 1.0 112.34 -176.34 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -57.04 -48.97 77.25 Favored 'General case' 0 N--CA 1.43 -1.432 0 C-N-CA 126.806 2.042 . . . . 1.0 113.857 172.93 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 27.8 t -50.88 -52.9 37.23 Favored 'General case' 0 N--CA 1.431 -1.401 0 C-N-CA 125.722 1.609 . . . . 1.0 114.099 172.579 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 49.7 tt0 -62.86 -52.42 63.17 Favored 'General case' 0 N--CA 1.431 -1.395 0 C-N-CA 124.765 1.226 . . . . 1.0 113.976 -178.452 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -63.46 -35.31 80.03 Favored 'General case' 0 N--CA 1.43 -1.441 0 O-C-N 120.673 -1.267 . . . . 1.0 114.362 178.626 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 9.0 t-160 -66.49 -37.79 85.86 Favored 'General case' 0 N--CA 1.43 -1.432 0 O-C-N 120.198 -1.564 . . . . 1.0 113.791 172.755 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 1.5 mmm180 -68.56 -43.93 75.56 Favored 'General case' 0 N--CA 1.43 -1.432 0 O-C-N 120.055 -1.653 . . . . 1.0 113.687 175.73 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 67.1 mt -56.52 -46.26 80.67 Favored 'General case' 0 N--CA 1.43 -1.45 0 C-N-CA 124.666 1.186 . . . . 1.0 112.558 172.251 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -54.51 -55.69 26.47 Favored 'General case' 0 N--CA 1.43 -1.442 0 C-N-CA 124.477 1.111 . . . . 1.0 113.498 171.6 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 18.7 t70 -46.16 -48.15 17.51 Favored 'General case' 0 N--CA 1.43 -1.45 0 C-N-CA 126.491 1.917 . . . . 1.0 114.093 178.284 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 12.5 mm100 -55.72 -60.6 3.21 Favored 'General case' 0 N--CA 1.43 -1.456 0 N-CA-C 114.522 1.305 . . . . 1.0 114.522 172.944 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 2.5 pp -74.49 -37.68 63.09 Favored 'General case' 0 N--CA 1.43 -1.459 0 N-CA-C 116.585 2.068 . . . . 1.0 116.585 -175.497 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 11.9 m0 -55.6 -47.06 77.11 Favored 'General case' 0 N--CA 1.431 -1.411 0 C-N-CA 127.753 2.421 . . . . 1.0 112.109 171.663 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 47.8 tp -59.73 -45.25 92.75 Favored 'General case' 0 N--CA 1.43 -1.451 0 O-C-N 121.057 -1.027 . . . . 1.0 113.468 172.142 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 25.5 m -56.28 -46.34 79.78 Favored 'General case' 0 N--CA 1.431 -1.383 0 N-CA-C 114.853 1.427 . . . . 1.0 114.853 175.387 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 67.6 mt -64.75 -46.21 92.82 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.437 0 O-C-N 120.431 -1.418 . . . . 1.0 112.206 178.263 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 58.1 tt0 -53.41 -58.41 7.22 Favored 'General case' 0 N--CA 1.43 -1.443 0 C-N-CA 125.047 1.339 . . . . 1.0 111.939 174.765 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 23.7 mt-10 -55.68 -55.43 32.26 Favored 'General case' 0 N--CA 1.43 -1.446 0 C-N-CA 125.789 1.635 . . . . 1.0 115.138 176.748 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 7.2 tpm_? -52.31 -49.18 64.74 Favored 'General case' 0 N--CA 1.43 -1.445 0 C-N-CA 124.578 1.151 . . . . 1.0 113.056 -177.456 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 21' ' ' LEU . . . . . 0.422 HD23 HG21 ' A' ' 41' ' ' ILE . 12.8 tp -81.51 -36.51 29.15 Favored 'General case' 0 N--CA 1.43 -1.432 0 N-CA-C 113.991 1.108 . . . . 1.0 113.991 -176.335 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 27.4 t70 -64.17 -34.36 77.9 Favored 'General case' 0 N--CA 1.431 -1.42 0 O-C-N 119.994 -1.691 . . . . 1.0 114.51 176.567 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 10.1 t70 -67.87 -26.81 66.21 Favored 'General case' 0 N--CA 1.43 -1.431 0 O-C-N 120.185 -1.572 . . . . 1.0 113.388 172.752 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 24' ' ' TRP . . . . . . . . . . . . . 0.2 OUTLIER -75.92 148.84 37.93 Favored 'General case' 0 N--CA 1.43 -1.426 0 O-C-N 120.154 -1.591 . . . . 1.0 114.003 -167.512 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 2.3 t70 -129.1 133.78 47.8 Favored 'General case' 0 N--CA 1.429 -1.491 0 O-C-N 120.528 -1.358 . . . . 1.0 108.972 -175.099 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -166.64 -149.16 5.85 Favored Glycine 0 N--CA 1.431 -1.652 0 O-C-N 120.536 -1.352 . . . . 1.0 112.521 -171.439 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 10.9 t70 -77.03 -41.65 41.72 Favored 'General case' 0 N--CA 1.431 -1.421 0 N-CA-C 107.88 -1.156 . . . . 1.0 107.88 168.439 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 47.1 m -65.2 141.62 58.6 Favored 'General case' 0 N--CA 1.43 -1.471 0 C-N-CA 125.275 1.43 . . . . 1.0 114.236 174.083 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 20.0 t70 -110.97 147.3 35.0 Favored 'General case' 0 N--CA 1.429 -1.517 0 N-CA-C 105.993 -1.854 . . . . 1.0 105.993 171.5 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 48.6 mm -135.02 115.7 19.07 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.457 0 C-N-CA 125.555 1.542 . . . . 1.0 108.528 -160.895 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -121.83 110.22 15.63 Favored 'General case' 0 N--CA 1.43 -1.472 0 C-N-CA 124.461 1.104 . . . . 1.0 109.188 158.718 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 10.3 t -77.13 143.73 38.94 Favored 'General case' 0 N--CA 1.429 -1.507 0 O-C-N 118.625 -2.547 . . . . 1.0 110.204 164.952 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 52.2 mt-10 -101.74 140.07 36.53 Favored 'General case' 0 N--CA 1.431 -1.415 0 C-N-CA 124.37 1.068 . . . . 1.0 109.302 172.211 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 2.5 tp -122.1 107.33 19.56 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.488 0 CA-C-O 124.327 2.013 . . . . 1.0 108.372 177.293 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 35.1 m120 -117.79 68.57 0.76 Allowed 'General case' 0 N--CA 1.43 -1.434 0 CA-C-N 114.425 -1.261 . . . . 1.0 109.651 176.499 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . 73.17 -86.55 0.58 Allowed Glycine 0 N--CA 1.43 -1.713 0 C-N-CA 125.363 1.459 . . . . 1.0 114.334 173.088 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -120.34 27.31 6.7 Favored Glycine 0 N--CA 1.429 -1.79 0 C-N-CA 125.332 1.444 . . . . 1.0 111.866 175.019 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 66.4 t -128.34 129.11 69.03 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.449 0 N-CA-C 107.661 -1.237 . . . . 1.0 107.661 169.628 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 46.3 mt -113.02 123.97 51.56 Favored 'General case' 0 N--CA 1.429 -1.481 0 CA-C-O 122.846 1.307 . . . . 1.0 108.655 166.754 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -121.84 116.33 24.24 Favored 'General case' 0 N--CA 1.43 -1.455 0 N-CA-C 106.348 -1.723 . . . . 1.0 106.348 179.385 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 41' ' ' ILE . . . . . 0.422 HG21 HD23 ' A' ' 21' ' ' LEU . 49.3 mt -94.04 116.1 34.45 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.411 0 O-C-N 119.625 -1.922 . . . . 1.0 108.644 -172.985 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 47.0 p -109.76 120.06 41.29 Favored 'General case' 0 N--CA 1.43 -1.438 0 N-CA-C 113.237 0.828 . . . . 1.0 113.237 -173.656 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 43' ' ' PHE . . . . . . . . . . . . 0.25 1.2 p90 -118.23 166.34 12.72 Favored 'General case' 0 N--CA 1.429 -1.492 0 CA-C-O 123.322 1.534 . . . . 1.0 114.093 179.487 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 1.1 pp20? -63.13 -31.4 72.54 Favored 'General case' 0 N--CA 1.43 -1.45 0 N-CA-C 117.517 2.414 . . . . 1.0 117.517 -159.179 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 59.5 m-80 -74.81 -0.36 18.08 Favored 'General case' 0 N--CA 1.431 -1.411 0 N-CA-C 114.905 1.446 . . . . 1.0 114.905 176.67 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 99.41 -1.3 57.19 Favored Glycine 0 N--CA 1.432 -1.613 0 O-C-N 120.673 -1.267 . . . . 1.0 113.255 166.849 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 3.4 p -96.52 164.47 12.6 Favored 'General case' 0 N--CA 1.428 -1.548 0 C-N-CA 127.028 2.131 . . . . 1.0 110.255 178.439 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 54.3 pttt -162.35 158.93 24.74 Favored 'General case' 0 N--CA 1.429 -1.479 0 CA-C-O 122.468 1.128 . . . . 1.0 113.655 -171.108 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 17.9 mm -103.7 140.14 22.71 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.412 0 C-N-CA 125.258 1.423 . . . . 1.0 107.232 179.073 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 50' ' ' ILE . . . . . 0.433 ' HB ' ' HB3' ' A' ' 63' ' ' ALA . 1.2 mm -122.39 108.04 20.89 Favored 'Isoleucine or valine' 0 N--CA 1.428 -1.53 0 CA-C-N 119.649 1.113 . . . . 1.0 110.299 -175.34 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 2.7 mt -122.82 98.6 5.82 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.463 0 CA-C-O 123.357 1.551 . . . . 1.0 111.828 179.117 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 2.3 m120 -108.81 148.0 31.23 Favored 'General case' 0 N--CA 1.429 -1.51 0 C-N-CA 127.896 2.478 . . . . 1.0 108.727 174.796 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 39.1 ttp180 -154.29 134.29 13.1 Favored 'General case' 0 N--CA 1.429 -1.496 0 CA-C-N 113.729 -1.578 . . . . 1.0 108.305 -167.055 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 5.0 mm100 -89.55 129.47 36.01 Favored 'General case' 0 N--CA 1.431 -1.391 0 N-CA-C 106.687 -1.598 . . . . 1.0 106.687 163.617 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 37.8 tt0 -63.7 -51.25 67.05 Favored Pre-proline 0 N--CA 1.431 -1.393 0 CA-C-O 116.573 -1.68 . . . . 1.0 113.431 172.581 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 52.6 Cg_exo -67.29 -175.69 0.71 Allowed 'Trans proline' 0 N--CA 1.433 -2.055 0 CA-C-N 125.307 2.931 . . . . 1.0 114.707 162.707 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 15.0 mt 82.38 -30.07 0.1 Allowed 'General case' 0 N--CA 1.43 -1.452 0 C-N-CA 127.657 2.383 . . . . 1.0 114.934 169.439 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER 76.87 47.38 0.07 Allowed 'General case' 0 N--CA 1.432 -1.364 0 C-N-CA 126.247 1.819 . . . . 1.0 114.204 170.433 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 38.2 tt0 -160.36 152.12 19.92 Favored 'General case' 0 N--CA 1.429 -1.48 0 O-C-N 120.693 -1.254 . . . . 1.0 108.27 179.031 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 15.6 t -120.73 156.91 23.91 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.486 0 C-N-CA 124.819 1.248 . . . . 1.0 109.83 179.634 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 61' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -99.35 153.49 18.93 Favored 'General case' 0 N--CA 1.43 -1.427 0 O-C-N 120.567 -1.333 . . . . 1.0 111.419 170.198 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -137.45 90.9 2.55 Favored 'General case' 0 N--CA 1.43 -1.457 0 O-C-N 120.103 -1.623 . . . . 1.0 109.862 179.116 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 63' ' ' ALA . . . . . 0.433 ' HB3' ' HB ' ' A' ' 50' ' ' ILE . . . -104.37 139.92 38.65 Favored 'General case' 0 N--CA 1.429 -1.492 0 O-C-N 119.943 -1.723 . . . . 1.0 111.858 175.647 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 64' ' ' THR . . . . . . . . . . . . . 80.8 p -150.44 -130.28 0.05 OUTLIER 'General case' 0 N--CA 1.43 -1.468 0 C-N-CA 126.633 1.973 . . . . 1.0 105.783 -163.082 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 4.7 tmtt? -84.82 -39.64 18.11 Favored 'General case' 0 N--CA 1.43 -1.434 0 O-C-N 120.254 -1.529 . . . . 1.0 110.913 166.076 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 1.7 tp-100 -78.62 -25.14 45.05 Favored 'General case' 0 N--CA 1.43 -1.453 0 N-CA-C 114.937 1.458 . . . . 1.0 114.937 -150.785 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 169.76 -52.04 0.2 Allowed Glycine 0 N--CA 1.43 -1.729 0 O-C-N 121.076 -1.015 . . . . 1.0 113.16 174.632 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 116.48 93.53 1.79 Allowed Glycine 0 N--CA 1.43 -1.7 0 C-N-CA 125.255 1.407 . . . . 1.0 110.843 -173.691 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 69' ' ' TYR . . . . . 0.486 ' CD1' ' HG2' ' A' ' 82' ' ' ARG . 13.5 m-85 -122.07 143.26 49.63 Favored 'General case' 0 N--CA 1.43 -1.464 0 N-CA-C 107.962 -1.125 . . . . 1.0 107.962 -166.406 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 70' ' ' HIS . . . . . . . . . . . . 0.275 1.3 p80 -89.47 160.92 16.52 Favored 'General case' 0 N--CA 1.429 -1.482 0 O-C-N 119.376 -2.078 . . . . 1.0 113.746 178.636 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 71' ' ' PHE . . . . . . . . . . . . 0.27 11.9 t80 -139.34 125.0 19.45 Favored 'General case' 0 N--CA 1.429 -1.48 0 CA-C-N 115.333 -0.849 . . . . 1.0 111.076 -149.589 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -126.25 161.4 27.83 Favored 'General case' 0 N--CA 1.431 -1.402 0 C-N-CA 123.746 0.818 . . . . 1.0 109.974 178.089 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 57.3 tp -96.11 121.83 38.29 Favored 'General case' 0 N--CA 1.43 -1.434 0 O-C-N 119.599 -1.938 . . . . 1.0 110.403 176.391 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 20.0 mmmt -84.89 -48.56 9.2 Favored 'General case' 0 N--CA 1.43 -1.461 0 O-C-N 120.989 -1.069 . . . . 1.0 112.815 175.74 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -171.85 -69.77 0.04 OUTLIER Glycine 0 N--CA 1.429 -1.77 0 N-CA-C 110.843 -0.903 . . . . 1.0 110.843 179.007 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 20.2 p-10 -90.06 -26.92 20.03 Favored 'General case' 0 N--CA 1.43 -1.469 0 O-C-N 121.07 -1.253 . . . . 1.0 111.09 179.089 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 5.8 mt-10 -152.58 155.75 37.97 Favored 'General case' 0 N--CA 1.429 -1.492 0 N-CA-C 104.161 -2.533 . . . . 1.0 104.161 -164.417 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 78' ' ' TRP . . . . . . . . . . . . . 31.0 m95 -86.69 123.59 32.03 Favored 'General case' 0 N--CA 1.43 -1.456 0 N-CA-C 107.084 -1.45 . . . . 1.0 107.084 -178.311 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 3.3 mt -101.47 137.12 30.26 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.484 0 CA-C-O 123.893 1.806 . . . . 1.0 106.332 176.804 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 74.8 m -77.17 145.95 37.37 Favored 'General case' 0 N--CA 1.428 -1.527 0 CA-C-N 114.411 -1.268 . . . . 1.0 109.977 -175.593 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 37.6 t0 -73.44 -43.51 60.2 Favored 'General case' 0 N--CA 1.431 -1.416 0 O-C-N 120.469 -1.394 . . . . 1.0 111.953 -174.007 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 82' ' ' ARG . . . . . 0.486 ' HG2' ' CD1' ' A' ' 69' ' ' TYR . 0.1 OUTLIER -79.11 134.55 36.72 Favored 'General case' 0 N--CA 1.43 -1.463 0 O-C-N 119.977 -1.702 . . . . 1.0 110.378 176.911 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 8.0 t 65.58 -66.24 0.15 Allowed 'General case' 0 N--CA 1.43 -1.437 0 N-CA-C 116.215 1.932 . . . . 1.0 116.215 -179.951 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 130.48 89.49 0.52 Allowed Glycine 0 N--CA 1.43 -1.711 0 N-CA-C 107.474 -2.25 . . . . 1.0 107.474 -167.417 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 52.3 mt-10 -137.97 -168.33 2.33 Favored 'General case' 0 N--CA 1.431 -1.413 0 N-CA-C 105.162 -2.162 . . . . 1.0 105.162 -178.755 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 32.0 m -154.99 130.71 9.96 Favored 'General case' 0 N--CA 1.43 -1.471 0 O-C-N 119.346 -2.096 . . . . 1.0 111.102 -150.661 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 1.1 t80 -25.79 -92.56 0.0 OUTLIER 'General case' 0 N--CA 1.429 -1.492 0 N-CA-C 119.674 3.213 . . . . 1.0 119.674 174.7 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 88' ' ' TRP . . . . . . . . . . . . . 78.8 m95 -72.12 -26.8 62.26 Favored 'General case' 0 N--CA 1.429 -1.483 0 O-C-N 120.392 -1.442 . . . . 1.0 110.379 -169.819 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -68.42 -49.97 56.14 Favored 'General case' 0 N--CA 1.43 -1.454 0 C-N-CA 125.409 1.483 . . . . 1.0 113.139 178.413 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -70.14 -42.74 72.16 Favored 'General case' 0 N--CA 1.429 -1.48 0 CA-C-O 122.969 1.366 . . . . 1.0 111.73 -177.565 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 24.6 tp -53.76 -49.86 67.29 Favored 'General case' 0 N--CA 1.43 -1.459 0 C-N-CA 126.371 1.868 . . . . 1.0 112.946 173.996 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 1.9 tm-20 -58.21 -55.76 30.81 Favored 'General case' 0 N--CA 1.43 -1.443 0 C-N-CA 126.742 2.017 . . . . 1.0 114.816 173.71 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 3.6 pt20 -63.96 -43.42 95.83 Favored 'General case' 0 N--CA 1.43 -1.437 0 O-C-N 120.577 -1.327 . . . . 1.0 114.068 -177.452 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -62.79 -47.97 81.15 Favored 'General case' 0 N--CA 1.43 -1.442 0 O-C-N 120.635 -1.29 . . . . 1.0 113.057 175.098 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -63.43 -35.99 82.24 Favored 'General case' 0 N--CA 1.428 -1.536 0 O-C-N 120.312 -1.493 . . . . 1.0 113.399 176.98 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 91.5 m -57.75 -51.96 67.41 Favored 'General case' 0 N--CA 1.43 -1.456 0 C-N-CA 125.526 1.53 . . . . 1.0 112.474 173.149 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 5.0 pt20 -70.18 -31.34 68.77 Favored 'General case' 0 N--CA 1.43 -1.45 0 N-CA-C 114.75 1.389 . . . . 1.0 114.75 -179.847 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 51.0 mt-30 -66.26 -46.71 76.12 Favored 'General case' 0 N--CA 1.43 -1.468 0 O-C-N 119.741 -1.849 . . . . 1.0 114.806 169.876 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -77.98 -46.88 19.85 Favored 'General case' 0 N--CA 1.428 -1.534 0 N-CA-C 113.912 1.078 . . . . 1.0 113.912 -176.335 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . 99.58 24.7 9.84 Favored Glycine 0 N--CA 1.431 -1.691 0 C-N-CA 124.502 1.048 . . . . 1.0 113.422 -175.499 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 13.7 pt-20 -161.63 160.69 29.08 Favored 'General case' 0 N--CA 1.429 -1.482 0 N-CA-C 106.495 -1.669 . . . . 1.0 106.495 174.672 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 70.2 m -66.63 112.18 4.03 Favored 'General case' 0 N--CA 1.429 -1.5 0 CA-C-N 120.087 1.312 . . . . 1.0 112.43 -178.522 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 39.9 t -100.49 108.43 23.03 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.453 0 N-CA-C 107.302 -1.37 . . . . 1.0 107.302 173.867 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 44.0 p -141.31 127.72 19.95 Favored 'General case' 0 N--CA 1.43 -1.442 0 N-CA-C 113.792 1.034 . . . . 1.0 113.792 -169.483 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 5.2 t80 -93.85 -24.31 17.79 Favored 'General case' 0 N--CA 1.43 -1.458 0 C-N-CA 124.059 0.944 . . . . 1.0 109.759 167.366 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 18.3 mmm-85 . . . . . 0 C--O 1.261 1.661 0 O-C-N 120.971 -1.081 . . . . 1.0 110.385 -175.56 . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 72.7 mtp . . . . . 0 CA--C 1.49 -1.348 0 N-CA-C 113.519 0.933 . . . . 1.0 113.519 . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 23.6 t-20 -114.47 136.99 52.4 Favored 'General case' 0 N--CA 1.431 -1.397 0 O-C-N 120.996 -1.065 . . . . 1.0 112.892 -169.499 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 16.2 m-20 -61.69 -54.16 46.33 Favored 'General case' 0 N--CA 1.43 -1.447 0 C-N-CA 125.96 1.704 . . . . 1.0 113.924 176.451 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 53.9 m -65.56 -33.57 76.22 Favored 'General case' 0 N--CA 1.429 -1.496 0 O-C-N 120.462 -1.399 . . . . 1.0 113.247 -177.705 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 37.0 tt0 -60.33 -55.09 37.92 Favored 'General case' 0 N--CA 1.43 -1.448 0 C-N-CA 124.306 1.042 . . . . 1.0 112.488 170.471 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 19.8 t80 -50.56 -48.11 57.58 Favored 'General case' 0 N--CA 1.431 -1.425 0 N-CA-C 114.651 1.352 . . . . 1.0 114.651 170.829 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 7.5 t-80 -55.62 -55.72 28.75 Favored 'General case' 0 N--CA 1.43 -1.435 0 C-N-CA 125.979 1.712 . . . . 1.0 114.939 177.344 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 42.6 mtm105 -61.12 -54.37 45.38 Favored 'General case' 0 CA--C 1.49 -1.357 0 C-N-CA 124.86 1.264 . . . . 1.0 113.017 179.92 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 95.9 mt -59.9 -46.45 89.31 Favored 'General case' 0 N--CA 1.431 -1.393 0 O-C-N 121.249 -0.907 . . . . 1.0 113.299 -179.221 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -57.53 -43.46 84.36 Favored 'General case' 0 N--CA 1.43 -1.448 0 N-CA-C 113.779 1.029 . . . . 1.0 113.779 177.355 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 15.9 t0 -63.27 -46.96 84.4 Favored 'General case' 0 N--CA 1.43 -1.45 0 N-CA-C 113.297 0.851 . . . . 1.0 113.297 177.307 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 59.7 mt-30 -61.04 -48.61 80.97 Favored 'General case' 0 N--CA 1.432 -1.35 0 N-CA-C 116.357 1.984 . . . . 1.0 116.357 174.92 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 3.9 pp -67.39 -39.11 85.59 Favored 'General case' 0 N--CA 1.43 -1.474 0 O-C-N 119.917 -1.739 . . . . 1.0 113.996 179.626 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 5.6 m0 -48.69 -57.52 6.15 Favored 'General case' 0 N--CA 1.43 -1.459 0 C-N-CA 126.039 1.736 . . . . 1.0 114.195 166.983 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 51.6 tp -58.7 -41.82 87.17 Favored 'General case' 0 N--CA 1.431 -1.41 0 N-CA-C 113.819 1.044 . . . . 1.0 113.819 177.741 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 90.3 m -57.74 -55.44 34.83 Favored 'General case' 0 N--CA 1.43 -1.444 0 C-N-CA 125.819 1.647 . . . . 1.0 113.496 175.915 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 86.1 mt -59.76 -48.9 85.85 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.419 0 C-N-CA 125.557 1.543 . . . . 1.0 112.397 176.768 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 69.6 tt0 -54.92 -53.3 57.29 Favored 'General case' 0 N--CA 1.428 -1.525 0 C-N-CA 125.226 1.41 . . . . 1.0 113.776 178.666 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 34.8 tt0 -63.88 -43.78 95.02 Favored 'General case' 0 N--CA 1.429 -1.523 0 N-CA-C 114.484 1.29 . . . . 1.0 114.484 179.287 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 6.8 tpt180 -67.19 -35.31 79.38 Favored 'General case' 0 N--CA 1.43 -1.438 0 N-CA-C 114.562 1.319 . . . . 1.0 114.562 -179.559 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 94.6 mt -78.23 -35.87 47.76 Favored 'General case' 0 N--CA 1.43 -1.466 0 O-C-N 120.627 -1.295 . . . . 1.0 113.409 174.314 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 37.2 t70 -57.87 -33.12 68.35 Favored 'General case' 0 N--CA 1.43 -1.465 0 C-N-CA 125.155 1.382 . . . . 1.0 113.026 171.036 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 33.6 t70 -69.79 -18.66 63.49 Favored 'General case' 0 N--CA 1.431 -1.41 0 N-CA-C 114.382 1.253 . . . . 1.0 114.382 174.359 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 24' ' ' TRP . . . . . . . . . . . . . 28.8 t-105 -75.99 152.44 36.98 Favored 'General case' 0 N--CA 1.429 -1.488 0 O-C-N 119.225 -2.172 . . . . 1.0 114.184 -171.557 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 1.8 t0 -154.33 175.79 13.11 Favored 'General case' 0 N--CA 1.431 -1.419 0 N-CA-C 108.635 -0.876 . . . . 1.0 108.635 -174.059 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 160.03 -131.43 2.68 Favored Glycine 0 N--CA 1.43 -1.733 0 N-CA-C 110.911 -0.875 . . . . 1.0 110.911 -178.655 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -86.52 -34.47 19.97 Favored 'General case' 0 N--CA 1.429 -1.489 0 C-N-CA 125.523 1.529 . . . . 1.0 108.697 170.566 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 39.3 m -85.5 172.29 11.1 Favored 'General case' 0 N--CA 1.43 -1.434 0 C-N-CA 124.795 1.238 . . . . 1.0 112.918 -176.589 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 43.1 t0 -121.41 151.43 40.19 Favored 'General case' 0 N--CA 1.431 -1.408 0 C-N-CA 125.874 1.67 . . . . 1.0 106.92 176.116 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -159.84 117.72 0.2 Allowed 'Isoleucine or valine' 0 N--CA 1.43 -1.46 0 CA-C-O 122.355 1.074 . . . . 1.0 108.265 -167.863 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 23.8 t0 -136.21 134.82 38.55 Favored 'General case' 0 N--CA 1.428 -1.546 0 O-C-N 120.83 -1.169 . . . . 1.0 109.066 175.451 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 73.4 m -100.66 138.82 37.21 Favored 'General case' 0 N--CA 1.43 -1.47 0 O-C-N 119.531 -1.981 . . . . 1.0 111.423 179.793 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 52.6 mt-10 -109.81 134.44 52.03 Favored 'General case' 0 N--CA 1.43 -1.459 0 O-C-N 121.102 -0.999 . . . . 1.0 109.929 -172.09 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 2.3 tp -105.29 106.41 20.46 Favored 'Isoleucine or valine' 0 CA--C 1.488 -1.413 0 N-CA-C 105.25 -2.13 . . . . 1.0 105.25 169.304 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 55.2 t30 -135.55 107.5 7.11 Favored 'General case' 0 N--CA 1.43 -1.457 0 CA-C-N 114.777 -1.101 . . . . 1.0 109.899 -173.242 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . 67.11 31.44 77.7 Favored Glycine 0 N--CA 1.43 -1.756 0 O-C-N 120.413 -1.43 . . . . 1.0 114.944 174.179 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 81.64 4.54 90.34 Favored Glycine 0 N--CA 1.429 -1.794 0 O-C-N 121.231 -1.158 . . . . 1.0 114.775 -174.581 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 24.2 t -103.51 127.36 57.57 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.471 0 N-CA-C 107.963 -1.125 . . . . 1.0 107.963 175.353 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 12.3 mt -88.64 127.14 35.56 Favored 'General case' 0 N--CA 1.431 -1.385 0 CA-C-O 123.626 1.679 . . . . 1.0 107.084 161.601 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -130.09 115.04 16.51 Favored 'General case' 0 N--CA 1.429 -1.492 0 N-CA-C 105.759 -1.941 . . . . 1.0 105.759 -169.605 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 82.9 mt -94.14 110.78 24.1 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.485 0 N-CA-C 107.867 -1.16 . . . . 1.0 107.867 -168.625 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 9.8 p -112.65 126.6 55.55 Favored 'General case' 0 N--CA 1.431 -1.423 0 CA-C-O 121.662 0.744 . . . . 1.0 112.508 -170.319 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 43' ' ' PHE . . . . . . . . . . . . . 1.6 p90 -119.97 159.83 23.94 Favored 'General case' 0 N--CA 1.429 -1.489 0 O-C-N 120.558 -1.339 . . . . 1.0 110.405 174.048 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -66.03 -15.08 62.73 Favored 'General case' 0 N--CA 1.43 -1.475 0 N-CA-C 117.762 2.505 . . . . 1.0 117.762 -163.454 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 45.1 m-80 -71.8 -7.74 50.1 Favored 'General case' 0 N--CA 1.43 -1.429 0 C-N-CA 125.935 1.694 . . . . 1.0 113.845 173.472 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 88.76 41.42 6.0 Favored Glycine 0 N--CA 1.429 -1.819 0 O-C-N 120.942 -1.098 . . . . 1.0 114.668 165.888 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 17.0 m -150.99 168.92 23.08 Favored 'General case' 0 N--CA 1.43 -1.45 0 N-CA-C 106.058 -1.831 . . . . 1.0 106.058 179.597 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -156.96 153.27 27.78 Favored 'General case' 0 N--CA 1.43 -1.442 0 N-CA-C 114.295 1.22 . . . . 1.0 114.295 -168.202 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 5.0 mm -97.61 140.62 17.43 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.478 0 C-N-CA 125.825 1.65 . . . . 1.0 106.963 177.598 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 4.7 mm -115.85 118.16 57.9 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.468 0 C-N-CA 124.616 1.166 . . . . 1.0 110.176 -171.935 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 3.4 mt -128.68 120.87 53.55 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.479 0 CA-C-O 122.806 1.288 . . . . 1.0 112.476 -176.876 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 52' ' ' ASN . . . . . 0.461 ' H ' ' HD1' ' A' ' 61' ' ' TRP . 47.2 t30 -156.46 169.17 25.24 Favored 'General case' 0 N--CA 1.429 -1.488 0 N-CA-C 105.374 -2.084 . . . . 1.0 105.374 -178.739 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 29.6 ptt180 -140.57 127.22 20.3 Favored 'General case' 0 N--CA 1.431 -1.409 0 C-N-CA 124.777 1.231 . . . . 1.0 113.004 -159.315 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -110.46 108.2 18.13 Favored 'General case' 0 N--CA 1.43 -1.469 0 C-N-CA 125.212 1.405 . . . . 1.0 110.935 -174.641 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 86.8 mt-10 -64.82 -52.76 48.2 Favored Pre-proline 0 N--CA 1.43 -1.462 0 N-CA-C 118.363 2.727 . . . . 1.0 118.363 -169.497 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 31.9 Cg_exo -73.52 -10.62 23.89 Favored 'Trans proline' 0 N--CA 1.433 -2.033 0 CA-C-N 128.01 3.896 . . . . 1.0 114.01 -168.971 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 35.0 mt -94.1 -22.37 18.53 Favored 'General case' 0 N--CA 1.431 -1.425 0 C-N-CA 126.282 1.833 . . . . 1.0 109.159 177.535 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 32.3 m80 65.91 47.92 1.92 Allowed 'General case' 0 N--CA 1.429 -1.494 0 C-N-CA 126.614 1.965 . . . . 1.0 111.193 175.145 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 13.9 pt20 -144.01 149.33 36.55 Favored 'General case' 0 N--CA 1.429 -1.49 0 C-N-CA 124.31 1.044 . . . . 1.0 110.733 -178.769 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 4.2 t -100.2 153.23 4.6 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.5 0 N-CA-C 108.372 -0.973 . . . . 1.0 108.372 172.043 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 61' ' ' TRP . . . . . 0.461 ' HD1' ' H ' ' A' ' 52' ' ' ASN . 0.0 OUTLIER -102.73 155.3 18.41 Favored 'General case' 0 N--CA 1.43 -1.443 0 O-C-N 119.856 -1.777 . . . . 1.0 113.784 173.337 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 18.2 mt -125.52 94.93 4.28 Favored 'General case' 0 N--CA 1.432 -1.36 0 N-CA-C 106.16 -1.793 . . . . 1.0 106.16 164.207 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 63' ' ' ALA . . . . . 0.406 ' HA ' ' HA2' ' A' ' 68' ' ' GLY . . . -98.56 140.7 32.4 Favored 'General case' 0 N--CA 1.429 -1.49 0 CA-C-O 122.712 1.244 . . . . 1.0 110.113 171.812 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 64' ' ' THR . . . . . . . . . . . . . 6.3 t -153.47 -130.04 0.04 OUTLIER 'General case' 0 N--CA 1.431 -1.414 0 O-C-N 120.767 -1.208 . . . . 1.0 109.011 -169.883 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 3.4 tmtp? -72.01 -64.96 0.83 Allowed 'General case' 0 N--CA 1.429 -1.498 0 O-C-N 119.969 -1.707 . . . . 1.0 111.537 -179.871 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -128.24 -26.69 2.79 Favored 'General case' 0 N--CA 1.429 -1.507 0 O-C-N 121.41 -0.806 . . . . 1.0 112.011 179.139 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . -94.84 61.96 1.62 Allowed Glycine 0 N--CA 1.431 -1.668 0 O-C-N 121.062 -1.024 . . . . 1.0 113.486 -168.62 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 68' ' ' GLY . . . . . 0.406 ' HA2' ' HA ' ' A' ' 63' ' ' ALA . . . -75.17 83.81 0.84 Allowed Glycine 0 N--CA 1.43 -1.705 0 CA-C-O 122.609 1.116 . . . . 1.0 115.663 174.412 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 20.0 m-30 -113.96 148.28 37.16 Favored 'General case' 0 N--CA 1.43 -1.432 0 N-CA-C 107.454 -1.313 . . . . 1.0 107.454 -169.634 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 18.1 p-80 -86.52 157.77 19.69 Favored 'General case' 0 N--CA 1.43 -1.428 0 O-C-N 120.288 -1.507 . . . . 1.0 111.272 174.593 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 71' ' ' PHE . . . . . . . . . . . . 0.294 86.9 t80 -121.41 113.18 19.51 Favored 'General case' 0 N--CA 1.43 -1.447 0 C-N-CA 125.671 1.588 . . . . 1.0 107.951 -157.147 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 12.1 m-20 -146.99 157.57 43.66 Favored 'General case' 0 N--CA 1.428 -1.56 0 CA-C-N 119.501 1.046 . . . . 1.0 111.323 -175.532 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 27.5 tp -84.78 137.09 33.4 Favored 'General case' 0 N--CA 1.432 -1.366 0 O-C-N 120.465 -1.397 . . . . 1.0 113.711 -172.302 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 38.9 mmtm -106.14 -96.63 0.35 Allowed 'General case' 0 N--CA 1.429 -1.475 0 C-N-CA 125.143 1.377 . . . . 1.0 108.926 166.971 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -100.7 -96.28 2.22 Favored Glycine 0 N--CA 1.429 -1.774 0 O-C-N 120.946 -1.096 . . . . 1.0 112.989 178.637 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 44.2 t0 -98.19 17.02 19.55 Favored 'General case' 0 N--CA 1.431 -1.394 0 C-N-CA 125.409 1.484 . . . . 1.0 108.182 173.587 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 5.3 mm-40 -135.78 124.58 23.97 Favored 'General case' 0 N--CA 1.43 -1.472 0 N-CA-C 106.162 -1.792 . . . . 1.0 106.162 -167.834 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 78' ' ' TRP . . . . . . . . . . . . . 46.8 m95 -80.56 102.22 9.63 Favored 'General case' 0 N--CA 1.43 -1.472 0 N-CA-C 104.639 -2.356 . . . . 1.0 104.639 161.536 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 1.7 pt -89.22 158.04 2.99 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.474 0 O-C-N 119.184 -2.197 . . . . 1.0 108.122 179.313 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 89.6 m -81.63 116.04 21.18 Favored 'General case' 0 N--CA 1.432 -1.359 0 N-CA-C 106.409 -1.7 . . . . 1.0 106.409 170.974 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 6.1 t70 -69.91 -41.58 74.47 Favored 'General case' 0 N--CA 1.431 -1.412 0 C-N-CA 126.147 1.779 . . . . 1.0 112.538 -161.744 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 27.3 ttt180 -73.24 125.23 27.29 Favored 'General case' 0 N--CA 1.431 -1.389 0 C-N-CA 125.8 1.64 . . . . 1.0 109.514 172.345 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 83' ' ' SER . . . . . . . . . . . . 0.341 56.8 m 73.17 -42.44 0.53 Allowed 'General case' 0 N--CA 1.43 -1.462 0 C-N-CA 126.511 1.924 . . . . 1.0 115.717 -174.947 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 107.18 70.16 0.72 Allowed Glycine 0 N--CA 1.43 -1.752 0 O-C-N 120.629 -1.294 . . . . 1.0 114.38 166.564 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 64.1 mm-40 -120.27 -126.62 0.27 Allowed 'General case' 0 N--CA 1.429 -1.481 0 CA-C-N 117.953 0.877 . . . . 1.0 112.519 -169.383 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 92.7 m -158.59 140.22 13.54 Favored 'General case' 0 N--CA 1.43 -1.467 0 O-C-N 119.806 -1.808 . . . . 1.0 108.851 -168.527 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 0.8 OUTLIER -42.94 -92.46 0.0 OUTLIER 'General case' 0 N--CA 1.43 -1.47 0 C-N-CA 127.699 2.399 . . . . 1.0 115.704 172.366 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 88' ' ' TRP . . . . . . . . . . . . . 1.1 t-105 -75.57 -26.61 58.08 Favored 'General case' 0 N--CA 1.428 -1.535 0 O-C-N 120.517 -1.365 . . . . 1.0 111.01 -164.739 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 60.2 m-20 -63.8 -42.53 97.69 Favored 'General case' 0 N--CA 1.43 -1.442 0 O-C-N 120.175 -1.578 . . . . 1.0 114.586 173.531 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 33.3 tp -74.66 -41.74 59.76 Favored 'General case' 0 N--CA 1.428 -1.526 0 O-C-N 119.457 -2.027 . . . . 1.0 111.733 178.589 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 37.0 tp -55.06 -35.4 64.47 Favored 'General case' 0 N--CA 1.431 -1.415 0 C-N-CA 126.617 1.967 . . . . 1.0 114.371 169.947 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 3.0 tm-20 -61.9 -53.51 54.81 Favored 'General case' 0 N--CA 1.43 -1.428 0 C-N-CA 126.189 1.796 . . . . 1.0 111.222 167.466 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 6.5 tt0 -56.01 -46.33 78.82 Favored 'General case' 0 N--CA 1.43 -1.435 0 CA-C-N 120.808 1.64 . . . . 1.0 115.151 176.514 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -51.67 -58.19 7.07 Favored 'General case' 0 N--CA 1.43 -1.438 0 C-N-CA 127.104 2.162 . . . . 1.0 114.584 171.859 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -64.63 -42.61 95.36 Favored 'General case' 0 N--CA 1.429 -1.487 0 O-C-N 120.5 -1.375 . . . . 1.0 113.604 178.366 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 44.5 m -57.87 -48.35 80.07 Favored 'General case' 0 N--CA 1.43 -1.431 0 C-N-CA 126.561 1.945 . . . . 1.0 112.56 175.403 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 24.1 pt20 -70.3 -28.36 65.13 Favored 'General case' 0 N--CA 1.429 -1.485 0 O-C-N 120.185 -1.572 . . . . 1.0 114.043 -179.953 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 3.6 mm-40 -81.84 -36.65 28.04 Favored 'General case' 0 N--CA 1.429 -1.477 0 O-C-N 120.033 -1.667 . . . . 1.0 114.263 175.656 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -86.14 -34.57 20.54 Favored 'General case' 0 N--CA 1.43 -1.435 0 O-C-N 120.518 -1.364 . . . . 1.0 114.186 -179.817 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . 92.67 22.06 29.69 Favored Glycine 0 N--CA 1.429 -1.794 0 O-C-N 120.514 -1.366 . . . . 1.0 114.073 178.156 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 12.0 pt-20 -158.17 158.46 34.64 Favored 'General case' 0 N--CA 1.43 -1.436 0 N-CA-C 104.707 -2.331 . . . . 1.0 104.707 -172.631 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 39.7 m -74.02 112.68 10.38 Favored 'General case' 0 N--CA 1.43 -1.444 0 CA-C-N 121.318 1.872 . . . . 1.0 111.848 178.205 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 44.7 t -107.24 101.59 12.72 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.444 0 CA-C-O 122.623 1.201 . . . . 1.0 108.315 177.071 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 66.1 p -139.76 149.91 44.14 Favored 'General case' 0 N--CA 1.429 -1.494 0 O-C-N 120.939 -1.101 . . . . 1.0 113.823 -168.057 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 105' ' ' PHE . . . . . . . . . . . . 0.262 0.0 OUTLIER -106.74 -21.94 12.88 Favored 'General case' 0 N--CA 1.429 -1.49 0 C-N-CA 124.679 1.192 . . . . 1.0 110.602 158.76 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 5.2 mmm180 . . . . . 0 C--O 1.26 1.628 0 CA-C-O 117.659 -1.162 . . . . 1.0 111.118 -178.855 . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 54.1 ttp . . . . . 0 CA--C 1.489 -1.386 0 CA-C-O 121.749 0.785 . . . . 1.0 109.119 . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 1.8 p30 -170.5 -39.72 0.02 OUTLIER 'General case' 0 N--CA 1.43 -1.435 0 O-C-N 120.871 -1.143 . . . . 1.0 112.278 -173.389 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 3.8 m-20 -55.71 -48.67 74.75 Favored 'General case' 0 N--CA 1.431 -1.424 0 C-N-CA 126.605 1.962 . . . . 1.0 114.784 -173.079 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 19.2 m -52.36 -53.93 38.3 Favored 'General case' 0 N--CA 1.43 -1.456 0 C-N-CA 125.186 1.394 . . . . 1.0 113.905 178.418 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 45.0 mt-10 -57.48 -58.59 7.62 Favored 'General case' 0 N--CA 1.431 -1.425 0 C-N-CA 125.49 1.516 . . . . 1.0 112.082 176.414 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 2.7 t80 -56.56 -39.44 73.45 Favored 'General case' 0 N--CA 1.43 -1.459 0 N-CA-C 116.481 2.03 . . . . 1.0 116.481 178.967 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 1.4 m-70 -67.82 -44.16 77.92 Favored 'General case' 0 CA--C 1.489 -1.372 0 O-C-N 121.061 -1.024 . . . . 1.0 113.454 179.418 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -70.89 -41.6 71.11 Favored 'General case' 0 N--CA 1.431 -1.392 0 O-C-N 121.091 -1.006 . . . . 1.0 112.295 178.53 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 89.9 mt -62.49 -39.07 92.28 Favored 'General case' 0 N--CA 1.431 -1.421 0 O-C-N 119.682 -1.886 . . . . 1.0 113.554 174.157 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -59.74 -53.2 60.75 Favored 'General case' 0 N--CA 1.43 -1.473 0 C-N-CA 125.047 1.339 . . . . 1.0 112.776 172.53 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 40.1 t0 -47.44 -54.97 9.94 Favored 'General case' 0 N--CA 1.43 -1.473 0 C-N-CA 127.609 2.364 . . . . 1.0 112.965 177.098 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 42.4 mt-30 -55.23 -50.73 68.69 Favored 'General case' 0 N--CA 1.43 -1.46 0 N-CA-C 116.375 1.991 . . . . 1.0 116.375 173.705 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 1.8 pp -71.27 -38.35 71.85 Favored 'General case' 0 N--CA 1.429 -1.497 0 O-C-N 119.942 -1.724 . . . . 1.0 115.386 178.888 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 0.5 OUTLIER -45.78 -57.19 4.49 Favored 'General case' 0 N--CA 1.429 -1.489 0 C-N-CA 128.231 2.612 . . . . 1.0 113.45 168.195 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 3.0 pp -70.55 -30.34 67.04 Favored 'General case' 0 N--CA 1.43 -1.431 0 O-C-N 120.764 -1.21 . . . . 1.0 112.926 -179.193 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 97.3 m -64.27 -50.19 68.91 Favored 'General case' 0 N--CA 1.43 -1.45 0 C-N-CA 124.419 1.088 . . . . 1.0 112.815 174.516 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 82.7 mt -60.49 -47.53 92.29 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.477 0 O-C-N 120.621 -1.3 . . . . 1.0 111.706 175.422 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 3.8 tt0 -52.45 -57.23 10.52 Favored 'General case' 0 N--CA 1.43 -1.432 0 N-CA-C 114.611 1.337 . . . . 1.0 114.611 175.115 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 21.9 tt0 -75.64 -33.36 60.47 Favored 'General case' 0 N--CA 1.429 -1.504 0 N-CA-C 114.719 1.377 . . . . 1.0 114.719 -174.488 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 2.0 tpm_? -64.81 -44.28 90.39 Favored 'General case' 0 N--CA 1.43 -1.426 0 O-C-N 119.668 -1.895 . . . . 1.0 112.433 174.133 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 4.6 mm? -74.13 -31.41 62.74 Favored 'General case' 0 N--CA 1.431 -1.424 0 N-CA-C 113.18 0.807 . . . . 1.0 113.18 178.435 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 20.1 t70 -54.55 -53.57 52.71 Favored 'General case' 0 N--CA 1.431 -1.423 0 O-C-N 120.432 -1.418 . . . . 1.0 113.171 167.909 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 6.0 t70 -96.52 29.64 2.86 Favored 'General case' 0 N--CA 1.43 -1.435 0 CA-C-O 122.175 0.988 . . . . 1.0 112.721 -174.27 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 24' ' ' TRP . . . . . . . . . . . . . 54.6 t-105 -80.27 -177.71 6.25 Favored 'General case' 0 N--CA 1.43 -1.449 0 O-C-N 120.037 -1.664 . . . . 1.0 111.379 177.083 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 40.1 t0 -81.16 65.82 6.44 Favored 'General case' 0 N--CA 1.429 -1.499 0 O-C-N 119.857 -1.777 . . . . 1.0 111.199 179.525 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -179.84 138.74 3.52 Favored Glycine 0 N--CA 1.429 -1.789 0 N-CA-C 107.056 -2.418 . . . . 1.0 107.056 -179.844 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 3.9 t70 -108.74 -43.68 4.2 Favored 'General case' 0 N--CA 1.43 -1.474 0 N-CA-C 108.446 -0.946 . . . . 1.0 108.446 -179.705 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 67.8 m -85.57 159.92 19.76 Favored 'General case' 0 N--CA 1.43 -1.472 0 C-N-CA 126.041 1.737 . . . . 1.0 109.953 171.876 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 29' ' ' ASP . . . . . 0.683 ' HA ' ' H ' ' A' ' 44' ' ' GLU 0.3 15.9 t70 61.26 20.53 11.12 Favored 'General case' 0 N--CA 1.429 -1.497 0 C-N-CA 128.156 2.582 . . . . 1.0 116.572 176.854 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 10.0 tp -147.21 111.36 0.8 Allowed 'Isoleucine or valine' 0 N--CA 1.43 -1.458 0 O-C-N 120.148 -1.595 . . . . 1.0 107.814 173.219 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 38.2 t0 -153.31 108.68 3.23 Favored 'General case' 0 N--CA 1.43 -1.462 0 O-C-N 120.544 -1.347 . . . . 1.0 108.421 -175.514 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 11.8 t -86.31 143.86 27.67 Favored 'General case' 0 N--CA 1.429 -1.477 0 O-C-N 118.055 -2.903 . . . . 1.0 113.099 -174.855 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 91.7 mt-10 -92.77 136.94 32.8 Favored 'General case' 0 N--CA 1.431 -1.417 0 C-N-CA 125.735 1.614 . . . . 1.0 108.481 167.164 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 4.3 mp -129.66 105.94 12.91 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.444 0 N-CA-C 106.421 -1.696 . . . . 1.0 106.421 177.451 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 35.1 m120 -128.48 77.63 1.79 Allowed 'General case' 0 N--CA 1.43 -1.475 0 CA-C-N 114.768 -1.105 . . . . 1.0 111.045 -178.647 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . 62.49 26.77 68.57 Favored Glycine 0 N--CA 1.429 -1.806 0 N-CA-C 118.587 2.195 . . . . 1.0 118.587 161.255 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 130.92 -32.8 2.94 Favored Glycine 0 N--CA 1.431 -1.685 0 N-CA-C 109.785 -1.326 . . . . 1.0 109.785 -173.82 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 44.9 t -88.41 128.17 40.86 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.434 0 O-C-N 121.639 -0.918 . . . . 1.0 109.212 175.562 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 80.2 mt -114.9 130.26 56.87 Favored 'General case' 0 N--CA 1.43 -1.445 0 N-CA-C 108.089 -1.078 . . . . 1.0 108.089 169.12 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -122.98 114.98 21.14 Favored 'General case' 0 N--CA 1.43 -1.426 0 N-CA-C 106.188 -1.782 . . . . 1.0 106.188 174.926 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 58.7 mt -88.05 112.13 23.21 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.482 0 N-CA-C 105.25 -2.13 . . . . 1.0 105.25 -178.788 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 33.3 m -108.7 143.04 38.32 Favored 'General case' 0 N--CA 1.43 -1.446 0 CA-C-O 122.237 1.017 . . . . 1.0 109.916 -166.024 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 43' ' ' PHE . . . . . . . . . . . . . 53.0 m-85 -115.31 155.96 26.34 Favored 'General case' 0 N--CA 1.43 -1.433 0 C-N-CA 124.874 1.27 . . . . 1.0 108.127 -172.806 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 44' ' ' GLU . . . . . 0.683 ' H ' ' HA ' ' A' ' 29' ' ' ASP . 5.3 mm-40 -66.12 -23.16 66.44 Favored 'General case' 0 N--CA 1.429 -1.501 0 O-C-N 119.291 -2.131 . . . . 1.0 115.299 164.268 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 49.4 m-80 -65.92 -7.26 15.66 Favored 'General case' 0 N--CA 1.429 -1.48 0 C-N-CA 124.989 1.316 . . . . 1.0 114.128 164.963 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 94.99 -8.49 70.25 Favored Glycine 0 N--CA 1.431 -1.694 0 O-C-N 119.962 -1.711 . . . . 1.0 113.925 169.219 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 1.5 m -80.71 -170.33 2.59 Favored 'General case' 0 N--CA 1.43 -1.45 0 C-N-CA 126.626 1.971 . . . . 1.0 113.001 -171.635 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 44.7 pttt -168.6 126.49 1.07 Allowed 'General case' 0 N--CA 1.43 -1.439 0 O-C-N 119.922 -1.736 . . . . 1.0 114.497 -162.819 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 49' ' ' ILE . . . . . 0.45 HD13 HG23 ' A' ' 64' ' ' THR . 5.9 mm -100.23 107.41 20.92 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.45 0 N-CA-C 106.737 -1.579 . . . . 1.0 106.737 166.298 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 4.5 tp -106.18 117.6 52.24 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.506 0 O-C-N 120.036 -1.665 . . . . 1.0 110.886 -173.942 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 3.7 mt -128.55 131.65 68.58 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.408 0 C-N-CA 125.864 1.666 . . . . 1.0 109.943 -171.444 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 16.8 t30 -161.26 175.03 12.74 Favored 'General case' 0 N--CA 1.432 -1.374 0 N-CA-C 104.628 -2.36 . . . . 1.0 104.628 -172.267 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 60.7 ttp85 -151.22 138.4 19.27 Favored 'General case' 0 N--CA 1.43 -1.46 0 O-C-N 120.033 -1.667 . . . . 1.0 108.238 -162.27 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 1.6 tt0 -149.03 -45.35 0.14 Allowed 'General case' 0 CA--C 1.489 -1.394 0 O-C-N 121.154 -0.966 . . . . 1.0 109.339 -168.647 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 55.5 mt-10 -76.05 147.77 80.64 Favored Pre-proline 0 N--CA 1.43 -1.468 0 N-CA-C 114.277 1.214 . . . . 1.0 114.277 -164.553 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 47.8 Cg_endo -77.6 -174.61 2.29 Favored 'Trans proline' 0 C--N 1.299 -2.06 0 C-N-CA 122.811 2.341 . . . . 1.0 111.478 166.221 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 22.8 mt 79.34 -48.66 0.4 Allowed 'General case' 0 N--CA 1.431 -1.402 0 C-N-CA 128.89 2.876 . . . . 1.0 112.122 178.305 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER 143.82 88.33 0.0 OUTLIER 'General case' 0 N--CA 1.43 -1.452 1 C-N-CA 132.382 4.273 . . . . 1.0 108.014 172.382 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 8.1 tt0 -154.25 145.27 22.7 Favored 'General case' 0 N--CA 1.43 -1.458 0 CA-C-N 123.06 2.664 . . . . 1.0 111.922 168.302 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 2.2 t -127.93 160.16 37.97 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.466 0 C-N-CA 127.478 2.311 . . . . 1.0 111.723 -175.395 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 61' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -109.48 152.44 25.41 Favored 'General case' 0 N--CA 1.431 -1.424 0 C-N-CA 124.564 1.146 . . . . 1.0 110.987 177.222 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 2.3 pt? -154.24 124.08 6.73 Favored 'General case' 0 N--CA 1.43 -1.45 0 CA-C-O 122.655 1.216 . . . . 1.0 109.935 168.781 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 63' ' ' ALA . . . . . 0.454 ' HA ' ' HA2' ' A' ' 68' ' ' GLY . . . -124.24 130.48 52.59 Favored 'General case' 0 N--CA 1.429 -1.487 0 N-CA-C 115.042 1.497 . . . . 1.0 115.042 -178.813 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 64' ' ' THR . . . . . 0.45 HG23 HD13 ' A' ' 49' ' ' ILE . 8.6 m -123.97 -102.44 0.38 Allowed 'General case' 0 N--CA 1.432 -1.352 0 C-N-CA 124.467 1.107 . . . . 1.0 110.983 177.553 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 9.1 tmtm? -125.92 -40.63 2.01 Favored 'General case' 0 N--CA 1.429 -1.483 0 O-C-N 120.369 -1.457 . . . . 1.0 111.814 -163.648 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 5.2 tm0? -79.42 -23.96 42.84 Favored 'General case' 0 N--CA 1.428 -1.537 0 O-C-N 120.662 -1.274 . . . . 1.0 112.576 -172.872 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . -176.18 -62.58 0.06 OUTLIER Glycine 0 N--CA 1.43 -1.761 0 O-C-N 120.36 -1.462 . . . . 1.0 112.501 171.229 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 68' ' ' GLY . . . . . 0.454 ' HA2' ' HA ' ' A' ' 63' ' ' ALA . . . 107.61 109.59 3.37 Favored Glycine 0 N--CA 1.43 -1.703 0 C-N-CA 124.894 1.235 . . . . 1.0 110.732 -171.322 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 23.1 m-85 -121.64 170.83 9.33 Favored 'General case' 0 N--CA 1.431 -1.404 0 C-N-CA 125.027 1.331 . . . . 1.0 108.665 -169.096 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 5.6 p80 -115.85 161.08 19.29 Favored 'General case' 0 N--CA 1.43 -1.463 0 O-C-N 120.278 -1.514 . . . . 1.0 110.025 171.606 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 71' ' ' PHE . . . . . . . . . . . . 0.273 65.6 t80 -135.27 120.77 19.27 Favored 'General case' 0 N--CA 1.43 -1.431 0 C-N-CA 124.721 1.208 . . . . 1.0 109.829 -144.418 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 51.4 t0 -139.54 165.82 26.23 Favored 'General case' 0 N--CA 1.43 -1.436 0 CA-C-O 121.884 0.85 . . . . 1.0 110.424 -176.96 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 55.9 tp -103.03 121.59 42.88 Favored 'General case' 0 N--CA 1.43 -1.435 0 O-C-N 120.268 -1.52 . . . . 1.0 113.209 -167.48 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 29.6 mmtm -112.65 84.98 2.07 Favored 'General case' 0 N--CA 1.43 -1.439 0 O-C-N 120.9 -1.125 . . . . 1.0 109.305 170.926 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . 73.38 -95.52 0.77 Allowed Glycine 0 N--CA 1.43 -1.736 0 O-C-N 120.573 -1.33 . . . . 1.0 114.823 174.365 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 55.9 m-20 -104.31 -3.83 23.71 Favored 'General case' 0 N--CA 1.43 -1.425 0 C-N-CA 125.645 1.578 . . . . 1.0 112.975 -176.639 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 33.3 tt0 -150.24 132.39 15.37 Favored 'General case' 0 N--CA 1.429 -1.501 0 N-CA-C 106.317 -1.734 . . . . 1.0 106.317 -169.59 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 78' ' ' TRP . . . . . . . . . . . . . 33.7 m95 -79.93 127.29 32.08 Favored 'General case' 0 N--CA 1.43 -1.441 0 O-C-N 120.666 -1.271 . . . . 1.0 108.878 177.224 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 9.5 mt -103.14 135.86 38.56 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.513 0 C-N-CA 125.766 1.626 . . . . 1.0 107.016 177.565 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -81.39 134.63 35.58 Favored 'General case' 0 N--CA 1.43 -1.456 0 O-C-N 121.009 -1.057 . . . . 1.0 109.168 178.36 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 25.7 t70 -77.6 -20.74 53.47 Favored 'General case' 0 N--CA 1.431 -1.411 0 N-CA-C 115.359 1.615 . . . . 1.0 115.359 -162.684 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 4.3 mmp_? -82.71 -90.03 0.08 Allowed 'General case' 0 N--CA 1.43 -1.432 0 O-C-N 120.349 -1.469 . . . . 1.0 113.462 -174.868 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 31.7 p -72.06 -29.64 64.35 Favored 'General case' 0 N--CA 1.431 -1.39 0 O-C-N 120.069 -1.644 . . . . 1.0 114.16 -176.854 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 106.24 83.37 1.62 Allowed Glycine 0 N--CA 1.43 -1.747 0 N-CA-C 109.716 -1.354 . . . . 1.0 109.716 -171.851 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 5.0 mm-40 -140.66 -172.27 3.41 Favored 'General case' 0 N--CA 1.431 -1.422 0 N-CA-C 105.693 -1.966 . . . . 1.0 105.693 -170.854 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 30.1 m -145.84 131.99 19.4 Favored 'General case' 0 N--CA 1.43 -1.444 0 O-C-N 120.578 -1.326 . . . . 1.0 111.435 -155.077 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 1.1 t80 -21.83 -97.08 0.0 OUTLIER 'General case' 0 N--CA 1.43 -1.433 0 N-CA-C 120.418 3.488 . . . . 1.0 120.418 175.523 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 88' ' ' TRP . . . . . . . . . . . . . 29.9 m95 -71.69 -26.83 62.67 Favored 'General case' 0 N--CA 1.431 -1.419 0 O-C-N 120.247 -1.533 . . . . 1.0 110.889 -167.445 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 16.2 m-20 -79.25 -42.21 26.41 Favored 'General case' 0 N--CA 1.43 -1.456 0 C-N-CA 126.432 1.893 . . . . 1.0 112.747 -176.879 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -70.3 -39.94 74.55 Favored 'General case' 0 N--CA 1.43 -1.452 0 O-C-N 119.716 -1.865 . . . . 1.0 111.54 176.007 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 41.0 tp -53.74 -47.28 70.78 Favored 'General case' 0 N--CA 1.429 -1.484 0 C-N-CA 126.252 1.821 . . . . 1.0 113.589 170.345 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 30.2 tt0 -56.73 -56.19 24.68 Favored 'General case' 0 N--CA 1.43 -1.448 0 C-N-CA 125.08 1.352 . . . . 1.0 113.917 169.832 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 38.6 mt-30 -55.34 -42.91 74.48 Favored 'General case' 0 N--CA 1.43 -1.442 0 C-N-CA 125.168 1.387 . . . . 1.0 113.678 179.248 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -59.21 -55.34 36.2 Favored 'General case' 0 N--CA 1.428 -1.526 0 C-N-CA 127.055 2.142 . . . . 1.0 114.395 173.538 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -65.68 -40.64 92.58 Favored 'General case' 0 N--CA 1.429 -1.498 0 O-C-N 120.222 -1.549 . . . . 1.0 113.314 -179.377 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 31.8 m -56.23 -45.81 79.81 Favored 'General case' 0 N--CA 1.43 -1.426 0 C-N-CA 125.215 1.406 . . . . 1.0 114.335 168.257 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 9.0 pt20 -71.8 -22.27 61.59 Favored 'General case' 0 N--CA 1.431 -1.397 0 O-C-N 120.589 -1.319 . . . . 1.0 114.129 -178.465 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 2.4 mm-40 -72.79 -57.64 3.94 Favored 'General case' 0 N--CA 1.431 -1.381 0 O-C-N 121.441 -0.787 . . . . 1.0 112.83 166.549 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -77.09 -41.95 40.13 Favored 'General case' 0 N--CA 1.43 -1.461 0 N-CA-C 117.089 2.255 . . . . 1.0 117.089 -170.563 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . 83.99 43.27 7.22 Favored Glycine 0 N--CA 1.43 -1.704 0 O-C-N 120.86 -1.15 . . . . 1.0 111.907 -165.868 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 4.9 tp10 -161.28 154.53 21.36 Favored 'General case' 0 N--CA 1.431 -1.419 0 N-CA-C 107.409 -1.33 . . . . 1.0 107.409 -169.69 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 93.2 m -78.47 93.68 4.8 Favored 'General case' 0 N--CA 1.43 -1.449 0 O-C-N 118.953 -2.342 . . . . 1.0 110.594 168.821 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 47.9 t -105.48 90.29 1.53 Allowed 'Isoleucine or valine' 0 N--CA 1.43 -1.437 0 C-N-CA 125.844 1.658 . . . . 1.0 106.931 -179.398 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 59.5 p -143.07 178.23 7.83 Favored 'General case' 0 N--CA 1.43 -1.444 0 O-C-N 120.709 -1.245 . . . . 1.0 113.754 -172.678 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -108.93 -40.41 5.03 Favored 'General case' 0 N--CA 1.43 -1.452 0 O-C-N 120.633 -1.292 . . . . 1.0 110.646 177.577 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 24.9 ttp180 . . . . . 0 C--O 1.259 1.581 0 O-C-N 120.766 -1.209 . . . . 1.0 111.824 -165.549 . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 2.3 mpt? . . . . . 0 CA--C 1.49 -1.333 0 N-CA-C 111.51 0.189 . . . . 1.0 111.51 . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 4.3 p30 -152.33 153.36 33.51 Favored 'General case' 0 N--CA 1.43 -1.435 0 O-C-N 120.74 -1.225 . . . . 1.0 110.145 -179.817 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 1.1 p-10 -66.58 -30.49 70.8 Favored 'General case' 0 N--CA 1.43 -1.447 0 N-CA-C 114.978 1.473 . . . . 1.0 114.978 -176.67 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 8.5 t -63.52 -54.3 38.45 Favored 'General case' 0 N--CA 1.43 -1.47 0 O-C-N 120.492 -1.38 . . . . 1.0 113.368 174.019 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 53.9 mt-10 -63.38 -42.2 98.81 Favored 'General case' 0 N--CA 1.431 -1.385 0 O-C-N 120.615 -1.303 . . . . 1.0 113.624 176.625 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 6' ' ' PHE . . . . . 0.401 ' CD1' ' HA ' ' A' ' 58' ' ' HIS . 11.6 t80 -44.89 -55.37 5.5 Favored 'General case' 0 N--CA 1.429 -1.479 0 C-N-CA 125.666 1.586 . . . . 1.0 114.5 167.309 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 1.5 p80 -70.08 -30.41 67.63 Favored 'General case' 0 N--CA 1.431 -1.402 0 N-CA-C 114.514 1.302 . . . . 1.0 114.514 -179.61 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 31.1 ttt85 -68.88 -48.78 62.55 Favored 'General case' 0 N--CA 1.43 -1.45 0 C-N-CA 125.816 1.646 . . . . 1.0 113.182 179.152 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 92.1 mt -64.7 -36.77 85.36 Favored 'General case' 0 N--CA 1.429 -1.516 0 C-N-CA 126.193 1.797 . . . . 1.0 112.366 173.589 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -57.78 -47.44 82.53 Favored 'General case' 0 N--CA 1.43 -1.464 0 C-N-CA 124.293 1.037 . . . . 1.0 113.107 171.914 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -56.57 -43.95 80.52 Favored 'General case' 0 N--CA 1.429 -1.522 0 C-N-CA 126.703 2.001 . . . . 1.0 113.4 175.131 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 19.1 mm-40 -54.99 -63.25 1.21 Allowed 'General case' 0 N--CA 1.431 -1.401 0 C-N-CA 124.879 1.272 . . . . 1.0 113.524 172.855 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 3.7 pp -69.86 -39.85 76.12 Favored 'General case' 0 N--CA 1.43 -1.435 0 O-C-N 120.23 -1.543 . . . . 1.0 114.969 -173.621 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 14' ' ' TRP . . . . . 0.432 ' HE1' ' CG2' ' A' ' 51' ' ' ILE . 9.3 m0 -55.02 -48.66 73.07 Favored 'General case' 0 N--CA 1.43 -1.428 0 N-CA-C 114.179 1.178 . . . . 1.0 114.179 172.032 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 41.1 tp -63.71 -39.41 94.24 Favored 'General case' 0 N--CA 1.43 -1.442 0 N-CA-C 113.05 0.759 . . . . 1.0 113.05 175.876 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 25.6 m -52.36 -50.81 61.61 Favored 'General case' 0 N--CA 1.429 -1.497 0 C-N-CA 125.377 1.471 . . . . 1.0 114.709 172.921 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 20.6 mt -66.71 -48.61 79.57 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.483 0 O-C-N 120.174 -1.579 . . . . 1.0 112.206 178.078 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 41.1 tt0 -53.85 -54.56 36.82 Favored 'General case' 0 N--CA 1.43 -1.461 0 C-N-CA 124.638 1.175 . . . . 1.0 112.294 178.114 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 33.9 tt0 -58.32 -49.71 76.23 Favored 'General case' 0 N--CA 1.431 -1.403 0 C-N-CA 126.45 1.9 . . . . 1.0 114.241 178.414 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 8.7 tpm_? -60.49 -44.76 95.61 Favored 'General case' 0 N--CA 1.43 -1.469 0 CA-C-N 119.817 1.19 . . . . 1.0 112.913 -178.964 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 98.1 mt -72.29 -41.14 66.97 Favored 'General case' 0 N--CA 1.43 -1.443 0 N-CA-C 114.594 1.331 . . . . 1.0 114.594 175.769 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 38.0 t70 -59.48 -36.75 76.63 Favored 'General case' 0 N--CA 1.429 -1.483 0 O-C-N 119.365 -2.084 . . . . 1.0 113.566 174.967 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 24.6 t0 -105.17 33.83 3.49 Favored 'General case' 0 N--CA 1.43 -1.475 0 O-C-N 120.181 -1.575 . . . . 1.0 111.261 174.225 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 24' ' ' TRP . . . . . . . . . . . . . 22.6 t-105 -83.41 -61.76 1.76 Allowed 'General case' 0 N--CA 1.429 -1.494 0 O-C-N 119.872 -1.768 . . . . 1.0 109.896 168.515 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 28.1 t70 70.07 -111.66 0.08 Allowed 'General case' 0 N--CA 1.43 -1.438 0 C-N-CA 125.051 1.34 . . . . 1.0 111.501 174.344 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 76.35 -115.7 4.51 Favored Glycine 0 N--CA 1.43 -1.761 0 O-C-N 120.025 -1.672 . . . . 1.0 114.147 172.921 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -101.89 -19.45 15.27 Favored 'General case' 0 N--CA 1.431 -1.419 0 C-N-CA 124.962 1.305 . . . . 1.0 109.788 172.159 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 54.0 p -80.71 173.63 12.41 Favored 'General case' 0 N--CA 1.429 -1.476 0 N-CA-C 115.949 1.833 . . . . 1.0 115.949 -170.262 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 4.7 t70 -130.53 150.77 51.59 Favored 'General case' 0 N--CA 1.431 -1.416 0 N-CA-C 106.31 -1.737 . . . . 1.0 106.31 161.952 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER -155.16 114.27 0.32 Allowed 'Isoleucine or valine' 0 N--CA 1.431 -1.404 0 C-N-CA 125.047 1.339 . . . . 1.0 108.45 -159.923 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 21.1 m-20 -120.35 107.2 12.65 Favored 'General case' 0 N--CA 1.43 -1.441 0 C-N-CA 125.39 1.476 . . . . 1.0 110.645 174.12 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 27.6 t -86.34 136.22 33.22 Favored 'General case' 0 N--CA 1.431 -1.382 0 O-C-N 119.762 -1.836 . . . . 1.0 109.85 165.904 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 79.1 mt-10 -112.22 135.53 52.78 Favored 'General case' 0 N--CA 1.429 -1.478 0 O-C-N 120.904 -1.122 . . . . 1.0 109.342 179.292 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 3.2 tp -111.03 105.48 18.89 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.419 0 CA-C-O 125.1 2.381 . . . . 1.0 107.766 176.297 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 76.6 m-20 -115.63 74.68 0.9 Allowed 'General case' 0 N--CA 1.431 -1.408 0 CA-C-N 113.102 -1.863 . . . . 1.0 109.11 -179.382 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . 76.34 -92.16 0.96 Allowed Glycine 0 N--CA 1.43 -1.733 0 O-C-N 120.663 -1.273 . . . . 1.0 114.588 174.42 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -120.75 20.51 8.7 Favored Glycine 0 N--CA 1.431 -1.695 0 C-N-CA 124.308 0.956 . . . . 1.0 111.054 174.156 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 40.8 t -121.43 123.96 70.8 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.459 0 N-CA-C 107.543 -1.28 . . . . 1.0 107.543 178.257 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 12.6 mt -111.93 130.1 55.96 Favored 'General case' 0 N--CA 1.43 -1.448 0 CA-C-O 122.865 1.317 . . . . 1.0 107.973 167.308 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 17.9 p -126.33 125.8 42.86 Favored 'General case' 0 N--CA 1.431 -1.425 0 N-CA-C 107.387 -1.338 . . . . 1.0 107.387 177.868 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 22.8 mt -106.11 122.77 60.21 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.416 0 N-CA-C 108.846 -0.798 . . . . 1.0 108.846 -177.166 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 39.6 p -116.69 128.21 55.13 Favored 'General case' 0 N--CA 1.43 -1.449 0 CA-C-O 121.177 0.513 . . . . 1.0 112.055 -173.229 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 43' ' ' PHE . . . . . . . . . . . . . 26.1 p90 -119.66 171.85 8.09 Favored 'General case' 0 N--CA 1.431 -1.415 0 C-N-CA 124.447 1.099 . . . . 1.0 111.333 175.504 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 37.3 mm-40 -51.21 -30.88 18.57 Favored 'General case' 0 N--CA 1.43 -1.431 0 N-CA-C 118.88 2.918 . . . . 1.0 118.88 -173.154 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 6.6 m120 -66.95 -17.88 65.12 Favored 'General case' 0 N--CA 1.431 -1.424 0 O-C-N 119.761 -1.837 . . . . 1.0 114.0 179.007 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 86.95 -0.26 86.14 Favored Glycine 0 N--CA 1.429 -1.776 0 O-C-N 120.505 -1.372 . . . . 1.0 113.463 179.449 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 48.2 m -88.48 158.08 18.45 Favored 'General case' 0 N--CA 1.429 -1.502 0 C-N-CA 125.428 1.491 . . . . 1.0 107.66 167.702 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 6.8 ptpt -154.76 159.58 40.74 Favored 'General case' 0 N--CA 1.43 -1.431 0 O-C-N 120.933 -1.104 . . . . 1.0 112.878 -167.294 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 8.9 mm -100.37 137.64 27.23 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.477 0 N-CA-C 106.587 -1.635 . . . . 1.0 106.587 177.107 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 50' ' ' ILE . . . . . 0.405 ' HB ' ' HB3' ' A' ' 63' ' ' ALA . 4.7 mm -126.21 116.7 46.44 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.472 0 C-N-CA 124.518 1.127 . . . . 1.0 109.692 -178.516 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 51' ' ' ILE . . . . . 0.432 ' CG2' ' HE1' ' A' ' 14' ' ' TRP . 3.3 mt -128.47 128.11 67.78 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.428 0 CA-C-O 122.424 1.107 . . . . 1.0 112.378 -179.629 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 52' ' ' ASN . . . . . 0.611 ' H ' ' HD1' ' A' ' 61' ' ' TRP . 20.4 t-20 -151.35 162.47 40.87 Favored 'General case' 0 N--CA 1.43 -1.471 0 C-N-CA 126.452 1.901 . . . . 1.0 105.995 174.379 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -129.09 145.87 51.18 Favored 'General case' 0 N--CA 1.43 -1.432 0 C-N-CA 125.829 1.651 . . . . 1.0 109.897 -174.498 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 2.2 tt0 -151.25 -38.9 0.12 Allowed 'General case' 0 N--CA 1.431 -1.419 0 O-C-N 120.878 -1.139 . . . . 1.0 111.323 -168.993 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 28.8 mm-40 -70.99 156.55 91.9 Favored Pre-proline 0 N--CA 1.43 -1.47 0 N-CA-C 114.417 1.265 . . . . 1.0 114.417 -168.83 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 39.1 Cg_endo -75.88 -25.86 10.13 Favored 'Trans proline' 0 C--N 1.3 -1.987 0 C-N-CA 121.916 1.744 . . . . 1.0 114.126 -165.626 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 49.4 mt -93.51 -112.87 0.1 Allowed 'General case' 0 N--CA 1.429 -1.496 0 CA-C-O 122.726 1.251 . . . . 1.0 111.018 -173.804 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 58' ' ' HIS . . . . . 0.401 ' HA ' ' CD1' ' A' ' 6' ' ' PHE . 39.3 m170 -125.85 70.1 1.2 Allowed 'General case' 0 N--CA 1.431 -1.394 0 C-N-CA 124.619 1.168 . . . . 1.0 109.171 174.827 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 9.6 mt-30 -141.06 125.44 17.59 Favored 'General case' 0 N--CA 1.431 -1.42 0 O-C-N 120.362 -1.461 . . . . 1.0 109.93 -175.683 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 88.6 t -124.32 156.41 32.0 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.509 0 O-C-N 120.942 -1.099 . . . . 1.0 108.825 -174.77 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 61' ' ' TRP . . . . . 0.611 ' HD1' ' H ' ' A' ' 52' ' ' ASN . 0.0 OUTLIER -92.6 152.22 19.7 Favored 'General case' 0 N--CA 1.43 -1.426 0 O-C-N 120.142 -1.599 . . . . 1.0 110.553 -178.201 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 2.2 tm? -137.27 98.26 3.68 Favored 'General case' 0 N--CA 1.429 -1.5 0 O-C-N 120.41 -1.432 . . . . 1.0 110.465 176.107 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 63' ' ' ALA . . . . . 0.405 ' HB3' ' HB ' ' A' ' 50' ' ' ILE . . . -103.95 139.61 38.86 Favored 'General case' 0 N--CA 1.431 -1.422 0 CA-C-O 123.314 1.531 . . . . 1.0 111.812 172.378 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 64' ' ' THR . . . . . 0.478 HG23 ' H ' ' A' ' 65' ' ' LYS . 0.0 OUTLIER -153.98 -80.16 0.09 Allowed 'General case' 0 N--CA 1.43 -1.436 0 C-N-CA 126.301 1.84 . . . . 1.0 107.066 -174.304 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 65' ' ' LYS . . . . . 0.478 ' H ' HG23 ' A' ' 64' ' ' THR . 3.6 tmtt? -116.65 -53.74 2.49 Favored 'General case' 0 N--CA 1.429 -1.494 0 C-N-CA 125.182 1.393 . . . . 1.0 113.376 176.831 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 50.7 mt-30 -72.43 -24.35 61.21 Favored 'General case' 0 N--CA 1.429 -1.499 0 N-CA-C 117.99 2.589 . . . . 1.0 117.99 -160.803 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 151.49 -9.93 0.7 Allowed Glycine 0 N--CA 1.43 -1.711 0 N-CA-C 116.714 1.446 . . . . 1.0 116.714 174.593 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 98.85 77.01 1.29 Allowed Glycine 0 N--CA 1.43 -1.731 0 CA-C-N 118.902 1.351 . . . . 1.0 110.77 -176.066 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 14.5 m-30 -102.22 122.14 43.61 Favored 'General case' 0 N--CA 1.43 -1.468 0 C-N-CA 124.345 1.058 . . . . 1.0 108.547 -175.589 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -86.5 157.25 19.82 Favored 'General case' 0 N--CA 1.431 -1.411 0 O-C-N 119.974 -1.704 . . . . 1.0 114.288 -179.271 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 49.6 p90 -129.37 138.45 51.53 Favored 'General case' 0 N--CA 1.429 -1.499 0 N-CA-C 113.296 0.85 . . . . 1.0 113.296 -165.558 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 23.5 t0 -126.99 159.54 33.77 Favored 'General case' 0 N--CA 1.43 -1.443 0 C-N-CA 126.34 1.856 . . . . 1.0 110.183 -176.779 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 7.0 tt -91.78 122.44 34.33 Favored 'General case' 0 N--CA 1.429 -1.495 0 O-C-N 120.471 -1.393 . . . . 1.0 112.664 -170.764 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 28.9 tptp -83.56 -56.59 3.65 Favored 'General case' 0 N--CA 1.43 -1.47 0 O-C-N 120.441 -1.412 . . . . 1.0 110.782 167.826 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -170.84 -79.65 0.05 OUTLIER Glycine 0 CA--C 1.487 -1.663 0 O-C-N 120.91 -1.119 . . . . 1.0 111.411 -179.805 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 7.6 m-20 -93.79 5.59 51.15 Favored 'General case' 0 N--CA 1.43 -1.451 0 C-N-CA 124.936 1.294 . . . . 1.0 111.139 178.93 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 7.7 pt-20 -165.59 145.33 6.57 Favored 'General case' 0 N--CA 1.431 -1.414 0 N-CA-C 104.383 -2.451 . . . . 1.0 104.383 -153.716 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 78' ' ' TRP . . . . . . . . . . . . . 27.4 m95 -111.79 139.1 47.54 Favored 'General case' 0 N--CA 1.431 -1.39 0 N-CA-C 107.633 -1.247 . . . . 1.0 107.633 178.254 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 40.4 mt -96.32 135.73 29.48 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.483 0 C-N-CA 127.247 2.219 . . . . 1.0 107.977 -179.379 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 75.8 m -82.5 122.19 27.73 Favored 'General case' 0 N--CA 1.431 -1.41 0 N-CA-C 108.154 -1.054 . . . . 1.0 108.154 171.684 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 16.3 t70 -66.68 -47.87 71.1 Favored 'General case' 0 N--CA 1.429 -1.485 0 N-CA-C 114.224 1.194 . . . . 1.0 114.224 -167.227 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 17.1 mmt180 -72.25 129.24 37.97 Favored 'General case' 0 N--CA 1.43 -1.455 0 O-C-N 120.899 -1.126 . . . . 1.0 109.55 177.804 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 83' ' ' SER . . . . . . . . . . . . 0.27 5.6 t 76.45 -47.64 0.55 Allowed 'General case' 0 N--CA 1.428 -1.532 0 C-N-CA 126.869 2.068 . . . . 1.0 114.124 -168.473 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 99.33 70.91 0.97 Allowed Glycine 0 N--CA 1.429 -1.773 0 O-C-N 120.69 -1.256 . . . . 1.0 111.024 176.68 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 5.5 mm-40 -128.97 -131.89 0.22 Allowed 'General case' 0 N--CA 1.431 -1.418 0 C-N-CA 124.156 0.983 . . . . 1.0 110.752 -166.35 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 93.9 m -153.76 133.61 13.1 Favored 'General case' 0 N--CA 1.431 -1.383 0 O-C-N 120.551 -1.343 . . . . 1.0 109.46 -157.34 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . 0.309 0.0 OUTLIER -49.3 -83.11 0.01 OUTLIER 'General case' 0 N--CA 1.43 -1.446 0 N-CA-C 119.939 3.311 . . . . 1.0 119.939 -175.911 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 88' ' ' TRP . . . . . . . . . . . . . 7.9 m95 -65.83 -34.37 78.01 Favored 'General case' 0 N--CA 1.43 -1.443 0 O-C-N 119.84 -1.788 . . . . 1.0 113.367 -175.106 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -61.64 -41.97 98.25 Favored 'General case' 0 N--CA 1.431 -1.408 0 N-CA-C 114.409 1.263 . . . . 1.0 114.409 176.148 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 17.9 tp -67.82 -48.93 64.86 Favored 'General case' 0 N--CA 1.43 -1.454 0 O-C-N 120.647 -1.283 . . . . 1.0 111.054 175.808 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 58.0 tp -51.96 -46.33 64.76 Favored 'General case' 0 N--CA 1.429 -1.492 0 C-N-CA 126.268 1.827 . . . . 1.0 113.752 174.017 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 18.6 tt0 -53.32 -54.39 37.17 Favored 'General case' 0 N--CA 1.429 -1.501 0 C-N-CA 125.983 1.713 . . . . 1.0 111.873 171.639 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -59.23 -53.25 60.4 Favored 'General case' 0 N--CA 1.43 -1.429 0 N-CA-C 113.418 0.896 . . . . 1.0 113.418 -178.188 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -59.7 -43.92 93.88 Favored 'General case' 0 N--CA 1.43 -1.436 0 C-N-CA 125.841 1.656 . . . . 1.0 115.381 178.455 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -71.31 -40.31 70.87 Favored 'General case' 0 N--CA 1.429 -1.517 0 O-C-N 120.497 -1.377 . . . . 1.0 112.988 178.53 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 95.1 m -63.65 -37.02 85.76 Favored 'General case' 0 N--CA 1.43 -1.44 0 C-N-CA 126.415 1.886 . . . . 1.0 112.06 174.304 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -57.35 -54.54 45.67 Favored 'General case' 0 CA--C 1.489 -1.395 0 C-N-CA 127.108 2.163 . . . . 1.0 112.205 173.382 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 2.3 pt20 -73.57 -33.73 64.79 Favored 'General case' 0 N--CA 1.43 -1.454 0 N-CA-C 115.217 1.562 . . . . 1.0 115.217 179.165 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -75.36 -41.24 56.94 Favored 'General case' 0 N--CA 1.43 -1.47 0 O-C-N 120.111 -1.618 . . . . 1.0 115.206 177.863 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . 85.87 24.41 41.84 Favored Glycine 0 N--CA 1.429 -1.791 0 C-N-CA 124.692 1.139 . . . . 1.0 112.763 -175.198 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 9.3 pt-20 -175.44 159.19 2.39 Favored 'General case' 0 N--CA 1.43 -1.462 0 C-N-CA 126.495 1.918 . . . . 1.0 106.117 -176.24 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 44.0 m -69.79 130.77 43.22 Favored 'General case' 0 N--CA 1.43 -1.456 0 O-C-N 120.792 -1.193 . . . . 1.0 113.271 -169.041 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 69.3 t -102.1 120.96 52.52 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.416 0 N-CA-C 107.771 -1.196 . . . . 1.0 107.771 173.768 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 19.7 m -107.03 141.94 37.46 Favored 'General case' 0 N--CA 1.429 -1.493 0 N-CA-C 115.103 1.52 . . . . 1.0 115.103 -160.285 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 2.6 p90 -127.28 -43.36 1.63 Allowed 'General case' 0 N--CA 1.43 -1.467 0 C-N-CA 125.509 1.524 . . . . 1.0 110.783 179.191 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 30.2 mtt-85 . . . . . 0 C--O 1.261 1.671 0 C-N-CA 124.465 1.106 . . . . 1.0 111.05 -179.907 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 7.1 p30 . . . . . 0 N--CA 1.43 -1.458 0 N-CA-C 113.842 1.053 . . . . 1.0 113.842 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 35.3 t70 -55.92 -40.08 72.59 Favored 'General case' 0 N--CA 1.429 -1.479 0 C-N-CA 127.125 2.17 . . . . 1.0 113.46 -178.543 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 5.2 p -68.49 -37.94 80.55 Favored 'General case' 0 N--CA 1.43 -1.467 0 C-N-CA 126.274 1.83 . . . . 1.0 114.359 174.972 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 14.2 tp10 -67.74 -53.06 30.44 Favored 'General case' 0 N--CA 1.43 -1.435 0 C-N-CA 125.226 1.41 . . . . 1.0 110.115 177.925 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 16.3 t80 -47.25 -50.94 20.17 Favored 'General case' 0 N--CA 1.431 -1.425 0 C-N-CA 127.425 2.29 . . . . 1.0 114.821 169.657 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 35.2 m-70 -63.97 -41.43 97.56 Favored 'General case' 0 N--CA 1.43 -1.452 0 N-CA-C 114.907 1.447 . . . . 1.0 114.907 177.989 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -70.76 -37.19 73.38 Favored 'General case' 0 N--CA 1.43 -1.435 0 O-C-N 120.366 -1.459 . . . . 1.0 114.074 178.887 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 79.7 mt -59.58 -51.55 69.37 Favored 'General case' 0 N--CA 1.43 -1.444 0 C-N-CA 124.99 1.316 . . . . 1.0 111.747 168.239 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -54.06 -50.34 66.95 Favored 'General case' 0 N--CA 1.431 -1.416 0 C-N-CA 125.011 1.324 . . . . 1.0 113.458 176.991 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -51.58 -49.71 61.57 Favored 'General case' 0 N--CA 1.43 -1.425 0 N-CA-C 114.783 1.401 . . . . 1.0 114.783 173.136 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 12.2 pt20 -68.9 -33.27 73.49 Favored 'General case' 0 N--CA 1.43 -1.433 0 N-CA-C 115.583 1.697 . . . . 1.0 115.583 179.764 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 84.8 mt -66.74 -59.07 3.89 Favored 'General case' 0 N--CA 1.431 -1.419 0 O-C-N 120.087 -1.633 . . . . 1.0 111.02 174.753 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 1.2 m-90 -50.3 -50.11 51.58 Favored 'General case' 0 N--CA 1.429 -1.487 0 C-N-CA 125.65 1.58 . . . . 1.0 113.27 -179.565 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 41.0 tp -61.85 -59.05 5.71 Favored 'General case' 0 N--CA 1.43 -1.447 0 N-CA-C 113.626 0.973 . . . . 1.0 113.626 175.775 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 59.6 m -64.88 -37.42 87.58 Favored 'General case' 0 N--CA 1.431 -1.4 0 N-CA-C 114.252 1.204 . . . . 1.0 114.252 -173.621 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 93.5 mt -64.63 -54.24 32.7 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.458 0 C-N-CA 124.923 1.289 . . . . 1.0 111.686 174.83 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 1.7 tt0 -55.48 -49.66 71.94 Favored 'General case' 0 N--CA 1.43 -1.473 0 C-N-CA 123.984 0.914 . . . . 1.0 113.386 178.565 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 44.4 tt0 -54.65 -49.1 71.38 Favored 'General case' 0 N--CA 1.429 -1.493 0 C-N-CA 125.966 1.706 . . . . 1.0 114.025 174.173 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 7.4 tpm_? -58.95 -45.92 89.29 Favored 'General case' 0 N--CA 1.431 -1.406 0 O-C-N 120.726 -1.234 . . . . 1.0 114.291 179.818 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 3.8 pp -83.51 -26.97 29.71 Favored 'General case' 0 N--CA 1.431 -1.384 0 N-CA-C 115.097 1.517 . . . . 1.0 115.097 -177.387 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 8.7 t70 -62.71 -34.09 76.44 Favored 'General case' 0 CA--C 1.488 -1.405 0 O-C-N 120.336 -1.478 . . . . 1.0 113.342 163.591 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 19.2 t70 -70.59 -55.08 9.65 Favored 'General case' 0 N--CA 1.43 -1.472 0 C-N-CA 126.201 1.8 . . . . 1.0 114.559 178.405 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 24' ' ' TRP . . . . . . . . . . . . . 32.4 t-105 -73.03 138.68 46.11 Favored 'General case' 0 N--CA 1.43 -1.456 0 O-C-N 120.703 -1.248 . . . . 1.0 113.104 -172.643 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 63.3 m-20 -84.16 -141.33 0.07 Allowed 'General case' 0 N--CA 1.431 -1.408 0 O-C-N 120.327 -1.483 . . . . 1.0 112.054 177.519 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 164.3 -164.8 36.9 Favored Glycine 0 N--CA 1.431 -1.664 0 O-C-N 118.592 -2.568 . . . . 1.0 114.181 -175.221 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 37.4 t70 -86.84 -53.43 4.92 Favored 'General case' 0 N--CA 1.43 -1.463 0 C-N-CA 125.238 1.415 . . . . 1.0 107.911 169.242 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 4.5 t -82.7 -176.48 6.3 Favored 'General case' 0 N--CA 1.431 -1.414 0 C-N-CA 125.728 1.611 . . . . 1.0 109.691 178.94 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 32.9 t0 -99.85 178.63 4.76 Favored 'General case' 0 N--CA 1.43 -1.449 0 O-C-N 120.26 -1.525 . . . . 1.0 108.142 175.218 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 9.3 tp -152.26 126.58 1.41 Allowed 'Isoleucine or valine' 0 N--CA 1.43 -1.431 0 N-CA-C 106.936 -1.505 . . . . 1.0 106.936 -173.974 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 28.4 t70 -131.73 119.07 20.82 Favored 'General case' 0 N--CA 1.43 -1.439 0 CA-C-O 122.956 1.36 . . . . 1.0 109.13 163.299 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 17.3 p -86.21 131.17 34.3 Favored 'General case' 0 N--CA 1.43 -1.445 0 O-C-N 120.088 -1.632 . . . . 1.0 111.228 174.349 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 41.0 mm-40 -100.06 137.5 38.42 Favored 'General case' 0 N--CA 1.429 -1.488 0 C-N-CA 124.708 1.203 . . . . 1.0 108.916 174.651 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 3.5 tp -127.42 114.1 34.79 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.407 0 CA-C-O 124.046 1.879 . . . . 1.0 106.245 178.81 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 1.6 t-20 -125.81 179.98 4.93 Favored 'General case' 0 N--CA 1.43 -1.427 0 C-N-CA 124.805 1.242 . . . . 1.0 107.828 176.663 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -71.36 87.36 0.41 Allowed Glycine 0 N--CA 1.431 -1.653 0 O-C-N 120.566 -1.334 . . . . 1.0 115.898 -168.657 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 82.2 23.57 56.67 Favored Glycine 0 N--CA 1.429 -1.792 0 C-N-CA 125.379 1.466 . . . . 1.0 112.526 -171.889 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 61.8 t -138.84 135.05 42.92 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.475 0 CA-C-N 118.307 1.053 . . . . 1.0 109.109 -173.253 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 31.1 mt -118.07 142.01 47.86 Favored 'General case' 0 N--CA 1.43 -1.427 0 CA-C-O 122.919 1.343 . . . . 1.0 108.799 166.273 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -138.49 111.3 7.71 Favored 'General case' 0 N--CA 1.43 -1.426 0 O-C-N 120.422 -1.424 . . . . 1.0 108.436 178.032 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 70.3 mt -96.83 105.41 17.07 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.467 0 N-CA-C 107.362 -1.347 . . . . 1.0 107.362 -165.859 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 14.0 m -118.44 131.2 56.28 Favored 'General case' 0 N--CA 1.43 -1.457 0 CA-C-N 118.896 0.771 . . . . 1.0 112.994 -163.053 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 43' ' ' PHE . . . . . . . . . . . . . 1.4 m-85 -99.56 173.68 6.61 Favored 'General case' 0 N--CA 1.43 -1.431 0 O-C-N 120.608 -1.308 . . . . 1.0 111.193 -179.381 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -71.77 -19.03 62.08 Favored 'General case' 0 N--CA 1.429 -1.481 0 O-C-N 119.219 -2.175 . . . . 1.0 113.476 -179.466 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 29.0 t-20 -67.21 -17.97 65.05 Favored 'General case' 0 N--CA 1.429 -1.502 0 C-N-CA 126.811 2.044 . . . . 1.0 113.512 170.731 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 92.34 -14.9 63.5 Favored Glycine 0 N--CA 1.43 -1.74 0 O-C-N 119.962 -1.712 . . . . 1.0 113.683 179.666 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 13.8 m -77.8 167.86 20.86 Favored 'General case' 0 N--CA 1.431 -1.425 0 O-C-N 121.082 -1.246 . . . . 1.0 111.077 172.943 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 12.9 ptpt -169.93 157.68 6.82 Favored 'General case' 0 N--CA 1.43 -1.439 0 O-C-N 121.156 -0.965 . . . . 1.0 113.07 -162.668 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 5.3 mm -101.54 137.11 30.39 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.438 0 C-N-CA 125.791 1.636 . . . . 1.0 107.389 171.823 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 16.1 mm -111.17 116.85 53.61 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.437 0 C-N-CA 125.032 1.333 . . . . 1.0 109.382 -178.013 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 3.0 mt -125.43 124.76 67.68 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.506 0 O-C-N 120.717 -1.239 . . . . 1.0 110.695 179.297 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 52' ' ' ASN . . . . . 0.481 ' H ' ' HD1' ' A' ' 61' ' ' TRP . 26.6 t30 -162.52 172.93 14.7 Favored 'General case' 0 N--CA 1.43 -1.471 0 N-CA-C 103.142 -2.91 . . . . 1.0 103.142 -172.815 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 1.9 ptm180 -139.76 150.57 44.93 Favored 'General case' 0 N--CA 1.429 -1.524 0 CA-C-O 122.546 1.165 . . . . 1.0 112.337 -158.913 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 15.8 mm-40 -107.16 -108.42 0.31 Allowed 'General case' 0 N--CA 1.43 -1.448 0 C-N-CA 124.653 1.181 . . . . 1.0 109.562 -167.173 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 33.2 mm-40 -79.23 135.75 57.6 Favored Pre-proline 0 N--CA 1.43 -1.446 0 CA-C-O 117.718 -1.134 . . . . 1.0 112.799 -172.041 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 98.5 Cg_endo -73.45 62.69 4.46 Favored 'Trans proline' 0 N--CA 1.434 -1.999 0 C-N-CA 123.277 2.651 . . . . 1.0 112.319 162.997 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 57' ' ' LEU . . . . . 0.432 ' O ' ' HD2' ' A' ' 58' ' ' HIS . 73.1 mt -120.32 -103.0 0.41 Allowed 'General case' 0 N--CA 1.429 -1.493 0 N-CA-C 102.841 -3.022 . . . . 1.0 102.841 164.483 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 58' ' ' HIS . . . . . 0.432 ' HD2' ' O ' ' A' ' 57' ' ' LEU . 42.0 m170 -132.47 92.02 3.01 Favored 'General case' 0 N--CA 1.429 -1.489 0 N-CA-C 106.622 -1.622 . . . . 1.0 106.622 159.412 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 22.1 tt0 -158.68 122.05 3.84 Favored 'General case' 0 N--CA 1.429 -1.516 0 CA-C-N 121.687 2.04 . . . . 1.0 114.161 173.005 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 86.4 t -133.36 157.57 42.63 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.451 0 C-N-CA 127.031 2.132 . . . . 1.0 109.437 -179.013 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 61' ' ' TRP . . . . . 0.481 ' HD1' ' H ' ' A' ' 52' ' ' ASN . 0.0 OUTLIER -111.36 156.06 22.16 Favored 'General case' 0 N--CA 1.429 -1.505 0 C-N-CA 127.867 2.467 . . . . 1.0 109.755 -174.169 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . 0.277 2.3 pt? -150.91 134.01 16.03 Favored 'General case' 0 N--CA 1.432 -1.364 0 CA-C-N 120.686 1.584 . . . . 1.0 113.916 150.939 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -120.08 147.29 45.03 Favored 'General case' 0 N--CA 1.429 -1.514 0 C-N-CA 125.367 1.467 . . . . 1.0 114.429 -179.557 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 64' ' ' THR . . . . . . . . . . . . . 12.5 t -153.96 -149.52 0.29 Allowed 'General case' 0 N--CA 1.429 -1.509 0 C-N-CA 126.745 2.018 . . . . 1.0 112.388 -172.694 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 5.6 tmtm? -63.56 -53.57 49.64 Favored 'General case' 0 N--CA 1.43 -1.456 0 C-N-CA 130.116 3.366 . . . . 1.0 114.362 -174.404 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 31.3 tt0 -82.24 2.19 33.02 Favored 'General case' 0 N--CA 1.429 -1.492 0 CA-C-O 122.581 1.181 . . . . 1.0 111.602 -177.008 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 117.5 -72.92 0.29 Allowed Glycine 0 N--CA 1.43 -1.732 0 N-CA-C 107.343 -2.303 . . . . 1.0 107.343 -177.4 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 106.06 -173.43 19.85 Favored Glycine 0 N--CA 1.43 -1.733 0 C-N-CA 124.229 0.918 . . . . 1.0 112.486 -176.382 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -162.05 169.83 20.29 Favored 'General case' 0 N--CA 1.431 -1.423 0 N-CA-C 107.284 -1.376 . . . . 1.0 107.284 -173.008 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 19.8 p80 -79.87 159.9 26.25 Favored 'General case' 0 N--CA 1.431 -1.422 0 O-C-N 119.775 -1.828 . . . . 1.0 114.653 174.504 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 71' ' ' PHE . . . . . . . . . . . . 0.3 72.3 t80 -112.21 113.77 26.2 Favored 'General case' 0 N--CA 1.431 -1.402 0 C-N-CA 127.744 2.418 . . . . 1.0 107.019 -158.565 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 5.7 m-20 -134.12 155.1 50.66 Favored 'General case' 0 N--CA 1.43 -1.459 0 CA-C-O 121.851 0.834 . . . . 1.0 110.546 -173.99 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 8.0 tt -97.37 133.53 41.84 Favored 'General case' 0 N--CA 1.431 -1.42 0 O-C-N 119.68 -1.888 . . . . 1.0 111.869 -166.677 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 53.5 tttm -101.81 -56.39 2.29 Favored 'General case' 0 N--CA 1.43 -1.471 0 O-C-N 120.823 -1.173 . . . . 1.0 109.556 174.539 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -157.03 -96.91 0.12 Allowed Glycine 0 N--CA 1.431 -1.677 0 O-C-N 121.035 -1.041 . . . . 1.0 111.346 175.863 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 27.9 m-20 -89.72 16.31 8.17 Favored 'General case' 0 N--CA 1.429 -1.479 0 O-C-N 121.047 -1.266 . . . . 1.0 111.405 179.94 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 32.9 tt0 -166.02 132.83 2.66 Favored 'General case' 0 N--CA 1.43 -1.427 0 N-CA-C 102.046 -3.316 . . . . 1.0 102.046 -161.484 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 78' ' ' TRP . . . . . . . . . . . . . 50.2 m95 -87.75 144.88 26.39 Favored 'General case' 0 N--CA 1.432 -1.37 0 N-CA-C 106.322 -1.732 . . . . 1.0 106.322 175.186 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 9.4 pt -102.35 167.54 2.33 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.485 0 N-CA-C 106.618 -1.623 . . . . 1.0 106.618 174.083 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 1.4 m -89.79 135.65 33.5 Favored 'General case' 0 N--CA 1.429 -1.484 0 O-C-N 120.195 -1.565 . . . . 1.0 107.193 155.29 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 36.8 t70 -59.94 -38.87 83.66 Favored 'General case' 0 N--CA 1.43 -1.447 0 CA-C-N 120.689 1.586 . . . . 1.0 115.069 -174.238 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -9.85 -84.34 0.0 OUTLIER 'General case' 0 N--CA 1.43 -1.467 0 C-N-CA 131.628 3.971 . . . . 1.0 118.457 176.634 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 58.8 m -111.19 -12.79 14.09 Favored 'General case' 0 CA--C 1.489 -1.371 0 O-C-N 120.485 -1.384 . . . . 1.0 109.588 158.126 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 115.85 76.41 0.63 Allowed Glycine 0 N--CA 1.43 -1.763 0 N-CA-C 108.041 -2.023 . . . . 1.0 108.041 -173.509 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 5.2 mm-40 -100.74 -136.4 0.31 Allowed 'General case' 0 N--CA 1.431 -1.419 0 N-CA-C 109.141 -0.688 . . . . 1.0 109.141 -175.583 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 95.5 m -154.2 133.95 12.94 Favored 'General case' 0 N--CA 1.43 -1.445 0 O-C-N 120.156 -1.59 . . . . 1.0 110.402 -171.317 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 1.1 t80 -38.02 -92.13 0.0 OUTLIER 'General case' 0 CA--C 1.489 -1.375 0 C-N-CA 128.432 2.693 . . . . 1.0 115.842 168.895 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 88' ' ' TRP . . . . . . . . . . . . . 50.7 m95 -63.16 -32.69 74.14 Favored 'General case' 0 N--CA 1.431 -1.419 0 C-N-CA 125.649 1.58 . . . . 1.0 113.454 -167.195 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 35.7 t70 -77.96 -42.94 31.24 Favored 'General case' 0 N--CA 1.43 -1.456 0 C-N-CA 125.088 1.355 . . . . 1.0 113.027 -175.898 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 35.0 tp -75.3 -38.9 60.08 Favored 'General case' 0 N--CA 1.43 -1.46 0 O-C-N 119.427 -2.045 . . . . 1.0 111.332 179.335 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 41.9 tp -54.78 -38.64 67.51 Favored 'General case' 0 N--CA 1.43 -1.427 0 C-N-CA 126.33 1.852 . . . . 1.0 113.626 168.106 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 3.4 tm-20 -56.85 -59.9 4.35 Favored 'General case' 0 N--CA 1.429 -1.506 0 C-N-CA 124.611 1.164 . . . . 1.0 112.043 165.875 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 35.9 mt-30 -51.92 -41.81 62.29 Favored 'General case' 0 N--CA 1.43 -1.425 0 N-CA-C 116.28 1.956 . . . . 1.0 116.28 177.394 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -59.19 -58.39 8.84 Favored 'General case' 0 N--CA 1.43 -1.473 0 C-N-CA 126.523 1.929 . . . . 1.0 113.906 172.424 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -62.77 -49.11 76.3 Favored 'General case' 0 N--CA 1.429 -1.507 0 O-C-N 120.41 -1.431 . . . . 1.0 113.446 179.783 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 66.1 m -48.18 -47.55 35.11 Favored 'General case' 0 N--CA 1.43 -1.437 0 C-N-CA 127.859 2.464 . . . . 1.0 114.913 170.501 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 6.6 pt20 -73.4 -30.93 63.59 Favored 'General case' 0 N--CA 1.43 -1.441 0 O-C-N 120.306 -1.496 . . . . 1.0 114.428 -179.222 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 49.7 mt-30 -81.03 -37.93 28.3 Favored 'General case' 0 N--CA 1.431 -1.379 0 O-C-N 120.323 -1.486 . . . . 1.0 113.868 174.715 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -79.42 -42.76 24.73 Favored 'General case' 0 N--CA 1.43 -1.456 0 O-C-N 120.32 -1.488 . . . . 1.0 114.98 -179.686 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . 106.98 17.75 11.35 Favored Glycine 0 N--CA 1.431 -1.695 0 O-C-N 120.683 -1.261 . . . . 1.0 115.762 175.408 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 4.9 tt0 -162.41 152.78 16.81 Favored 'General case' 0 N--CA 1.43 -1.455 0 N-CA-C 104.946 -2.242 . . . . 1.0 104.946 179.527 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 35.1 m -53.48 108.31 0.33 Allowed 'General case' 0 N--CA 1.43 -1.463 0 C-N-CA 125.238 1.415 . . . . 1.0 114.571 175.317 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 49.0 t -89.43 110.49 21.69 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.414 0 CA-C-O 123.258 1.504 . . . . 1.0 108.244 176.892 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 61.5 m -94.19 98.98 11.33 Favored 'General case' 0 N--CA 1.43 -1.46 0 N-CA-C 113.615 0.968 . . . . 1.0 113.615 -162.525 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 88.5 m-85 -89.17 -32.91 17.24 Favored 'General case' 0 N--CA 1.429 -1.485 0 O-C-N 120.961 -1.087 . . . . 1.0 112.884 176.738 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 30.7 mmt180 . . . . . 0 C--O 1.26 1.647 0 N-CA-C 107.3 -1.37 . . . . 1.0 107.3 172.78 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 76.8 m-20 . . . . . 0 N--CA 1.431 -1.405 0 CA-C-O 121.172 0.51 . . . . 1.0 110.542 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -56.86 -45.95 82.12 Favored 'General case' 0 N--CA 1.43 -1.446 0 C-N-CA 126.723 2.009 . . . . 1.0 110.611 170.95 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 49.5 m -60.06 -40.79 90.69 Favored 'General case' 0 N--CA 1.431 -1.416 0 C-N-CA 125.285 1.434 . . . . 1.0 114.776 176.57 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 26.1 tt0 -62.8 -57.34 11.25 Favored 'General case' 0 N--CA 1.429 -1.494 0 C-N-CA 124.236 1.014 . . . . 1.0 111.933 175.265 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 2.4 m-85 -67.31 -24.79 65.79 Favored 'General case' 0 N--CA 1.429 -1.499 0 N-CA-C 115.506 1.669 . . . . 1.0 115.506 178.555 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 10.0 t60 -62.56 -43.28 99.19 Favored 'General case' 0 N--CA 1.43 -1.429 0 O-C-N 119.709 -1.869 . . . . 1.0 112.982 167.857 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -73.84 -45.47 51.02 Favored 'General case' 0 N--CA 1.43 -1.458 0 O-C-N 120.355 -1.465 . . . . 1.0 113.683 177.965 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 84.2 mt -59.76 -44.82 93.69 Favored 'General case' 0 N--CA 1.429 -1.495 0 C-N-CA 124.539 1.135 . . . . 1.0 112.782 173.441 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -58.47 -40.57 83.06 Favored 'General case' 0 N--CA 1.43 -1.47 0 O-C-N 120.538 -1.351 . . . . 1.0 113.427 173.01 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -58.51 -38.48 77.78 Favored 'General case' 0 N--CA 1.431 -1.417 0 CA-C-N 120.276 1.398 . . . . 1.0 114.138 172.358 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 57.9 mm-40 -63.06 -47.94 80.79 Favored 'General case' 0 N--CA 1.43 -1.453 0 O-C-N 119.999 -1.688 . . . . 1.0 114.98 171.719 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 77.6 mt -60.71 -50.06 75.0 Favored 'General case' 0 N--CA 1.431 -1.422 0 O-C-N 120.283 -1.51 . . . . 1.0 112.508 173.863 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 0.4 OUTLIER -46.5 -61.75 1.67 Allowed 'General case' 0 N--CA 1.43 -1.451 0 C-N-CA 127.594 2.358 . . . . 1.0 111.799 177.416 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 53.0 tp -53.62 -58.21 7.99 Favored 'General case' 0 N--CA 1.431 -1.415 0 C-N-CA 125.041 1.336 . . . . 1.0 113.304 174.519 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 28.7 m -60.93 -44.13 97.64 Favored 'General case' 0 N--CA 1.429 -1.485 0 N-CA-C 115.038 1.496 . . . . 1.0 115.038 -170.234 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 7.4 mt -83.41 -27.85 7.69 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.408 0 O-C-N 120.237 -1.539 . . . . 1.0 111.4 -178.196 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 5.4 tt0 -59.33 -50.23 74.78 Favored 'General case' 0 N--CA 1.431 -1.394 0 O-C-N 119.852 -1.78 . . . . 1.0 110.944 167.714 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 53.3 mt-10 -51.84 -52.86 46.41 Favored 'General case' 0 N--CA 1.429 -1.48 0 C-N-CA 126.234 1.814 . . . . 1.0 114.397 172.315 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -63.94 -45.28 89.9 Favored 'General case' 0 N--CA 1.43 -1.472 0 O-C-N 120.277 -1.515 . . . . 1.0 114.843 -177.933 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 96.0 mt -63.93 -49.17 73.67 Favored 'General case' 0 N--CA 1.43 -1.447 0 N-CA-C 115.486 1.661 . . . . 1.0 115.486 174.207 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 25.2 t0 -58.28 -37.58 75.3 Favored 'General case' 0 N--CA 1.429 -1.492 0 O-C-N 119.517 -1.99 . . . . 1.0 114.501 174.349 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 18.2 t70 -91.21 28.32 1.67 Allowed 'General case' 0 N--CA 1.43 -1.46 0 C-N-CA 125.643 1.577 . . . . 1.0 113.9 177.201 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 24' ' ' TRP . . . . . . . . . . . . . 14.1 t90 -65.41 -66.81 0.5 Allowed 'General case' 0 N--CA 1.43 -1.47 0 O-C-N 119.51 -1.994 . . . . 1.0 113.356 176.844 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 29.0 t0 83.2 167.71 0.11 Allowed 'General case' 0 N--CA 1.43 -1.452 0 C-N-CA 127.368 2.267 . . . . 1.0 113.841 172.912 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 116.51 -134.59 11.45 Favored Glycine 0 N--CA 1.431 -1.686 0 C-N-CA 124.803 1.192 . . . . 1.0 111.785 177.223 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -80.57 -28.54 37.16 Favored 'General case' 0 N--CA 1.429 -1.519 0 C-N-CA 126.524 1.93 . . . . 1.0 111.054 -174.921 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 81.9 p -77.42 171.51 14.77 Favored 'General case' 0 N--CA 1.432 -1.366 0 C-N-CA 127.176 2.191 . . . . 1.0 115.68 -172.387 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 17.2 t0 -132.32 157.66 43.88 Favored 'General case' 0 N--CA 1.429 -1.478 0 N-CA-C 107.051 -1.462 . . . . 1.0 107.051 166.18 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 16.6 tt -159.62 123.33 0.41 Allowed 'Isoleucine or valine' 0 N--CA 1.43 -1.461 0 CA-C-O 123.088 1.423 . . . . 1.0 107.754 -169.274 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 31.9 t0 -115.7 101.59 8.97 Favored 'General case' 0 N--CA 1.43 -1.472 0 C-N-CA 127.554 2.342 . . . . 1.0 108.212 -179.377 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 21.7 p -89.26 134.48 34.03 Favored 'General case' 0 N--CA 1.43 -1.447 0 O-C-N 120.283 -1.511 . . . . 1.0 110.345 174.841 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 19.5 mt-10 -129.03 130.11 46.19 Favored 'General case' 0 N--CA 1.431 -1.379 0 O-C-N 120.488 -1.383 . . . . 1.0 111.475 -175.996 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 3.3 tp -106.51 110.77 32.71 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.456 0 C-N-CA 127.34 2.256 . . . . 1.0 105.893 178.335 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 62.7 m-80 -115.17 -178.5 3.39 Favored 'General case' 0 N--CA 1.429 -1.503 0 C-N-CA 126.255 1.822 . . . . 1.0 107.786 175.524 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -71.98 92.79 0.56 Allowed Glycine 0 N--CA 1.431 -1.669 0 O-C-N 119.816 -1.803 . . . . 1.0 115.695 -167.031 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 85.76 11.42 74.05 Favored Glycine 0 N--CA 1.429 -1.782 0 C-N-CA 125.898 1.713 . . . . 1.0 113.264 -174.194 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 48.5 t -136.97 125.89 35.8 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.426 0 O-C-N 121.615 -0.932 . . . . 1.0 111.048 -165.429 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 13.5 mt -105.47 126.0 51.63 Favored 'General case' 0 N--CA 1.43 -1.437 0 CA-C-O 124.511 2.101 . . . . 1.0 108.933 161.587 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -126.66 120.73 30.21 Favored 'General case' 0 N--CA 1.43 -1.449 0 N-CA-C 104.412 -2.44 . . . . 1.0 104.412 -178.621 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 4.5 mp -119.09 126.29 75.23 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.484 0 N-CA-C 108.011 -1.107 . . . . 1.0 108.011 -173.676 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 44.0 p -129.88 130.45 45.22 Favored 'General case' 0 N--CA 1.428 -1.547 0 CA-C-O 121.421 0.629 . . . . 1.0 110.932 -171.83 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 43' ' ' PHE . . . . . . . . . . . . . 1.9 p90 -120.02 172.31 7.83 Favored 'General case' 0 N--CA 1.429 -1.494 0 O-C-N 120.552 -1.343 . . . . 1.0 111.343 -176.395 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -64.02 -24.43 67.71 Favored 'General case' 0 N--CA 1.43 -1.466 0 N-CA-C 116.774 2.138 . . . . 1.0 116.774 -160.062 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 31.1 m120 -66.22 -18.17 65.18 Favored 'General case' 0 N--CA 1.429 -1.489 0 N-CA-C 115.369 1.618 . . . . 1.0 115.369 173.848 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 83.57 43.69 7.23 Favored Glycine 0 N--CA 1.429 -1.774 0 N-CA-C 109.898 -1.281 . . . . 1.0 109.898 -169.929 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 57.8 m -123.94 158.71 31.38 Favored 'General case' 0 N--CA 1.43 -1.468 0 C-N-CA 126.336 1.855 . . . . 1.0 107.213 -177.382 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 22.1 ptmt -151.35 142.3 23.0 Favored 'General case' 0 N--CA 1.43 -1.442 0 N-CA-C 115.21 1.559 . . . . 1.0 115.21 -160.985 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 4.7 mm -109.18 132.71 56.53 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.433 0 N-CA-C 106.136 -1.801 . . . . 1.0 106.136 166.651 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 2.7 tp -125.0 119.75 56.69 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.505 0 CA-C-O 123.116 1.436 . . . . 1.0 109.19 174.243 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 3.0 mt -124.69 96.02 3.58 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.386 0 C-N-CA 126.229 1.812 . . . . 1.0 110.769 -179.035 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 27.2 m120 -94.68 150.77 19.88 Favored 'General case' 0 N--CA 1.43 -1.473 0 CA-C-O 123.864 1.792 . . . . 1.0 108.469 166.97 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 5.8 tmm_? -153.51 141.6 20.38 Favored 'General case' 0 N--CA 1.429 -1.495 0 CA-C-O 123.237 1.494 . . . . 1.0 110.933 -163.977 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -111.57 132.02 54.84 Favored 'General case' 0 N--CA 1.428 -1.541 0 C-N-CA 127.484 2.314 . . . . 1.0 107.352 178.047 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 56.0 mt-10 -67.33 -48.88 45.5 Favored Pre-proline 0 N--CA 1.43 -1.44 0 CA-C-O 115.687 -2.101 . . . . 1.0 115.295 165.573 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 92.4 Cg_endo -77.29 -172.31 1.41 Allowed 'Trans proline' 0 N--CA 1.434 -2.004 0 CA-C-N 126.449 3.339 . . . . 1.0 112.586 172.401 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 22.3 mt 77.7 -44.54 0.42 Allowed 'General case' 0 N--CA 1.43 -1.45 0 C-N-CA 127.419 2.288 . . . . 1.0 114.609 173.989 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 3.8 m170 91.15 47.0 0.01 OUTLIER 'General case' 0 N--CA 1.43 -1.458 0 C-N-CA 128.865 2.866 . . . . 1.0 112.673 169.035 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -150.49 161.86 41.72 Favored 'General case' 0 N--CA 1.43 -1.454 0 O-C-N 120.403 -1.435 . . . . 1.0 107.169 174.984 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 91.3 t -123.14 154.5 28.77 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.403 0 N-CA-C 108.126 -1.064 . . . . 1.0 108.126 173.166 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 61' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -90.1 153.67 20.36 Favored 'General case' 0 N--CA 1.43 -1.451 0 CA-C-N 120.91 1.687 . . . . 1.0 110.376 176.665 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 2.1 tm? -147.61 103.93 3.57 Favored 'General case' 0 N--CA 1.429 -1.477 0 O-C-N 119.144 -2.222 . . . . 1.0 111.035 178.761 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -123.97 136.07 54.06 Favored 'General case' 0 N--CA 1.43 -1.433 0 O-C-N 120.818 -1.176 . . . . 1.0 113.742 172.915 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 64' ' ' THR . . . . . . . . . . . . 0.258 0.1 OUTLIER -134.66 -80.84 0.44 Allowed 'General case' 0 N--CA 1.429 -1.475 0 N-CA-C 107.415 -1.328 . . . . 1.0 107.415 171.456 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 6.1 tmtm? -82.31 -83.69 0.12 Allowed 'General case' 0 N--CA 1.43 -1.442 0 O-C-N 120.242 -1.536 . . . . 1.0 113.161 -175.84 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 20.9 tt0 -128.51 -26.38 2.77 Favored 'General case' 0 N--CA 1.43 -1.464 0 O-C-N 120.218 -1.551 . . . . 1.0 111.733 -175.357 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . -92.19 71.25 1.67 Allowed Glycine 0 N--CA 1.431 -1.689 0 O-C-N 120.692 -1.255 . . . . 1.0 110.839 -179.466 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . -77.97 94.78 1.23 Allowed Glycine 0 N--CA 1.43 -1.759 0 C-N-CA 123.382 0.515 . . . . 1.0 112.522 168.831 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 15.5 m-85 -126.45 151.53 47.62 Favored 'General case' 0 N--CA 1.43 -1.447 0 N-CA-C 107.699 -1.223 . . . . 1.0 107.699 -171.625 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 12.8 p80 -92.71 158.17 16.06 Favored 'General case' 0 N--CA 1.431 -1.392 0 O-C-N 120.187 -1.571 . . . . 1.0 111.063 169.411 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 47.1 p90 -130.01 143.32 50.73 Favored 'General case' 0 N--CA 1.431 -1.423 0 N-CA-C 114.379 1.252 . . . . 1.0 114.379 -162.503 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 30.8 m-20 -125.02 154.35 41.41 Favored 'General case' 0 N--CA 1.43 -1.464 0 C-N-CA 125.74 1.616 . . . . 1.0 110.496 -177.729 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 64.2 tp -87.07 137.48 32.31 Favored 'General case' 0 N--CA 1.43 -1.433 0 C-N-CA 125.625 1.57 . . . . 1.0 111.555 -178.397 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 2.5 mmmp? -101.46 -76.15 0.57 Allowed 'General case' 0 N--CA 1.43 -1.471 0 O-C-N 120.694 -1.254 . . . . 1.0 109.279 165.076 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -146.12 -76.35 0.02 OUTLIER Glycine 0 N--CA 1.43 -1.741 0 O-C-N 121.133 -0.98 . . . . 1.0 112.062 -178.674 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 37.8 m-20 -113.99 39.7 2.65 Favored 'General case' 0 N--CA 1.429 -1.502 0 C-N-CA 124.695 1.198 . . . . 1.0 109.382 170.637 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 15.0 tp10 -168.63 138.0 2.3 Favored 'General case' 0 N--CA 1.43 -1.453 0 N-CA-C 103.624 -2.732 . . . . 1.0 103.624 -178.81 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 78' ' ' TRP . . . . . . . . . . . . . 45.1 m95 -101.65 141.55 34.34 Favored 'General case' 0 N--CA 1.429 -1.477 0 N-CA-C 104.984 -2.228 . . . . 1.0 104.984 165.51 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 9.9 pt -105.11 160.6 5.21 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.432 0 O-C-N 120.527 -1.358 . . . . 1.0 107.93 176.744 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 39.0 m -82.74 133.54 35.15 Favored 'General case' 0 N--CA 1.43 -1.431 0 O-C-N 121.041 -1.037 . . . . 1.0 108.674 167.765 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 29.0 t70 -65.25 -43.29 91.84 Favored 'General case' 0 N--CA 1.43 -1.469 0 CA-C-N 120.577 1.535 . . . . 1.0 112.774 -178.092 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 29.2 tpt85 -66.63 101.79 0.83 Allowed 'General case' 0 N--CA 1.43 -1.428 0 C-N-CA 126.822 2.049 . . . . 1.0 111.38 -179.054 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 83' ' ' SER . . . . . . . . . . . . 0.279 15.4 m 80.52 -43.49 0.23 Allowed 'General case' 0 N--CA 1.43 -1.433 0 C-N-CA 128.619 2.767 . . . . 1.0 114.931 -171.87 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 110.86 81.78 1.23 Allowed Glycine 0 N--CA 1.43 -1.751 0 N-CA-C 109.71 -1.356 . . . . 1.0 109.71 -176.181 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 85' ' ' GLU . . . . . . . . . . . . 0.264 16.0 mt-10 -124.72 -140.5 0.29 Allowed 'General case' 0 N--CA 1.43 -1.455 0 CA-C-N 118.19 0.995 . . . . 1.0 109.535 -172.0 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 62.9 m -146.04 129.2 16.63 Favored 'General case' 0 N--CA 1.43 -1.461 0 O-C-N 119.592 -1.942 . . . . 1.0 110.004 -169.388 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 15.0 t80 -58.86 -81.87 0.02 OUTLIER 'General case' 0 N--CA 1.429 -1.481 0 N-CA-C 117.11 2.263 . . . . 1.0 117.11 -171.277 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 88' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -66.94 -34.38 77.65 Favored 'General case' 0 N--CA 1.429 -1.487 0 O-C-N 120.608 -1.307 . . . . 1.0 112.958 -170.697 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 35.5 t70 -59.93 -47.51 85.47 Favored 'General case' 0 N--CA 1.43 -1.458 0 C-N-CA 126.233 1.813 . . . . 1.0 114.62 173.074 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 49.3 tp -69.81 -41.42 75.05 Favored 'General case' 0 N--CA 1.429 -1.524 0 O-C-N 119.541 -1.974 . . . . 1.0 111.981 178.521 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 45.3 tp -50.58 -44.27 56.78 Favored 'General case' 0 N--CA 1.429 -1.519 0 C-N-CA 126.584 1.954 . . . . 1.0 113.763 167.698 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 2.7 tm-20 -59.55 -50.36 74.21 Favored 'General case' 0 N--CA 1.429 -1.504 0 C-N-CA 125.329 1.452 . . . . 1.0 113.122 172.324 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 37.5 mt-30 -53.33 -45.55 69.1 Favored 'General case' 0 N--CA 1.43 -1.446 0 CA-C-N 120.188 1.358 . . . . 1.0 114.373 173.693 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -62.71 -44.47 96.14 Favored 'General case' 0 N--CA 1.43 -1.461 0 O-C-N 120.219 -1.551 . . . . 1.0 115.133 175.024 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -71.21 -45.23 63.77 Favored 'General case' 0 N--CA 1.43 -1.426 0 O-C-N 119.692 -1.88 . . . . 1.0 113.808 178.233 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 63.0 m -57.46 -30.83 65.36 Favored 'General case' 0 N--CA 1.431 -1.409 0 C-N-CA 127.764 2.425 . . . . 1.0 112.521 174.631 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -63.54 -72.36 0.14 Allowed 'General case' 0 N--CA 1.429 -1.507 0 C-N-CA 125.004 1.321 . . . . 1.0 112.098 168.711 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 3.2 pt20 -70.5 -12.17 61.4 Favored 'General case' 0 N--CA 1.43 -1.425 0 N-CA-C 116.756 2.132 . . . . 1.0 116.756 -169.76 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -90.51 -48.2 7.24 Favored 'General case' 0 N--CA 1.43 -1.446 0 C-N-CA 124.854 1.261 . . . . 1.0 112.139 164.643 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . 110.62 4.33 28.38 Favored Glycine 0 N--CA 1.43 -1.702 0 O-C-N 121.037 -1.039 . . . . 1.0 114.379 -178.614 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 11.2 pt-20 -162.91 165.87 24.61 Favored 'General case' 0 N--CA 1.429 -1.511 0 N-CA-C 106.754 -1.573 . . . . 1.0 106.754 -177.087 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 96.4 m -70.83 121.66 18.45 Favored 'General case' 0 N--CA 1.431 -1.424 0 CA-C-N 120.313 1.415 . . . . 1.0 113.424 -173.342 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 76.6 t -98.62 121.36 49.1 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.493 0 C-N-CA 127.272 2.229 . . . . 1.0 109.421 -179.625 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 29.6 m -67.27 124.07 22.09 Favored 'General case' 0 N--CA 1.43 -1.457 0 C-N-CA 128.845 2.858 . . . . 1.0 115.557 -172.721 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 1.6 p90 -140.85 -56.12 0.5 Allowed 'General case' 0 N--CA 1.429 -1.482 0 O-C-N 120.196 -1.565 . . . . 1.0 112.174 -156.032 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 17.6 ttt180 . . . . . 0 C--O 1.262 1.723 0 C-N-CA 125.346 1.459 . . . . 1.0 111.13 -171.938 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 2.2 m120 . . . . . 0 N--CA 1.431 -1.406 0 N-CA-C 118.876 2.917 . . . . 1.0 118.876 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 11.0 p-10 -71.51 -25.34 62.21 Favored 'General case' 0 N--CA 1.43 -1.436 0 O-C-N 120.181 -1.574 . . . . 1.0 114.129 -175.989 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 28.2 m -71.3 -53.65 13.54 Favored 'General case' 0 N--CA 1.43 -1.451 0 C-N-CA 124.877 1.271 . . . . 1.0 110.338 175.943 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 44.6 mm-40 -57.55 -51.17 70.59 Favored 'General case' 0 N--CA 1.429 -1.483 0 C-N-CA 126.622 1.969 . . . . 1.0 113.509 175.778 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 5.1 t80 -56.42 -39.73 73.54 Favored 'General case' 0 CA--C 1.489 -1.4 0 N-CA-C 114.833 1.42 . . . . 1.0 114.833 172.768 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . 0.31 0.2 OUTLIER -67.61 -40.42 84.69 Favored 'General case' 0 N--CA 1.43 -1.429 0 O-C-N 119.543 -1.973 . . . . 1.0 115.009 173.015 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 81.5 mtt180 -56.4 -53.96 51.26 Favored 'General case' 0 N--CA 1.429 -1.476 0 C-N-CA 125.28 1.432 . . . . 1.0 113.832 177.957 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . 0.454 HD12 ' N ' ' A' ' 10' ' ' ALA . 3.4 pp -62.0 -42.28 98.98 Favored 'General case' 0 N--CA 1.429 -1.504 0 C-N-CA 124.042 0.937 . . . . 1.0 112.865 176.936 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . 0.454 ' N ' HD12 ' A' ' 9' ' ' LEU . . . -56.92 -47.06 81.48 Favored 'General case' 0 N--CA 1.431 -1.419 0 C-N-CA 124.927 1.291 . . . . 1.0 113.996 172.598 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 58.7 m-20 -58.85 -41.7 87.6 Favored 'General case' 0 N--CA 1.43 -1.447 0 C-N-CA 125.484 1.514 . . . . 1.0 113.07 176.265 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . 0.26 15.6 pt20 -70.83 -39.24 73.12 Favored 'General case' 0 N--CA 1.431 -1.42 0 O-C-N 119.696 -1.877 . . . . 1.0 115.859 175.405 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 4.2 pp -73.01 -34.58 66.46 Favored 'General case' 0 N--CA 1.431 -1.376 0 O-C-N 119.183 -2.198 . . . . 1.0 114.028 175.128 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -51.73 -52.05 51.48 Favored 'General case' 0 N--CA 1.43 -1.47 0 C-N-CA 126.257 1.823 . . . . 1.0 112.438 166.434 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 50.8 tp -58.69 -45.83 88.6 Favored 'General case' 0 N--CA 1.429 -1.5 0 C-N-CA 124.643 1.177 . . . . 1.0 113.65 175.088 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 75.3 m -57.0 -59.81 4.51 Favored 'General case' 0 N--CA 1.43 -1.435 0 C-N-CA 125.699 1.6 . . . . 1.0 113.063 175.858 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 84.4 mt -50.15 -45.43 23.7 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.449 0 C-N-CA 126.515 1.926 . . . . 1.0 114.765 172.218 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 10.7 mt-10 -55.57 -63.83 1.04 Allowed 'General case' 0 N--CA 1.43 -1.459 0 O-C-N 119.901 -1.749 . . . . 1.0 113.15 173.65 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 95.2 mt-10 -62.53 -46.55 87.9 Favored 'General case' 0 N--CA 1.43 -1.449 0 C-N-CA 124.998 1.319 . . . . 1.0 113.736 -175.448 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 3.3 tpt180 -73.9 -24.03 59.65 Favored 'General case' 0 N--CA 1.43 -1.447 0 N-CA-C 114.372 1.249 . . . . 1.0 114.372 -174.553 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -88.01 -48.25 7.9 Favored 'General case' 0 N--CA 1.43 -1.43 0 O-C-N 120.742 -1.224 . . . . 1.0 112.088 172.895 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 26.2 t70 -60.33 -50.31 74.14 Favored 'General case' 0 N--CA 1.431 -1.408 0 O-C-N 120.25 -1.531 . . . . 1.0 114.531 -179.244 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 15.5 t70 -93.68 106.99 18.92 Favored 'General case' 0 N--CA 1.429 -1.499 0 O-C-N 119.88 -1.762 . . . . 1.0 109.441 171.047 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 24' ' ' TRP . . . . . . . . . . . . . 14.4 t90 -146.47 175.48 10.53 Favored 'General case' 0 N--CA 1.43 -1.471 0 C-N-CA 126.019 1.728 . . . . 1.0 108.335 -179.165 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 61.0 m-20 -100.48 112.15 24.49 Favored 'General case' 0 N--CA 1.432 -1.351 0 O-C-N 120.356 -1.465 . . . . 1.0 108.502 173.335 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -173.71 167.81 40.49 Favored Glycine 0 N--CA 1.429 -1.797 0 C-N-CA 119.136 -1.506 . . . . 1.0 112.892 176.85 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 31.2 m-20 -88.92 -34.21 17.01 Favored 'General case' 0 N--CA 1.43 -1.475 0 C-N-CA 126.837 2.055 . . . . 1.0 110.607 177.593 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 58.5 p -75.79 147.43 39.22 Favored 'General case' 0 CA--C 1.488 -1.42 0 C-N-CA 124.776 1.23 . . . . 1.0 113.302 -178.717 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 3.3 t0 -90.5 170.58 10.08 Favored 'General case' 0 N--CA 1.431 -1.416 0 O-C-N 120.453 -1.404 . . . . 1.0 111.127 -175.555 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 6.9 mm -152.5 122.59 0.87 Allowed 'Isoleucine or valine' 0 N--CA 1.429 -1.485 0 C-N-CA 128.473 2.709 . . . . 1.0 105.623 -171.288 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 60.6 m-20 -111.39 101.72 10.16 Favored 'General case' 0 N--CA 1.429 -1.513 0 C-N-CA 124.146 0.978 . . . . 1.0 108.803 158.419 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 14.3 p -85.08 124.83 32.22 Favored 'General case' 0 N--CA 1.43 -1.463 0 O-C-N 120.57 -1.331 . . . . 1.0 111.666 173.213 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 36.0 mm-40 -99.4 139.4 35.11 Favored 'General case' 0 N--CA 1.43 -1.429 0 O-C-N 119.781 -1.824 . . . . 1.0 109.534 -174.688 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 4.0 mp -127.2 112.53 28.85 Favored 'Isoleucine or valine' 0 N--CA 1.432 -1.366 0 N-CA-C 105.7 -1.963 . . . . 1.0 105.7 174.437 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 48.5 m-80 -123.8 175.26 6.99 Favored 'General case' 0 N--CA 1.43 -1.455 0 C-N-CA 126.918 2.087 . . . . 1.0 108.244 173.104 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -68.07 86.87 0.18 Allowed Glycine 0 N--CA 1.429 -1.781 0 N-CA-C 116.455 1.342 . . . . 1.0 116.455 -170.615 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 85.86 16.6 63.1 Favored Glycine 0 N--CA 1.43 -1.758 0 C-N-CA 125.29 1.424 . . . . 1.0 112.584 -174.152 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 94.7 t -136.54 122.98 30.13 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.395 0 C-N-CA 124.549 1.139 . . . . 1.0 109.162 -169.828 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 98.9 mt -112.91 140.72 47.47 Favored 'General case' 0 N--CA 1.431 -1.386 0 O-C-N 120.411 -1.431 . . . . 1.0 109.064 168.822 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -134.45 121.06 20.54 Favored 'General case' 0 N--CA 1.43 -1.442 0 O-C-N 120.361 -1.462 . . . . 1.0 108.204 179.229 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 96.4 mt -97.02 115.26 36.14 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.483 0 N-CA-C 106.784 -1.561 . . . . 1.0 106.784 -177.882 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 2.9 m -124.77 122.71 38.2 Favored 'General case' 0 N--CA 1.43 -1.472 0 N-CA-C 108.698 -0.853 . . . . 1.0 108.698 -177.354 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 43' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -115.07 173.28 6.57 Favored 'General case' 0 N--CA 1.429 -1.522 0 C-N-CA 124.339 1.055 . . . . 1.0 110.611 179.882 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -68.89 -23.27 64.18 Favored 'General case' 0 N--CA 1.43 -1.471 0 N-CA-C 116.474 2.027 . . . . 1.0 116.474 -161.017 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 8.4 t-20 -66.85 -18.56 65.44 Favored 'General case' 0 N--CA 1.429 -1.484 0 C-N-CA 124.81 1.244 . . . . 1.0 112.925 169.07 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 99.71 5.06 55.59 Favored Glycine 0 N--CA 1.429 -1.768 0 O-C-N 120.603 -1.311 . . . . 1.0 113.49 172.776 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 1.3 t -89.9 171.83 9.31 Favored 'General case' 0 N--CA 1.431 -1.379 0 CA-C-N 118.277 1.038 . . . . 1.0 112.795 -177.293 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 73.7 tttt -138.17 129.38 27.41 Favored 'General case' 0 N--CA 1.43 -1.468 0 N-CA-C 113.816 1.043 . . . . 1.0 113.816 -157.301 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 1.4 mm -112.32 127.14 69.7 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.39 0 N-CA-C 105.242 -2.133 . . . . 1.0 105.242 161.528 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 50' ' ' ILE . . . . . 0.511 HG23 ' HB3' ' A' ' 63' ' ' ALA . 3.0 tp -123.07 117.89 53.08 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.464 0 CA-C-O 123.67 1.7 . . . . 1.0 109.311 -178.803 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 6.6 mt -121.13 131.64 72.52 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.472 0 C-N-CA 125.703 1.601 . . . . 1.0 109.976 -170.127 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 52' ' ' ASN . . . . . 0.495 ' H ' ' HD1' ' A' ' 61' ' ' TRP . 6.8 t-20 -162.91 163.8 26.17 Favored 'General case' 0 N--CA 1.43 -1.439 0 CA-C-O 124.049 1.881 . . . . 1.0 107.108 -170.993 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 2.6 ttp180 -156.81 117.37 3.62 Favored 'General case' 0 N--CA 1.43 -1.456 0 CA-C-N 114.204 -1.362 . . . . 1.0 109.337 -156.098 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 32.2 mm-40 -104.55 122.29 45.27 Favored 'General case' 0 N--CA 1.43 -1.473 0 C-N-CA 126.562 1.945 . . . . 1.0 106.876 -179.342 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 23.5 mt-10 -55.72 -39.77 79.79 Favored Pre-proline 0 N--CA 1.43 -1.473 0 N-CA-C 119.332 3.086 . . . . 1.0 119.332 -175.505 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 50.1 Cg_exo -67.44 114.01 3.11 Favored 'Trans proline' 0 N--CA 1.434 -1.997 0 CA-C-N 126.107 3.217 . . . . 1.0 113.051 172.752 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . 0.389 5.3 mp 76.89 132.84 0.05 Allowed 'General case' 0 N--CA 1.429 -1.499 0 C-N-CA 126.83 2.052 . . . . 1.0 114.376 -166.872 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 35.4 m170 -73.78 43.65 0.16 Allowed 'General case' 0 N--CA 1.43 -1.451 0 C-N-CA 127.191 2.196 . . . . 1.0 114.48 -175.29 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 85.5 mt-30 -116.98 134.57 54.58 Favored 'General case' 0 N--CA 1.43 -1.474 0 O-C-N 119.877 -1.765 . . . . 1.0 110.321 -172.618 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 59.3 t -105.83 156.26 6.67 Favored 'Isoleucine or valine' 0 N--CA 1.427 -1.591 0 N-CA-C 106.173 -1.788 . . . . 1.0 106.173 177.91 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 61' ' ' TRP . . . . . 0.495 ' HD1' ' H ' ' A' ' 52' ' ' ASN . 0.0 OUTLIER -104.29 144.55 31.47 Favored 'General case' 0 N--CA 1.431 -1.394 0 O-C-N 119.788 -1.82 . . . . 1.0 111.447 170.82 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 13.1 mt -112.86 95.34 5.36 Favored 'General case' 0 N--CA 1.431 -1.392 0 N-CA-C 104.578 -2.379 . . . . 1.0 104.578 163.873 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . 0.511 ' HB3' HG23 ' A' ' 50' ' ' ILE . . . -90.79 125.91 35.86 Favored 'General case' 0 N--CA 1.43 -1.444 0 CA-C-O 123.174 1.464 . . . . 1.0 109.224 169.655 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 64' ' ' THR . . . . . . . . . . . . . 9.4 t -152.55 -169.44 3.34 Favored 'General case' 0 N--CA 1.43 -1.453 0 N-CA-C 107.414 -1.328 . . . . 1.0 107.414 -154.9 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 2.3 tptm -56.25 -44.44 79.67 Favored 'General case' 0 N--CA 1.43 -1.466 0 N-CA-C 115.778 1.77 . . . . 1.0 115.778 -178.326 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 82.1 mt-30 -71.66 -24.14 61.79 Favored 'General case' 0 N--CA 1.431 -1.418 0 N-CA-C 115.229 1.566 . . . . 1.0 115.229 -177.313 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 147.25 -46.78 0.71 Allowed Glycine 0 N--CA 1.43 -1.708 0 O-C-N 120.595 -1.315 . . . . 1.0 113.299 175.213 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 125.88 116.77 2.11 Favored Glycine 0 N--CA 1.431 -1.686 0 N-CA-C 117.816 1.886 . . . . 1.0 117.816 178.755 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 20.1 m-30 -123.59 131.99 53.76 Favored 'General case' 0 N--CA 1.431 -1.398 0 C-N-CA 124.791 1.237 . . . . 1.0 109.219 -178.912 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 70' ' ' HIS . . . . . 0.445 ' HE1' ' OD2' ' A' ' 81' ' ' ASP . 17.6 p80 -88.7 158.18 18.29 Favored 'General case' 0 N--CA 1.429 -1.487 0 O-C-N 120.372 -1.455 . . . . 1.0 114.024 173.502 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 48.0 p90 -148.19 148.8 30.94 Favored 'General case' 0 N--CA 1.431 -1.406 0 N-CA-C 115.469 1.655 . . . . 1.0 115.469 -161.369 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 6.2 m-20 -116.46 175.23 5.66 Favored 'General case' 0 N--CA 1.431 -1.414 0 C-N-CA 127.349 2.26 . . . . 1.0 111.808 -172.648 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 50.2 tp -111.3 116.74 31.51 Favored 'General case' 0 N--CA 1.431 -1.416 0 C-N-CA 125.723 1.609 . . . . 1.0 112.039 -178.998 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -72.91 -42.35 63.62 Favored 'General case' 0 N--CA 1.429 -1.495 0 O-C-N 121.14 -0.975 . . . . 1.0 112.476 163.375 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . 166.63 -66.64 0.2 Allowed Glycine 0 N--CA 1.431 -1.694 0 O-C-N 121.035 -1.04 . . . . 1.0 111.815 178.003 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 18.0 p-10 -110.45 6.07 21.86 Favored 'General case' 0 N--CA 1.43 -1.458 0 C-N-CA 124.888 1.275 . . . . 1.0 111.716 -179.108 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 20.2 tt0 -151.72 132.58 14.15 Favored 'General case' 0 N--CA 1.43 -1.44 0 N-CA-C 103.921 -2.622 . . . . 1.0 103.921 -177.574 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 78' ' ' TRP . . . . . 0.445 ' HZ2' HD13 ' A' ' 9' ' ' LEU . 71.3 m95 -89.12 135.54 33.51 Favored 'General case' 0 N--CA 1.43 -1.441 0 N-CA-C 105.667 -1.975 . . . . 1.0 105.667 173.495 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -133.96 136.92 53.13 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.452 0 N-CA-C 104.992 -2.225 . . . . 1.0 104.992 -161.737 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 60.5 m -78.69 137.42 37.79 Favored 'General case' 0 N--CA 1.431 -1.384 0 O-C-N 120.089 -1.632 . . . . 1.0 111.957 -173.194 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 81' ' ' ASP . . . . . 0.445 ' OD2' ' HE1' ' A' ' 70' ' ' HIS . 23.8 t0 -72.78 -56.82 4.68 Favored 'General case' 0 N--CA 1.43 -1.428 0 CA-C-O 123.12 1.438 . . . . 1.0 109.548 177.311 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 1.9 tpt85 -72.73 128.59 36.0 Favored 'General case' 0 N--CA 1.43 -1.449 0 C-N-CA 125.535 1.534 . . . . 1.0 110.076 178.59 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 11.0 t 77.86 -63.2 0.34 Allowed 'General case' 0 N--CA 1.43 -1.471 0 C-N-CA 127.33 2.252 . . . . 1.0 112.916 -170.773 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 110.67 71.68 0.66 Allowed Glycine 0 N--CA 1.429 -1.779 0 C-N-CA 124.62 1.105 . . . . 1.0 110.813 -176.774 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 59.6 mt-10 -136.05 -146.36 0.24 Allowed 'General case' 0 N--CA 1.43 -1.441 0 C-N-CA 125.023 1.329 . . . . 1.0 109.444 -170.246 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 88.7 m -143.32 134.8 26.22 Favored 'General case' 0 N--CA 1.43 -1.464 0 O-C-N 120.427 -1.42 . . . . 1.0 109.998 -156.789 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 31.1 t80 -61.03 -76.85 0.05 OUTLIER 'General case' 0 N--CA 1.43 -1.444 0 N-CA-C 117.353 2.353 . . . . 1.0 117.353 -177.535 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 88' ' ' TRP . . . . . . . . . . . . . 55.0 m95 -60.77 -31.88 71.21 Favored 'General case' 0 N--CA 1.431 -1.425 0 O-C-N 120.032 -1.668 . . . . 1.0 114.727 -169.674 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 6.1 t70 -78.14 -36.2 48.04 Favored 'General case' 0 N--CA 1.43 -1.441 0 C-N-CA 125.83 1.652 . . . . 1.0 113.16 177.721 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 50.5 tp -70.63 -41.39 72.26 Favored 'General case' 0 N--CA 1.431 -1.409 0 O-C-N 118.679 -2.513 . . . . 1.0 110.989 175.591 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 31.6 tp -55.46 -37.8 68.23 Favored 'General case' 0 N--CA 1.431 -1.383 0 C-N-CA 126.554 1.942 . . . . 1.0 114.074 169.614 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 35.0 tt0 -60.66 -54.23 47.84 Favored 'General case' 0 N--CA 1.43 -1.434 0 C-N-CA 125.454 1.502 . . . . 1.0 113.028 169.804 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 10.9 tm0? -51.71 -53.81 35.22 Favored 'General case' 0 N--CA 1.43 -1.438 0 C-N-CA 125.995 1.718 . . . . 1.0 114.268 175.133 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -52.21 -55.56 20.36 Favored 'General case' 0 N--CA 1.431 -1.408 0 C-N-CA 127.721 2.408 . . . . 1.0 113.954 176.053 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -61.58 -44.9 96.16 Favored 'General case' 0 N--CA 1.429 -1.49 0 N-CA-C 114.528 1.307 . . . . 1.0 114.528 177.066 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 93.4 m -64.71 -21.21 66.69 Favored 'General case' 0 N--CA 1.429 -1.478 0 O-C-N 119.634 -1.916 . . . . 1.0 113.779 175.324 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 7.5 tp60 -74.45 -65.13 0.89 Allowed 'General case' 0 N--CA 1.429 -1.496 0 O-C-N 120.345 -1.472 . . . . 1.0 110.927 171.749 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 13.3 pt20 -77.38 -28.37 52.81 Favored 'General case' 0 N--CA 1.429 -1.486 0 N-CA-C 115.478 1.658 . . . . 1.0 115.478 -170.963 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -85.6 -46.2 11.02 Favored 'General case' 0 N--CA 1.43 -1.447 0 O-C-N 120.667 -1.271 . . . . 1.0 112.866 171.602 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . 95.61 32.46 6.91 Favored Glycine 0 N--CA 1.43 -1.742 0 O-C-N 120.878 -1.139 . . . . 1.0 114.655 -178.848 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 14.1 pt-20 -158.37 163.1 37.6 Favored 'General case' 0 N--CA 1.43 -1.433 0 O-C-N 120.955 -1.321 . . . . 1.0 108.987 179.57 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 92.6 m -77.9 85.38 4.16 Favored 'General case' 0 N--CA 1.429 -1.502 0 O-C-N 119.862 -1.774 . . . . 1.0 112.58 -178.937 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 47.8 t -85.12 100.38 8.27 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.42 0 C-N-CA 126.914 2.085 . . . . 1.0 106.617 168.378 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 34.9 t -143.09 154.72 44.23 Favored 'General case' 0 N--CA 1.431 -1.415 0 C-N-CA 125.261 1.424 . . . . 1.0 107.93 -174.78 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -110.98 -16.77 13.44 Favored 'General case' 0 N--CA 1.43 -1.456 0 O-C-N 120.437 -1.415 . . . . 1.0 112.217 176.262 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 16.1 mtp180 . . . . . 0 C--O 1.259 1.574 0 N-CA-C 115.519 1.674 . . . . 1.0 115.519 -167.16 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 18.8 m120 . . . . . 0 N--CA 1.43 -1.46 0 N-CA-C 114.02 1.119 . . . . 1.0 114.02 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -57.3 -47.61 81.04 Favored 'General case' 0 CA--C 1.49 -1.361 0 C-N-CA 127.493 2.317 . . . . 1.0 113.197 -173.235 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 10.5 m -60.07 -42.5 94.67 Favored 'General case' 0 N--CA 1.43 -1.43 0 C-N-CA 125.743 1.617 . . . . 1.0 113.567 177.106 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 9.0 tp10 -70.6 -46.47 63.35 Favored 'General case' 0 N--CA 1.43 -1.426 0 C-N-CA 125.083 1.353 . . . . 1.0 111.729 -178.732 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 4.4 t80 -50.36 -54.69 19.83 Favored 'General case' 0 N--CA 1.429 -1.5 0 C-N-CA 125.802 1.641 . . . . 1.0 114.63 166.572 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 30.4 m170 -59.47 -45.16 92.42 Favored 'General case' 0 N--CA 1.43 -1.454 0 N-CA-C 115.475 1.657 . . . . 1.0 115.475 178.434 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 73.4 mtp85 -56.52 -56.27 23.34 Favored 'General case' 0 N--CA 1.43 -1.433 0 N-CA-C 113.338 0.866 . . . . 1.0 113.338 173.282 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 82.7 mt -66.23 -40.59 90.37 Favored 'General case' 0 N--CA 1.43 -1.441 0 N-CA-C 114.676 1.361 . . . . 1.0 114.676 -179.161 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -62.79 -48.5 78.87 Favored 'General case' 0 N--CA 1.43 -1.468 0 C-N-CA 124.905 1.282 . . . . 1.0 113.383 178.509 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 58.7 m-20 -66.22 -36.33 82.77 Favored 'General case' 0 N--CA 1.429 -1.485 0 O-C-N 120.829 -1.17 . . . . 1.0 113.071 175.812 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 29.1 mm100 -61.65 -46.73 88.52 Favored 'General case' 0 N--CA 1.43 -1.461 0 O-C-N 120.116 -1.615 . . . . 1.0 114.845 170.398 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 1.2 pp -70.05 -37.18 75.48 Favored 'General case' 0 N--CA 1.43 -1.451 0 O-C-N 119.942 -1.724 . . . . 1.0 114.503 -179.688 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 0.1 OUTLIER -43.82 -62.09 1.22 Allowed 'General case' 0 N--CA 1.43 -1.459 0 C-N-CA 127.786 2.434 . . . . 1.0 112.411 163.348 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 44.7 tp -60.06 -47.85 84.15 Favored 'General case' 0 N--CA 1.43 -1.44 0 C-N-CA 124.738 1.215 . . . . 1.0 113.499 177.88 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 32.6 m -57.33 -50.83 71.71 Favored 'General case' 0 N--CA 1.43 -1.474 0 C-N-CA 125.743 1.617 . . . . 1.0 113.686 179.482 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 95.9 mt -65.32 -45.45 93.37 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.465 0 O-C-N 120.353 -1.467 . . . . 1.0 111.554 179.718 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -57.65 -55.05 39.89 Favored 'General case' 0 N--CA 1.428 -1.532 0 O-C-N 121.774 -0.579 . . . . 1.0 112.542 176.26 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 5.5 tm-20 -58.21 -49.7 76.14 Favored 'General case' 0 N--CA 1.43 -1.467 0 C-N-CA 126.103 1.761 . . . . 1.0 114.591 178.008 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.28 -38.54 77.19 Favored 'General case' 0 N--CA 1.43 -1.471 0 C-N-CA 124.72 1.208 . . . . 1.0 113.912 -179.388 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . 0.44 HD23 HG21 ' A' ' 41' ' ' ILE . 2.7 tp -86.08 -38.32 17.92 Favored 'General case' 0 N--CA 1.429 -1.495 0 N-CA-C 113.877 1.065 . . . . 1.0 113.877 177.914 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 37.3 t70 -61.23 -26.41 67.72 Favored 'General case' 0 N--CA 1.43 -1.469 0 O-C-N 119.281 -2.137 . . . . 1.0 113.969 173.709 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 29.8 t70 -59.85 -35.51 74.93 Favored 'General case' 0 N--CA 1.429 -1.478 0 C-N-CA 126.247 1.819 . . . . 1.0 114.506 171.02 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 24' ' ' TRP . . . . . . . . . . . . . 48.7 t90 -83.93 138.78 32.98 Favored 'General case' 0 N--CA 1.43 -1.46 0 CA-C-O 122.062 0.934 . . . . 1.0 113.124 -167.349 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 24.0 t70 -133.64 131.46 39.59 Favored 'General case' 0 N--CA 1.431 -1.393 0 O-C-N 121.236 -0.915 . . . . 1.0 109.298 -179.661 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -125.88 -141.35 5.52 Favored Glycine 0 N--CA 1.43 -1.74 0 N-CA-C 109.843 -1.303 . . . . 1.0 109.843 177.272 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -89.07 -26.83 21.18 Favored 'General case' 0 N--CA 1.43 -1.438 0 O-C-N 120.825 -1.397 . . . . 1.0 109.134 165.632 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 88.1 p -82.12 163.98 21.63 Favored 'General case' 0 N--CA 1.431 -1.4 0 O-C-N 120.375 -1.453 . . . . 1.0 111.935 165.448 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 9.4 t70 -117.48 175.48 5.61 Favored 'General case' 0 N--CA 1.43 -1.448 0 N-CA-C 107.442 -1.318 . . . . 1.0 107.442 177.653 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 9.1 tp -159.08 114.24 0.15 Allowed 'Isoleucine or valine' 0 N--CA 1.429 -1.499 0 CA-C-O 123.81 1.767 . . . . 1.0 109.502 -159.884 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 25.1 t0 -131.21 102.47 6.01 Favored 'General case' 0 N--CA 1.43 -1.44 0 C-N-CA 125.501 1.52 . . . . 1.0 110.247 -168.079 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 28.2 t -85.57 135.22 33.9 Favored 'General case' 0 N--CA 1.429 -1.509 0 O-C-N 118.899 -2.376 . . . . 1.0 111.976 176.631 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 38.5 mt-10 -85.11 139.59 31.6 Favored 'General case' 0 N--CA 1.43 -1.44 0 O-C-N 120.953 -1.092 . . . . 1.0 110.856 171.538 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 7.9 mm -111.85 105.39 18.7 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.419 0 N-CA-C 104.927 -2.249 . . . . 1.0 104.927 166.859 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 8.0 t30 -122.95 68.25 0.98 Allowed 'General case' 0 N--CA 1.431 -1.413 0 C-N-CA 125.696 1.599 . . . . 1.0 108.208 -176.58 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . 66.61 -88.48 0.13 Allowed Glycine 0 N--CA 1.429 -1.771 0 O-C-N 120.524 -1.36 . . . . 1.0 115.986 176.584 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -113.88 4.57 24.18 Favored Glycine 0 N--CA 1.43 -1.708 0 C-N-CA 124.866 1.222 . . . . 1.0 112.955 177.953 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 40.3 t -117.54 131.17 71.04 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.483 0 C-N-CA 124.786 1.234 . . . . 1.0 107.679 176.919 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 40.1 mt -110.82 131.05 55.38 Favored 'General case' 0 N--CA 1.429 -1.478 0 O-C-N 120.702 -1.249 . . . . 1.0 108.14 166.771 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -130.6 111.69 12.46 Favored 'General case' 0 N--CA 1.431 -1.423 0 CA-C-O 123.119 1.438 . . . . 1.0 108.003 -174.245 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 41' ' ' ILE . . . . . 0.44 HG21 HD23 ' A' ' 21' ' ' LEU . 69.9 mt -89.66 114.83 28.2 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.421 0 O-C-N 120.762 -1.211 . . . . 1.0 108.023 -170.153 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 6.4 m -111.99 128.87 56.3 Favored 'General case' 0 N--CA 1.43 -1.451 0 CA-C-O 121.694 0.759 . . . . 1.0 111.295 -170.631 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 43' ' ' PHE . . . . . . . . . . . . . 2.7 m-85 -114.74 149.42 36.89 Favored 'General case' 0 N--CA 1.43 -1.445 0 O-C-N 120.437 -1.414 . . . . 1.0 107.731 -175.408 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 4.5 mt-10 -65.8 -17.01 64.34 Favored 'General case' 0 N--CA 1.43 -1.458 0 N-CA-C 116.304 1.965 . . . . 1.0 116.304 176.248 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 3.6 m-20 -64.7 -17.76 64.39 Favored 'General case' 0 N--CA 1.429 -1.478 0 O-C-N 120.66 -1.275 . . . . 1.0 113.538 172.771 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 104.45 -4.46 43.75 Favored Glycine 0 N--CA 1.429 -1.792 0 O-C-N 120.996 -1.065 . . . . 1.0 111.092 -177.861 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 69.0 m -73.92 164.57 26.47 Favored 'General case' 0 N--CA 1.43 -1.442 0 C-N-CA 129.115 2.966 . . . . 1.0 113.458 -179.865 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 81.8 tttt -168.48 132.25 1.54 Allowed 'General case' 0 N--CA 1.43 -1.466 0 O-C-N 120.778 -1.201 . . . . 1.0 114.088 -167.799 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 5.5 mm -112.98 144.4 20.71 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.471 0 C-N-CA 125.082 1.353 . . . . 1.0 108.401 174.417 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 50' ' ' ILE . . . . . 0.431 ' HB ' ' HB3' ' A' ' 63' ' ' ALA . 3.6 mm -120.0 119.39 60.0 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.483 0 C-N-CA 125.494 1.517 . . . . 1.0 109.942 -178.979 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 3.7 mt -126.99 125.6 66.84 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.474 0 O-C-N 120.304 -1.498 . . . . 1.0 111.357 -178.894 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 52' ' ' ASN . . . . . 0.409 ' H ' ' HD1' ' A' ' 61' ' ' TRP . 45.7 t-20 -160.56 166.39 29.12 Favored 'General case' 0 N--CA 1.429 -1.477 0 C-N-CA 126.759 2.024 . . . . 1.0 105.833 -177.206 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 11.1 ptm180 -133.61 145.09 49.71 Favored 'General case' 0 N--CA 1.43 -1.442 0 C-N-CA 125.513 1.525 . . . . 1.0 110.996 -162.49 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 6.2 mm-40 -128.45 -72.61 0.61 Allowed 'General case' 0 N--CA 1.429 -1.476 0 O-C-N 120.728 -1.232 . . . . 1.0 112.623 -175.052 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 54.1 mm-40 -74.12 121.64 85.68 Favored Pre-proline 0 N--CA 1.429 -1.488 0 CA-C-O 117.329 -1.32 . . . . 1.0 112.765 -165.809 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 38.4 Cg_endo -81.13 36.55 0.63 Allowed 'Trans proline' 0 C--N 1.3 -1.998 0 C-N-CA 123.877 3.051 . . . . 1.0 112.918 -174.006 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 57' ' ' LEU . . . . . 0.424 ' O ' ' HD2' ' A' ' 58' ' ' HIS . 55.4 mt -109.79 -100.42 0.39 Allowed 'General case' 0 N--CA 1.431 -1.413 0 N-CA-C 104.354 -2.462 . . . . 1.0 104.354 171.754 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 58' ' ' HIS . . . . . 0.424 ' HD2' ' O ' ' A' ' 57' ' ' LEU . 56.1 m170 -137.52 79.0 1.72 Allowed 'General case' 0 N--CA 1.43 -1.427 0 C-N-CA 125.57 1.548 . . . . 1.0 111.182 170.22 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 17.9 tt0 -155.5 132.75 10.89 Favored 'General case' 0 N--CA 1.43 -1.451 0 CA-C-N 121.84 2.109 . . . . 1.0 113.155 173.24 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 85.0 t -135.82 164.15 33.03 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.454 0 N-CA-C 107.339 -1.356 . . . . 1.0 107.339 179.933 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 61' ' ' TRP . . . . . 0.409 ' HD1' ' H ' ' A' ' 52' ' ' ASN . 0.1 OUTLIER -105.59 153.97 21.05 Favored 'General case' 0 N--CA 1.43 -1.441 0 O-C-N 119.971 -1.706 . . . . 1.0 114.127 178.298 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 68.9 mt -123.19 97.39 5.4 Favored 'General case' 0 N--CA 1.43 -1.446 0 N-CA-C 107.229 -1.397 . . . . 1.0 107.229 162.605 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . 0.431 ' HB3' ' HB ' ' A' ' 50' ' ' ILE . . . -98.24 139.11 34.52 Favored 'General case' 0 N--CA 1.431 -1.417 0 O-C-N 120.811 -1.18 . . . . 1.0 108.744 172.959 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 64' ' ' THR . . . . . . . . . . . . . 6.6 t -152.68 -158.52 0.9 Allowed 'General case' 0 N--CA 1.431 -1.405 0 O-C-N 120.595 -1.316 . . . . 1.0 111.39 -158.794 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 41.3 tptt -57.2 -62.85 1.47 Allowed 'General case' 0 N--CA 1.43 -1.473 0 C-N-CA 127.391 2.276 . . . . 1.0 114.373 178.762 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 31.3 tt0 -76.63 -23.56 53.35 Favored 'General case' 0 N--CA 1.429 -1.51 0 CA-C-O 122.489 1.138 . . . . 1.0 112.933 -171.605 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 155.73 -67.16 0.3 Allowed Glycine 0 N--CA 1.43 -1.704 0 N-CA-C 108.014 -2.034 . . . . 1.0 108.014 -178.398 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 85.92 170.92 47.55 Favored Glycine 0 N--CA 1.43 -1.712 0 C-N-CA 124.245 0.926 . . . . 1.0 114.971 -177.689 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -155.95 164.89 37.91 Favored 'General case' 0 N--CA 1.429 -1.509 0 C-N-CA 123.732 0.813 . . . . 1.0 110.7 -166.375 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 28.2 p80 -82.77 157.76 23.1 Favored 'General case' 0 N--CA 1.431 -1.422 0 N-CA-C 114.952 1.464 . . . . 1.0 114.952 177.518 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 42.6 p90 -121.02 134.42 55.29 Favored 'General case' 0 N--CA 1.431 -1.423 0 CA-C-N 114.835 -1.075 . . . . 1.0 113.55 -175.076 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -131.4 147.33 52.55 Favored 'General case' 0 N--CA 1.43 -1.451 0 C-N-CA 125.207 1.403 . . . . 1.0 108.203 -177.604 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 1.5 tt -85.76 114.0 22.37 Favored 'General case' 0 N--CA 1.43 -1.461 0 O-C-N 119.695 -1.878 . . . . 1.0 112.0 -169.468 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 32.3 mmtp -115.51 72.5 0.8 Allowed 'General case' 0 N--CA 1.43 -1.472 0 O-C-N 120.639 -1.288 . . . . 1.0 111.705 177.944 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . 97.84 -100.27 2.35 Favored Glycine 0 N--CA 1.43 -1.735 0 O-C-N 120.198 -1.564 . . . . 1.0 112.716 175.631 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 34.2 m-20 -115.74 11.09 15.59 Favored 'General case' 0 N--CA 1.431 -1.399 0 C-N-CA 124.436 1.094 . . . . 1.0 111.731 179.908 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 5.3 tp10 -151.44 146.32 25.86 Favored 'General case' 0 N--CA 1.43 -1.467 0 N-CA-C 105.418 -2.068 . . . . 1.0 105.418 -179.957 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 78' ' ' TRP . . . . . 0.449 ' HB2' ' HB2' ' A' ' 87' ' ' PHE . 23.7 m95 -90.25 125.63 35.56 Favored 'General case' 0 N--CA 1.429 -1.499 0 N-CA-C 107.159 -1.423 . . . . 1.0 107.159 176.266 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 2.4 mt -89.44 137.98 20.23 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.469 0 C-N-CA 127.191 2.196 . . . . 1.0 109.396 178.272 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 20.8 m -82.05 141.6 33.05 Favored 'General case' 0 N--CA 1.431 -1.425 0 N-CA-C 108.073 -1.084 . . . . 1.0 108.073 175.655 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 24.7 t70 -78.39 -1.54 33.94 Favored 'General case' 0 N--CA 1.43 -1.426 0 CA-C-N 120.201 1.364 . . . . 1.0 114.555 -175.834 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 2.0 ptt180 -82.29 176.79 9.17 Favored 'General case' 0 N--CA 1.43 -1.446 0 O-C-N 119.171 -2.206 . . . . 1.0 112.312 170.56 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 52.5 m -76.09 65.01 2.03 Favored 'General case' 0 N--CA 1.431 -1.375 0 O-C-N 119.899 -1.751 . . . . 1.0 113.051 170.878 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 170.44 103.14 0.16 Allowed Glycine 0 N--CA 1.43 -1.717 0 N-CA-C 105.577 -3.009 . . . . 1.0 105.577 170.486 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 3.2 pt-20 -116.44 82.08 1.73 Allowed 'General case' 0 N--CA 1.43 -1.444 0 N-CA-C 114.521 1.304 . . . . 1.0 114.521 -146.324 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -162.41 129.41 3.7 Favored 'General case' 0 N--CA 1.431 -1.399 0 N-CA-C 115.545 1.683 . . . . 1.0 115.545 -173.329 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 87' ' ' PHE . . . . . 0.449 ' HB2' ' HB2' ' A' ' 78' ' ' TRP . 4.4 t80 -63.63 -89.24 0.01 OUTLIER 'General case' 0 N--CA 1.43 -1.463 0 N-CA-C 116.432 2.012 . . . . 1.0 116.432 173.048 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 88' ' ' TRP . . . . . . . . . . . . . 68.5 m95 -62.1 -27.31 68.83 Favored 'General case' 0 N--CA 1.429 -1.476 0 C-N-CA 125.313 1.445 . . . . 1.0 113.217 -173.022 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . 0.276 0.6 OUTLIER -78.1 -39.41 41.5 Favored 'General case' 0 N--CA 1.429 -1.479 0 C-N-CA 126.291 1.836 . . . . 1.0 112.916 178.683 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 26.5 tp -72.08 -37.66 69.56 Favored 'General case' 0 N--CA 1.43 -1.436 0 O-C-N 118.419 -2.676 . . . . 1.0 111.784 171.15 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 18.5 tp -54.37 -40.33 68.03 Favored 'General case' 0 N--CA 1.43 -1.435 0 C-N-CA 125.43 1.492 . . . . 1.0 114.144 170.325 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 31.4 tt0 -55.71 -56.23 22.87 Favored 'General case' 0 N--CA 1.431 -1.385 0 C-N-CA 124.535 1.134 . . . . 1.0 112.88 165.908 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 60.7 mt-30 -61.25 -39.38 90.12 Favored 'General case' 0 N--CA 1.43 -1.428 0 N-CA-C 115.14 1.533 . . . . 1.0 115.14 -177.736 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -62.51 -46.7 87.21 Favored 'General case' 0 N--CA 1.43 -1.469 0 O-C-N 119.402 -2.061 . . . . 1.0 112.91 170.622 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -67.59 -36.57 81.14 Favored 'General case' 0 N--CA 1.429 -1.501 0 O-C-N 119.566 -1.959 . . . . 1.0 114.263 176.678 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -57.72 -38.67 75.68 Favored 'General case' 0 N--CA 1.43 -1.448 0 C-N-CA 127.033 2.133 . . . . 1.0 112.474 173.617 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 8.2 pt20 -78.15 -37.11 46.74 Favored 'General case' 0 N--CA 1.431 -1.41 0 O-C-N 121.097 -1.002 . . . . 1.0 113.455 174.963 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 6.9 mm-40 -72.69 -41.91 64.8 Favored 'General case' 0 N--CA 1.43 -1.467 0 N-CA-C 115.308 1.596 . . . . 1.0 115.308 -177.486 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -84.91 -39.15 18.55 Favored 'General case' 0 N--CA 1.429 -1.494 0 C-N-CA 124.804 1.242 . . . . 1.0 112.136 174.255 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . 105.61 12.56 26.24 Favored Glycine 0 N--CA 1.43 -1.715 0 O-C-N 121.004 -1.06 . . . . 1.0 114.256 176.105 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 8.4 pt-20 -165.2 163.44 20.25 Favored 'General case' 0 N--CA 1.43 -1.435 0 N-CA-C 105.439 -2.059 . . . . 1.0 105.439 -175.486 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 94.9 m -67.47 114.06 5.83 Favored 'General case' 0 N--CA 1.43 -1.472 0 CA-C-N 120.286 1.403 . . . . 1.0 113.717 -172.09 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 76.1 t -95.6 122.61 47.23 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.448 0 C-N-CA 126.899 2.08 . . . . 1.0 106.325 171.694 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 59.5 m -103.16 102.63 12.63 Favored 'General case' 0 N--CA 1.43 -1.461 0 C-N-CA 124.556 1.142 . . . . 1.0 112.66 -162.363 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 45.7 m-85 -95.57 -36.67 11.18 Favored 'General case' 0 N--CA 1.43 -1.45 0 O-C-N 120.317 -1.489 . . . . 1.0 111.825 177.363 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 11.7 mmt85 . . . . . 0 C--O 1.26 1.658 0 C-N-CA 124.174 0.99 . . . . 1.0 110.778 -179.42 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 19.6 m120 . . . . . 0 N--CA 1.43 -1.45 0 N-CA-C 109.235 -0.654 . . . . 1.0 109.235 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 25.7 t70 -56.84 -50.35 72.68 Favored 'General case' 0 N--CA 1.43 -1.47 0 C-N-CA 128.239 2.616 . . . . 1.0 112.321 178.947 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 41.9 t -44.7 -50.23 10.07 Favored 'General case' 0 N--CA 1.429 -1.488 0 C-N-CA 128.253 2.621 . . . . 1.0 114.181 170.086 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 14.5 tt0 -74.04 -51.41 15.9 Favored 'General case' 0 N--CA 1.43 -1.457 0 C-N-CA 125.33 1.452 . . . . 1.0 113.024 -177.0 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 11.1 t80 -49.95 -43.51 50.07 Favored 'General case' 0 N--CA 1.431 -1.409 0 N-CA-C 115.753 1.76 . . . . 1.0 115.753 170.698 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 35.2 m170 -69.9 -33.65 72.47 Favored 'General case' 0 N--CA 1.43 -1.425 0 N-CA-C 114.664 1.357 . . . . 1.0 114.664 175.458 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -66.0 -46.39 78.14 Favored 'General case' 0 N--CA 1.43 -1.458 0 O-C-N 120.731 -1.23 . . . . 1.0 112.96 169.742 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 97.7 mt -60.3 -34.73 74.18 Favored 'General case' 0 N--CA 1.43 -1.438 0 O-C-N 120.57 -1.331 . . . . 1.0 113.745 173.647 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -59.05 -46.69 87.62 Favored 'General case' 0 N--CA 1.43 -1.473 0 C-N-CA 125.692 1.597 . . . . 1.0 113.245 170.307 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -58.28 -41.49 84.46 Favored 'General case' 0 N--CA 1.429 -1.482 0 C-N-CA 124.658 1.183 . . . . 1.0 113.11 172.359 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 55.1 mt-30 -58.13 -58.43 8.47 Favored 'General case' 0 N--CA 1.431 -1.42 0 N-CA-C 115.166 1.543 . . . . 1.0 115.166 172.092 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 3.7 pp -66.36 -40.15 89.58 Favored 'General case' 0 N--CA 1.43 -1.433 0 O-C-N 120.15 -1.594 . . . . 1.0 114.996 -176.483 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 33.7 m0 -64.6 -44.19 91.42 Favored 'General case' 0 N--CA 1.429 -1.487 0 C-N-CA 124.814 1.246 . . . . 1.0 112.948 174.548 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 63.0 tp -58.6 -54.77 43.29 Favored 'General case' 0 N--CA 1.431 -1.417 0 O-C-N 120.564 -1.335 . . . . 1.0 112.506 171.533 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 29.4 m -57.42 -53.39 58.66 Favored 'General case' 0 N--CA 1.43 -1.451 0 C-N-CA 125.492 1.517 . . . . 1.0 113.228 -174.381 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 14.4 mt -68.22 -44.24 84.2 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.44 0 O-C-N 120.499 -1.376 . . . . 1.0 113.846 178.826 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 32.3 tt0 -60.86 -47.57 85.78 Favored 'General case' 0 N--CA 1.431 -1.399 0 CA-C-N 120.641 1.564 . . . . 1.0 112.883 179.09 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 34.0 tt0 -58.75 -55.0 40.69 Favored 'General case' 0 N--CA 1.43 -1.438 0 C-N-CA 125.109 1.364 . . . . 1.0 113.551 174.381 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 16.3 tpt180 -58.39 -44.06 88.81 Favored 'General case' 0 N--CA 1.43 -1.462 0 C-N-CA 124.798 1.239 . . . . 1.0 114.11 -176.084 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 84.8 mt -74.83 -43.38 54.88 Favored 'General case' 0 N--CA 1.43 -1.436 0 O-C-N 121.0 -1.062 . . . . 1.0 113.845 179.013 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 21.1 t70 -64.09 -35.14 79.77 Favored 'General case' 0 CA--C 1.488 -1.434 0 O-C-N 120.527 -1.358 . . . . 1.0 114.433 176.092 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 29.4 t70 -71.8 -43.36 65.78 Favored 'General case' 0 N--CA 1.431 -1.404 0 O-C-N 120.33 -1.481 . . . . 1.0 113.84 179.715 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 24' ' ' TRP . . . . . . . . . . . . . 68.8 t-105 -78.71 154.45 30.07 Favored 'General case' 0 N--CA 1.43 -1.474 0 CA-C-O 122.342 1.068 . . . . 1.0 113.523 -173.304 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 52.5 m-20 -96.93 -153.76 0.43 Allowed 'General case' 0 N--CA 1.431 -1.419 0 O-C-N 120.384 -1.447 . . . . 1.0 111.381 -176.165 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 153.16 -173.68 31.99 Favored Glycine 0 N--CA 1.431 -1.639 0 N-CA-C 109.003 -1.639 . . . . 1.0 109.003 -178.275 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 6.6 t70 -78.06 -44.64 25.77 Favored 'General case' 0 N--CA 1.432 -1.351 0 O-C-N 121.418 -1.048 . . . . 1.0 108.322 170.326 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 21.9 t -68.31 156.4 37.79 Favored 'General case' 0 N--CA 1.43 -1.469 0 C-N-CA 125.912 1.685 . . . . 1.0 113.743 172.661 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 4.6 t70 -86.52 175.45 8.34 Favored 'General case' 0 N--CA 1.429 -1.475 0 C-N-CA 125.833 1.653 . . . . 1.0 107.735 164.471 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -162.89 119.63 0.16 Allowed 'Isoleucine or valine' 0 N--CA 1.43 -1.436 0 O-C-N 120.223 -1.548 . . . . 1.0 107.508 -172.051 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 26.3 t70 -131.93 111.26 11.41 Favored 'General case' 0 N--CA 1.43 -1.458 0 O-C-N 120.189 -1.569 . . . . 1.0 108.743 174.258 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 96.3 m -90.25 134.93 33.99 Favored 'General case' 0 N--CA 1.431 -1.385 0 O-C-N 119.231 -2.168 . . . . 1.0 109.857 174.399 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 37.0 mt-10 -101.97 132.78 47.59 Favored 'General case' 0 N--CA 1.431 -1.419 0 C-N-CA 125.012 1.325 . . . . 1.0 109.157 -178.605 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 3.6 tp -112.48 113.59 44.57 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.449 0 CA-C-O 123.792 1.758 . . . . 1.0 106.379 175.756 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -136.42 99.08 3.99 Favored 'General case' 0 N--CA 1.43 -1.45 0 CA-C-N 114.578 -1.192 . . . . 1.0 111.219 -177.849 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . 71.77 26.24 73.25 Favored Glycine 0 N--CA 1.429 -1.774 0 O-C-N 120.251 -1.531 . . . . 1.0 116.34 164.395 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 86.95 20.71 52.76 Favored Glycine 0 N--CA 1.43 -1.752 0 C-N-CA 123.798 0.713 . . . . 1.0 112.889 -173.785 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 84.9 t -125.08 131.48 72.45 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.394 0 N-CA-C 105.815 -1.921 . . . . 1.0 105.815 173.068 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 42.5 mt -102.6 132.25 48.82 Favored 'General case' 0 N--CA 1.431 -1.398 0 CA-C-O 122.56 1.172 . . . . 1.0 109.615 165.785 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 40' ' ' THR . . . . . 0.402 HG23 HD13 ' A' ' 50' ' ' ILE . 0.1 OUTLIER -118.13 124.62 48.45 Favored 'General case' 0 N--CA 1.43 -1.427 0 N-CA-C 106.724 -1.584 . . . . 1.0 106.724 171.392 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 69.7 mt -101.42 121.57 52.48 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.475 0 N-CA-C 108.406 -0.961 . . . . 1.0 108.406 -173.626 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 20.2 p -123.72 118.51 27.38 Favored 'General case' 0 N--CA 1.431 -1.397 0 N-CA-C 113.942 1.09 . . . . 1.0 113.942 -173.439 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 43' ' ' PHE . . . . . . . . . . . . . 3.0 p90 -123.32 169.82 10.93 Favored 'General case' 0 N--CA 1.43 -1.44 0 C-N-CA 126.015 1.726 . . . . 1.0 114.088 174.674 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 7.5 mm-40 -53.34 -32.71 50.42 Favored 'General case' 0 N--CA 1.43 -1.441 0 N-CA-C 118.129 2.64 . . . . 1.0 118.129 -174.44 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -66.78 -12.99 60.89 Favored 'General case' 0 N--CA 1.43 -1.449 0 O-C-N 120.478 -1.389 . . . . 1.0 113.527 -179.715 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 100.96 -14.37 58.68 Favored Glycine 0 N--CA 1.43 -1.755 0 O-C-N 120.791 -1.193 . . . . 1.0 113.425 166.008 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 4.3 m -77.09 168.75 19.55 Favored 'General case' 0 N--CA 1.43 -1.451 0 C-N-CA 124.615 1.166 . . . . 1.0 111.661 176.918 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 93.1 mttt -142.91 135.48 27.64 Favored 'General case' 0 N--CA 1.43 -1.451 0 O-C-N 121.03 -1.044 . . . . 1.0 111.154 -172.266 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 49' ' ' ILE . . . . . 0.633 HD12 HG23 ' A' ' 64' ' ' THR . 4.2 mm -101.36 137.31 29.46 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.414 0 N-CA-C 105.922 -1.881 . . . . 1.0 105.922 175.671 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 50' ' ' ILE . . . . . 0.553 HG23 ' HB3' ' A' ' 63' ' ' ALA . 2.5 tp -128.06 124.83 63.44 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.469 0 CA-C-O 123.078 1.418 . . . . 1.0 109.687 -176.778 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 2.3 mt -127.45 118.03 48.47 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.496 0 C-N-CA 126.316 1.846 . . . . 1.0 111.906 -172.858 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 52' ' ' ASN . . . . . 0.417 ' H ' ' HD1' ' A' ' 61' ' ' TRP . 48.6 t30 -157.75 171.42 20.34 Favored 'General case' 0 N--CA 1.431 -1.418 0 C-N-CA 127.022 2.129 . . . . 1.0 107.792 -176.305 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -136.74 161.17 36.68 Favored 'General case' 0 N--CA 1.43 -1.474 0 C-N-CA 125.722 1.609 . . . . 1.0 114.547 -167.668 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 13.3 mm100 -108.09 129.03 55.17 Favored 'General case' 0 N--CA 1.429 -1.493 0 C-N-CA 125.998 1.719 . . . . 1.0 106.59 169.572 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 47.1 tt0 -60.69 -38.21 53.96 Favored Pre-proline 0 N--CA 1.428 -1.536 0 CA-C-O 117.132 -1.413 . . . . 1.0 114.528 164.481 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 51.9 Cg_exo -66.55 121.57 8.84 Favored 'Trans proline' 0 C--N 1.299 -2.056 0 CA-C-N 124.97 2.811 . . . . 1.0 113.745 160.716 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . 0.381 5.0 mp 75.3 131.9 0.05 OUTLIER 'General case' 0 N--CA 1.43 -1.43 0 CA-C-O 124.944 2.306 . . . . 1.0 116.336 -179.041 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 29.1 m80 -79.98 55.85 2.22 Favored 'General case' 0 N--CA 1.429 -1.502 0 C-N-CA 126.358 1.863 . . . . 1.0 114.144 -172.661 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -144.06 147.37 33.71 Favored 'General case' 0 N--CA 1.43 -1.453 0 C-N-CA 126.112 1.765 . . . . 1.0 110.528 -178.279 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 43.3 t -121.09 151.16 24.1 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.431 0 O-C-N 120.484 -1.385 . . . . 1.0 109.457 -175.372 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 61' ' ' TRP . . . . . 0.456 ' HA ' ' HA ' ' A' ' 70' ' ' HIS . 0.0 OUTLIER -88.77 152.87 21.51 Favored 'General case' 0 N--CA 1.43 -1.461 0 O-C-N 119.65 -1.906 . . . . 1.0 114.533 -178.565 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 80.6 mt -116.17 93.89 4.42 Favored 'General case' 0 N--CA 1.43 -1.444 0 N-CA-C 106.594 -1.632 . . . . 1.0 106.594 162.422 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . 0.553 ' HB3' HG23 ' A' ' 50' ' ' ILE . . . -92.96 100.18 12.68 Favored 'General case' 0 N--CA 1.43 -1.429 0 CA-C-O 123.26 1.505 . . . . 1.0 109.872 169.016 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 64' ' ' THR . . . . . 0.633 HG23 HD12 ' A' ' 49' ' ' ILE . 3.0 m -111.33 -113.51 0.32 Allowed 'General case' 0 N--CA 1.429 -1.509 0 N-CA-C 106.691 -1.596 . . . . 1.0 106.691 -171.909 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 13.3 tmtt? -82.81 -45.59 14.13 Favored 'General case' 0 N--CA 1.43 -1.45 0 O-C-N 119.745 -1.847 . . . . 1.0 111.01 174.452 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 66' ' ' GLN . . . . . 0.436 HE22 ' HB2' ' A' ' 94' ' ' ALA . 17.5 mp0 -74.59 -27.02 60.3 Favored 'General case' 0 N--CA 1.43 -1.469 0 N-CA-C 116.099 1.888 . . . . 1.0 116.099 -166.475 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 117.48 26.24 2.94 Favored Glycine 0 N--CA 1.43 -1.752 0 N-CA-C 117.133 1.613 . . . . 1.0 117.133 166.074 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 115.51 74.59 0.58 Allowed Glycine 0 N--CA 1.43 -1.752 0 CA-C-N 119.569 1.685 . . . . 1.0 115.735 165.185 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 18.2 m-30 -102.07 116.67 33.18 Favored 'General case' 0 N--CA 1.43 -1.468 0 N-CA-C 106.858 -1.534 . . . . 1.0 106.858 178.299 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 70' ' ' HIS . . . . . 0.456 ' HA ' ' HA ' ' A' ' 61' ' ' TRP . 40.8 p-80 -81.68 157.51 24.59 Favored 'General case' 0 N--CA 1.43 -1.468 0 O-C-N 119.802 -1.811 . . . . 1.0 113.891 -179.33 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -116.09 129.76 56.49 Favored 'General case' 0 N--CA 1.43 -1.45 0 N-CA-C 113.375 0.879 . . . . 1.0 113.375 -176.193 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 7.1 m-20 -112.32 179.39 4.0 Favored 'General case' 0 N--CA 1.431 -1.382 0 N-CA-C 107.28 -1.378 . . . . 1.0 107.28 172.483 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 26.3 tp -113.3 106.93 15.2 Favored 'General case' 0 N--CA 1.43 -1.45 0 O-C-N 119.117 -2.239 . . . . 1.0 112.079 -174.957 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 2.8 ttpm? -70.81 -45.18 65.07 Favored 'General case' 0 N--CA 1.431 -1.421 0 O-C-N 119.647 -1.908 . . . . 1.0 113.3 168.024 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -170.51 -103.06 0.16 Allowed Glycine 0 N--CA 1.43 -1.735 0 O-C-N 120.365 -1.459 . . . . 1.0 112.184 177.996 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 40.7 m-20 -89.74 17.94 6.06 Favored 'General case' 0 N--CA 1.431 -1.42 0 O-C-N 120.676 -1.485 . . . . 1.0 111.623 179.698 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 9.2 tt0 -168.13 137.12 2.42 Favored 'General case' 0 N--CA 1.43 -1.467 0 N-CA-C 102.864 -3.013 . . . . 1.0 102.864 -163.676 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 78' ' ' TRP . . . . . . . . . . . . . 33.0 m95 -88.53 145.83 25.51 Favored 'General case' 0 N--CA 1.43 -1.469 0 CA-C-O 122.195 0.998 . . . . 1.0 108.822 -177.131 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 2.1 tt -114.1 130.79 67.7 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.47 0 C-N-CA 129.394 3.078 . . . . 1.0 104.587 -168.818 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 80' ' ' CYS . . . . . 0.402 ' HB2' ' HA ' ' A' ' 85' ' ' GLU . 81.3 m -89.4 146.13 24.87 Favored 'General case' 0 N--CA 1.43 -1.472 0 O-C-N 120.679 -1.263 . . . . 1.0 113.483 -172.674 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 22.0 t70 -45.0 -53.69 7.44 Favored 'General case' 0 N--CA 1.431 -1.383 0 C-N-CA 128.27 2.628 . . . . 1.0 115.871 174.263 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 16.1 ptm180 -149.65 177.43 9.77 Favored 'General case' 0 N--CA 1.43 -1.431 0 O-C-N 120.677 -1.265 . . . . 1.0 110.19 -174.007 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 3.4 t 78.58 -73.47 0.07 Allowed 'General case' 0 N--CA 1.43 -1.439 0 C-N-CA 126.802 2.041 . . . . 1.0 113.026 -175.701 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -170.89 104.1 0.2 Allowed Glycine 0 N--CA 1.43 -1.719 0 N-CA-C 108.845 -1.702 . . . . 1.0 108.845 -176.131 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 85' ' ' GLU . . . . . 0.417 ' HG3' ' H ' ' A' ' 85' ' ' GLU . 0.0 OUTLIER -63.41 105.26 0.73 Allowed 'General case' 0 N--CA 1.429 -1.513 0 N-CA-C 119.86 3.281 . . . . 1.0 119.86 -166.807 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -173.81 127.01 0.39 Allowed 'General case' 0 N--CA 1.43 -1.472 0 C-N-CA 124.718 1.207 . . . . 1.0 112.604 166.522 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 1.2 t80 -45.53 -89.5 0.0 OUTLIER 'General case' 0 N--CA 1.43 -1.44 0 N-CA-C 119.059 2.985 . . . . 1.0 119.059 178.187 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 88' ' ' TRP . . . . . . . . . . . . . 85.7 m95 -72.38 -26.07 61.75 Favored 'General case' 0 N--CA 1.43 -1.436 0 O-C-N 120.07 -1.644 . . . . 1.0 111.546 -166.702 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 6.8 m-20 -69.87 -45.73 67.07 Favored 'General case' 0 N--CA 1.43 -1.451 0 C-N-CA 125.476 1.51 . . . . 1.0 113.283 177.578 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 35.3 tp -69.66 -41.83 75.0 Favored 'General case' 0 N--CA 1.429 -1.521 0 O-C-N 119.557 -1.964 . . . . 1.0 111.523 176.278 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 33.5 tp -56.21 -40.75 74.53 Favored 'General case' 0 N--CA 1.429 -1.52 0 C-N-CA 124.846 1.258 . . . . 1.0 114.26 169.384 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 42.2 tt0 -55.24 -49.87 70.92 Favored 'General case' 0 N--CA 1.43 -1.461 0 C-N-CA 126.711 2.004 . . . . 1.0 112.021 172.379 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 2.1 mp0 -59.96 -46.88 87.98 Favored 'General case' 0 N--CA 1.43 -1.431 0 O-C-N 120.205 -1.559 . . . . 1.0 114.649 173.773 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 94' ' ' ALA . . . . . 0.436 ' HB2' HE22 ' A' ' 66' ' ' GLN . . . -62.87 -42.18 99.67 Favored 'General case' 0 N--CA 1.43 -1.456 0 N-CA-C 115.068 1.507 . . . . 1.0 115.068 177.833 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -80.2 -37.37 33.32 Favored 'General case' 0 N--CA 1.429 -1.497 0 O-C-N 120.268 -1.52 . . . . 1.0 114.043 -179.472 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 96' ' ' THR . . . . . 0.448 HG23 HG12 ' A' ' 103' ' ' VAL . 23.2 p -58.52 -38.51 77.87 Favored 'General case' 0 N--CA 1.43 -1.452 0 CA-C-N 120.663 1.574 . . . . 1.0 112.335 170.574 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 34.1 tp60 -59.44 -61.58 2.52 Favored 'General case' 0 N--CA 1.429 -1.484 0 C-N-CA 124.837 1.255 . . . . 1.0 113.354 172.425 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 4.4 mm-40 -64.25 -43.4 95.01 Favored 'General case' 0 N--CA 1.429 -1.496 0 N-CA-C 116.145 1.906 . . . . 1.0 116.145 -179.038 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -77.45 -31.82 54.08 Favored 'General case' 0 CA--C 1.489 -1.386 0 O-C-N 120.644 -1.285 . . . . 1.0 113.427 -178.017 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . 98.26 16.63 31.81 Favored Glycine 0 N--CA 1.428 -1.857 0 C-N-CA 124.568 1.08 . . . . 1.0 115.537 169.735 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 16.4 pt-20 -168.05 174.86 7.01 Favored 'General case' 0 N--CA 1.428 -1.562 0 N-CA-C 108.204 -1.036 . . . . 1.0 108.204 -172.403 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 25.8 m -66.35 121.73 15.91 Favored 'General case' 0 N--CA 1.431 -1.385 0 O-C-N 120.645 -1.285 . . . . 1.0 112.569 -177.268 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 103' ' ' VAL . . . . . 0.448 HG12 HG23 ' A' ' 96' ' ' THR . 4.7 p -97.83 137.14 26.25 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.508 0 N-CA-C 106.046 -1.835 . . . . 1.0 106.046 179.391 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 2.8 t -117.07 78.88 1.26 Allowed 'General case' 0 N--CA 1.431 -1.396 0 O-C-N 121.181 -0.949 . . . . 1.0 112.161 -162.638 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 61.9 m-85 -103.03 -35.55 8.5 Favored 'General case' 0 N--CA 1.429 -1.486 0 O-C-N 120.06 -1.65 . . . . 1.0 110.306 174.458 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 22.6 mtm180 . . . . . 0 C--O 1.259 1.598 0 C-N-CA 123.411 0.685 . . . . 1.0 110.043 -172.597 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 56.0 m-80 . . . . . 0 N--CA 1.43 -1.471 0 CA-C-O 122.491 1.139 . . . . 1.0 112.647 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 8.3 p-10 -73.48 -29.2 62.37 Favored 'General case' 0 N--CA 1.43 -1.474 0 C-N-CA 125.19 1.396 . . . . 1.0 112.433 175.786 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 48.3 p -58.66 -52.17 66.84 Favored 'General case' 0 N--CA 1.43 -1.459 0 C-N-CA 125.762 1.625 . . . . 1.0 113.151 168.752 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 95.6 mt-10 -54.31 -54.07 45.34 Favored 'General case' 0 N--CA 1.428 -1.555 0 C-N-CA 126.822 2.049 . . . . 1.0 112.573 172.037 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 43.0 t80 -48.69 -46.94 41.14 Favored 'General case' 0 N--CA 1.429 -1.49 0 N-CA-C 115.343 1.609 . . . . 1.0 115.343 172.728 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 18.0 m170 -60.98 -51.54 68.83 Favored 'General case' 0 N--CA 1.43 -1.428 0 N-CA-C 113.838 1.051 . . . . 1.0 113.838 175.884 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 94.7 mtt180 -61.45 -40.61 95.12 Favored 'General case' 0 N--CA 1.429 -1.493 0 O-C-N 120.542 -1.349 . . . . 1.0 113.92 -179.724 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 72.5 mt -64.33 -45.35 88.23 Favored 'General case' 0 N--CA 1.43 -1.469 0 C-N-CA 125.402 1.481 . . . . 1.0 112.795 173.107 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -60.3 -51.04 71.23 Favored 'General case' 0 N--CA 1.43 -1.459 0 C-N-CA 125.898 1.679 . . . . 1.0 113.641 -179.407 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 -56.64 -49.21 75.68 Favored 'General case' 0 N--CA 1.429 -1.487 0 C-N-CA 124.267 1.027 . . . . 1.0 112.207 172.818 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . 0.315 5.9 pt20 -63.82 -44.73 92.38 Favored 'General case' 0 N--CA 1.431 -1.408 0 O-C-N 120.091 -1.631 . . . . 1.0 115.108 178.705 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 4.2 pp -65.34 -36.7 84.84 Favored 'General case' 0 N--CA 1.43 -1.469 0 CA-C-N 121.375 1.898 . . . . 1.0 115.019 -179.011 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 29.6 m0 -54.9 -60.41 3.4 Favored 'General case' 0 N--CA 1.43 -1.461 0 N-CA-C 113.507 0.929 . . . . 1.0 113.507 166.683 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 35.2 mt -63.67 -33.75 76.32 Favored 'General case' 0 N--CA 1.431 -1.413 0 CA-C-N 120.561 1.528 . . . . 1.0 114.593 -178.416 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 86.0 m -54.86 -59.98 3.99 Favored 'General case' 0 N--CA 1.431 -1.416 0 C-N-CA 125.475 1.51 . . . . 1.0 111.98 173.771 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 38.9 mm -62.12 -39.12 82.71 Favored 'Isoleucine or valine' 0 CA--C 1.489 -1.374 0 N-CA-C 114.596 1.332 . . . . 1.0 114.596 176.844 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 95.4 mt-10 -51.55 -52.33 48.05 Favored 'General case' 0 N--CA 1.43 -1.434 0 CA-C-N 121.434 1.925 . . . . 1.0 113.281 171.529 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 2.4 tp10 -65.4 -36.58 84.38 Favored 'General case' 0 N--CA 1.429 -1.489 0 N-CA-C 114.246 1.202 . . . . 1.0 114.246 -179.819 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 49.8 ttt-85 -54.0 -51.03 65.24 Favored 'General case' 0 N--CA 1.43 -1.465 0 O-C-N 120.793 -1.192 . . . . 1.0 113.053 170.521 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -70.07 -45.05 67.85 Favored 'General case' 0 N--CA 1.43 -1.436 0 N-CA-C 113.085 0.772 . . . . 1.0 113.085 178.302 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 34.8 t0 -55.18 -44.56 75.36 Favored 'General case' 0 N--CA 1.43 -1.449 0 C-N-CA 125.122 1.369 . . . . 1.0 114.075 178.987 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 32.1 t70 -71.04 -28.73 64.6 Favored 'General case' 0 N--CA 1.431 -1.409 0 O-C-N 120.052 -1.655 . . . . 1.0 113.472 177.678 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 24' ' ' TRP . . . . . . . . . . . . . 37.3 t-105 -71.28 149.33 46.26 Favored 'General case' 0 N--CA 1.43 -1.462 0 O-C-N 120.063 -1.648 . . . . 1.0 112.897 -177.831 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 6.8 m-20 -151.66 163.02 40.02 Favored 'General case' 0 N--CA 1.429 -1.488 0 N-CA-C 104.002 -2.592 . . . . 1.0 104.002 163.543 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -161.27 -132.6 1.36 Allowed Glycine 0 N--CA 1.43 -1.72 0 O-C-N 120.622 -1.299 . . . . 1.0 111.417 176.565 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -68.3 -32.6 72.86 Favored 'General case' 0 N--CA 1.43 -1.437 0 O-C-N 121.466 -1.02 . . . . 1.0 110.347 171.743 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 79.9 p -112.86 172.48 6.91 Favored 'General case' 0 N--CA 1.43 -1.452 0 C-N-CA 124.347 1.059 . . . . 1.0 111.212 177.046 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 2.9 t70 -96.12 -168.94 1.83 Allowed 'General case' 0 N--CA 1.43 -1.462 0 C-N-CA 124.811 1.244 . . . . 1.0 110.28 179.091 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 7.1 tp -163.37 119.73 0.15 Allowed 'Isoleucine or valine' 0 N--CA 1.43 -1.456 0 O-C-N 120.502 -1.374 . . . . 1.0 110.652 -169.19 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 37.7 t0 -135.84 108.25 7.35 Favored 'General case' 0 N--CA 1.43 -1.432 0 O-C-N 119.86 -1.775 . . . . 1.0 110.533 169.407 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 33.7 t -81.33 143.97 31.83 Favored 'General case' 0 N--CA 1.43 -1.438 0 O-C-N 119.033 -2.292 . . . . 1.0 112.049 173.012 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 33.4 mt-10 -90.16 139.22 30.84 Favored 'General case' 0 N--CA 1.43 -1.445 0 O-C-N 120.403 -1.436 . . . . 1.0 109.13 168.765 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 3.9 mp -126.28 105.68 14.75 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.425 0 N-CA-C 104.853 -2.277 . . . . 1.0 104.853 173.927 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 48.6 t30 -132.75 76.64 1.7 Allowed 'General case' 0 N--CA 1.429 -1.48 0 C-N-CA 124.882 1.273 . . . . 1.0 110.849 -167.171 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . 78.75 -73.15 2.31 Favored Glycine 0 N--CA 1.43 -1.754 0 O-C-N 120.963 -1.086 . . . . 1.0 115.453 167.343 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -142.93 27.53 2.17 Favored Glycine 0 N--CA 1.431 -1.684 0 C-N-CA 124.906 1.241 . . . . 1.0 110.432 172.116 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 76.4 t -125.44 136.22 61.54 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.419 0 C-N-CA 125.313 1.445 . . . . 1.0 107.198 177.216 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 72.7 mt -109.62 136.66 48.63 Favored 'General case' 0 N--CA 1.43 -1.431 0 N-CA-C 107.084 -1.45 . . . . 1.0 107.084 155.684 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -138.55 111.04 7.51 Favored 'General case' 0 N--CA 1.431 -1.393 0 N-CA-C 106.035 -1.839 . . . . 1.0 106.035 178.368 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 67.9 mt -89.74 126.35 42.65 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.432 0 O-C-N 120.32 -1.488 . . . . 1.0 109.684 -171.097 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 28.3 p -119.85 126.35 50.76 Favored 'General case' 0 N--CA 1.43 -1.435 0 CA-C-O 121.728 0.775 . . . . 1.0 113.004 179.896 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 43' ' ' PHE . . . . . . . . . . . . . 1.0 OUTLIER -122.96 170.27 10.3 Favored 'General case' 0 N--CA 1.43 -1.444 0 O-C-N 120.27 -1.519 . . . . 1.0 112.302 169.909 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 4.4 mm-40 -48.41 -36.75 15.38 Favored 'General case' 0 N--CA 1.429 -1.488 0 N-CA-C 118.557 2.799 . . . . 1.0 118.557 -171.439 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 47.1 m-80 -68.86 -6.0 24.52 Favored 'General case' 0 N--CA 1.43 -1.474 0 N-CA-C 115.535 1.68 . . . . 1.0 115.535 179.716 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 80.24 30.54 41.27 Favored Glycine 0 N--CA 1.43 -1.757 0 O-C-N 120.579 -1.325 . . . . 1.0 112.791 172.142 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 51.0 m -127.12 149.52 49.91 Favored 'General case' 0 N--CA 1.43 -1.46 0 N-CA-C 105.168 -2.16 . . . . 1.0 105.168 -177.571 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 22.8 pttm -140.53 159.07 43.0 Favored 'General case' 0 N--CA 1.431 -1.404 0 N-CA-C 113.826 1.047 . . . . 1.0 113.826 -165.136 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 12.7 mm -110.61 138.56 38.1 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.471 0 N-CA-C 106.195 -1.78 . . . . 1.0 106.195 177.1 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 5.5 mm -120.77 114.91 45.3 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.414 0 CA-C-N 119.937 1.244 . . . . 1.0 110.787 -173.562 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER -125.68 89.26 1.39 Allowed 'Isoleucine or valine' 0 N--CA 1.43 -1.459 0 C-N-CA 126.187 1.795 . . . . 1.0 110.468 -172.565 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 52' ' ' ASN . . . . . 0.425 ' H ' ' HD1' ' A' ' 61' ' ' TRP . 51.3 m-20 -114.25 161.74 17.46 Favored 'General case' 0 N--CA 1.43 -1.448 0 C-N-CA 128.725 2.81 . . . . 1.0 110.239 178.545 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -154.31 151.54 29.22 Favored 'General case' 0 N--CA 1.43 -1.455 0 O-C-N 119.91 -1.744 . . . . 1.0 112.319 -168.666 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -100.33 144.17 29.65 Favored 'General case' 0 N--CA 1.43 -1.433 0 CA-C-O 123.426 1.584 . . . . 1.0 108.192 174.977 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 54.3 mt-10 -70.75 -63.55 1.56 Allowed Pre-proline 0 N--CA 1.431 -1.418 0 CA-C-O 116.034 -1.936 . . . . 1.0 114.479 172.163 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 87.3 Cg_endo -78.85 157.9 27.58 Favored 'Trans proline' 0 C--N 1.3 -1.984 0 CA-C-N 126.135 3.227 . . . . 1.0 112.622 169.959 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . 0.409 5.1 mp 72.18 134.94 0.04 OUTLIER 'General case' 0 N--CA 1.43 -1.456 0 C-N-CA 127.266 2.226 . . . . 1.0 113.588 -165.616 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 17.5 m170 -83.8 50.77 1.88 Allowed 'General case' 0 N--CA 1.431 -1.411 0 O-C-N 120.668 -1.27 . . . . 1.0 112.853 -172.596 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -152.28 158.95 43.51 Favored 'General case' 0 N--CA 1.43 -1.428 0 O-C-N 120.382 -1.449 . . . . 1.0 109.43 -178.401 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 38.2 t -126.5 161.63 32.28 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.438 0 C-N-CA 125.528 1.531 . . . . 1.0 108.55 -169.182 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 61' ' ' TRP . . . . . 0.425 ' HD1' ' H ' ' A' ' 52' ' ' ASN . 0.0 OUTLIER -93.52 154.78 17.7 Favored 'General case' 0 N--CA 1.431 -1.413 0 O-C-N 118.792 -2.443 . . . . 1.0 111.028 177.3 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -142.5 101.41 3.88 Favored 'General case' 0 N--CA 1.431 -1.409 0 O-C-N 118.362 -2.711 . . . . 1.0 112.687 169.55 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -112.22 149.62 32.03 Favored 'General case' 0 N--CA 1.43 -1.467 0 O-C-N 119.494 -2.003 . . . . 1.0 114.61 174.313 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 64' ' ' THR . . . . . . . . . . . . . 95.1 m -151.89 -87.12 0.07 Allowed 'General case' 0 N--CA 1.43 -1.436 0 C-N-CA 126.186 1.794 . . . . 1.0 109.977 -179.891 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -131.23 -54.77 1.04 Allowed 'General case' 0 N--CA 1.43 -1.445 0 O-C-N 121.139 -0.976 . . . . 1.0 113.184 -170.556 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 58.8 mt-30 -71.08 -24.75 62.38 Favored 'General case' 0 N--CA 1.431 -1.418 0 N-CA-C 114.639 1.348 . . . . 1.0 114.639 -171.003 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 177.09 -40.42 0.1 OUTLIER Glycine 0 N--CA 1.429 -1.811 0 C-N-CA 117.753 -2.165 . . . . 1.0 115.588 174.207 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 98.8 106.62 2.65 Favored Glycine 0 N--CA 1.43 -1.745 0 CA-C-O 122.557 1.087 . . . . 1.0 111.978 -173.96 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 14.8 m-85 -128.5 135.77 49.89 Favored 'General case' 0 N--CA 1.43 -1.459 0 N-CA-C 105.802 -1.925 . . . . 1.0 105.802 -167.939 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 70' ' ' HIS . . . . . 0.458 ' HE1' ' OD2' ' A' ' 81' ' ' ASP . 27.2 p80 -83.42 159.8 21.71 Favored 'General case' 0 N--CA 1.43 -1.467 0 O-C-N 119.826 -1.796 . . . . 1.0 112.881 179.905 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 71' ' ' PHE . . . . . . . . . . . . 0.321 24.5 t80 -117.9 112.46 20.37 Favored 'General case' 0 N--CA 1.43 -1.428 0 C-N-CA 127.653 2.381 . . . . 1.0 105.185 -156.875 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -126.45 165.55 18.88 Favored 'General case' 0 N--CA 1.431 -1.394 0 N-CA-C 107.574 -1.269 . . . . 1.0 107.574 -169.689 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 51.4 tp -112.06 124.81 53.21 Favored 'General case' 0 N--CA 1.43 -1.451 0 O-C-N 119.528 -1.982 . . . . 1.0 110.434 -169.963 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 6.2 tmtt? -74.64 -58.73 3.1 Favored 'General case' 0 N--CA 1.429 -1.478 0 O-C-N 121.322 -0.861 . . . . 1.0 109.599 162.277 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -179.3 -61.65 0.07 OUTLIER Glycine 0 N--CA 1.43 -1.716 0 O-C-N 121.098 -1.001 . . . . 1.0 111.551 179.033 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 24.1 t0 -99.32 -18.21 17.66 Favored 'General case' 0 N--CA 1.43 -1.425 0 C-N-CA 126.108 1.763 . . . . 1.0 110.141 179.075 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 1.1 tp10 -130.09 128.43 41.86 Favored 'General case' 0 N--CA 1.431 -1.415 0 N-CA-C 103.377 -2.823 . . . . 1.0 103.377 -170.711 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 78' ' ' TRP . . . . . . . . . . . . . 91.7 m95 -77.47 129.55 35.87 Favored 'General case' 0 N--CA 1.429 -1.481 0 N-CA-C 105.364 -2.088 . . . . 1.0 105.364 162.498 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 79' ' ' ILE . . . . . 0.455 ' HB ' ' HB2' ' A' ' 85' ' ' GLU . 0.1 OUTLIER -131.34 153.24 38.65 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.377 0 O-C-N 119.976 -1.703 . . . . 1.0 106.865 -173.876 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 5.2 m -80.55 132.37 35.65 Favored 'General case' 0 N--CA 1.429 -1.488 0 O-C-N 119.873 -1.767 . . . . 1.0 112.922 -172.378 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 81' ' ' ASP . . . . . 0.458 ' OD2' ' HE1' ' A' ' 70' ' ' HIS . 24.0 t70 -86.61 62.8 7.63 Favored 'General case' 0 N--CA 1.431 -1.42 0 O-C-N 118.928 -2.357 . . . . 1.0 110.932 177.32 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -155.71 -135.73 0.05 OUTLIER 'General case' 0 N--CA 1.43 -1.441 0 O-C-N 120.608 -1.307 . . . . 1.0 111.858 -176.027 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 35.1 p -86.0 -12.44 50.32 Favored 'General case' 0 N--CA 1.428 -1.551 0 O-C-N 119.347 -2.096 . . . . 1.0 113.887 -170.524 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -161.93 92.32 0.11 Allowed Glycine 0 N--CA 1.429 -1.768 0 O-C-N 120.684 -1.26 . . . . 1.0 113.331 -177.534 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 85' ' ' GLU . . . . . 0.455 ' HB2' ' HB ' ' A' ' 79' ' ' ILE . 8.2 pt-20 -77.55 113.41 15.35 Favored 'General case' 0 N--CA 1.431 -1.398 0 N-CA-C 119.014 2.968 . . . . 1.0 119.014 -169.845 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 86.1 m -174.46 125.25 0.31 Allowed 'General case' 0 N--CA 1.431 -1.422 0 C-N-CA 126.315 1.846 . . . . 1.0 110.574 161.775 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 2.0 t80 -52.77 -84.21 0.01 OUTLIER 'General case' 0 N--CA 1.429 -1.508 0 N-CA-C 115.378 1.621 . . . . 1.0 115.378 170.265 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 88' ' ' TRP . . . . . . . . . . . . . 56.0 m95 -58.95 -29.43 67.15 Favored 'General case' 0 N--CA 1.43 -1.445 0 N-CA-C 116.283 1.957 . . . . 1.0 116.283 -166.1 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 24.0 m-20 -76.99 -41.35 43.25 Favored 'General case' 0 N--CA 1.429 -1.479 0 C-N-CA 124.489 1.116 . . . . 1.0 112.254 175.668 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 41.9 tp -69.65 -43.23 73.03 Favored 'General case' 0 N--CA 1.43 -1.425 0 O-C-N 119.521 -1.987 . . . . 1.0 111.88 176.249 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 2.6 tm? -48.38 -50.69 29.71 Favored 'General case' 0 N--CA 1.43 -1.471 0 C-N-CA 128.941 2.896 . . . . 1.0 113.08 172.608 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 37.5 tt0 -51.66 -54.44 27.96 Favored 'General case' 0 N--CA 1.431 -1.423 0 C-N-CA 125.823 1.649 . . . . 1.0 114.547 166.852 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 4.1 tt0 -58.5 -44.73 89.54 Favored 'General case' 0 N--CA 1.43 -1.471 0 N-CA-C 114.372 1.249 . . . . 1.0 114.372 179.929 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -58.75 -48.49 81.03 Favored 'General case' 0 N--CA 1.431 -1.412 0 C-N-CA 127.53 2.332 . . . . 1.0 113.554 174.895 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -64.89 -46.56 81.24 Favored 'General case' 0 N--CA 1.429 -1.483 0 O-C-N 119.426 -2.046 . . . . 1.0 113.131 176.191 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 96.5 m -53.61 -48.89 68.87 Favored 'General case' 0 N--CA 1.431 -1.409 0 C-N-CA 127.224 2.21 . . . . 1.0 114.176 174.037 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 2.1 pt20 -70.18 -28.02 64.98 Favored 'General case' 0 N--CA 1.43 -1.45 0 O-C-N 121.061 -1.025 . . . . 1.0 113.607 -178.911 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 15.7 mm-40 -75.91 -39.02 57.13 Favored 'General case' 0 N--CA 1.43 -1.459 0 N-CA-C 114.309 1.226 . . . . 1.0 114.309 171.988 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -85.85 -46.58 10.49 Favored 'General case' 0 N--CA 1.43 -1.461 0 O-C-N 120.229 -1.545 . . . . 1.0 114.963 -176.436 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . 91.28 43.25 4.7 Favored Glycine 0 N--CA 1.43 -1.745 0 O-C-N 120.418 -1.426 . . . . 1.0 112.55 -170.825 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 18.6 tt0 -170.04 145.75 2.93 Favored 'General case' 0 N--CA 1.43 -1.455 0 N-CA-C 103.712 -2.699 . . . . 1.0 103.712 -172.865 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 13.4 m -74.49 99.95 3.72 Favored 'General case' 0 N--CA 1.429 -1.484 0 CA-C-N 121.792 2.087 . . . . 1.0 111.033 179.282 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 12.2 t -95.36 84.1 1.55 Allowed 'Isoleucine or valine' 0 N--CA 1.432 -1.362 0 CA-C-O 124.231 1.967 . . . . 1.0 107.953 178.769 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 8.2 t -92.36 177.07 6.25 Favored 'General case' 0 N--CA 1.43 -1.438 0 C-N-CA 125.718 1.607 . . . . 1.0 112.695 -168.259 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 30.8 t80 -138.58 -29.32 0.8 Allowed 'General case' 0 N--CA 1.43 -1.434 0 O-C-N 120.83 -1.169 . . . . 1.0 111.04 156.83 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 89.1 mtt180 . . . . . 0 C--O 1.26 1.634 0 O-C-N 120.368 -1.457 . . . . 1.0 110.437 179.27 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 91.9 m-20 . . . . . 0 N--CA 1.431 -1.416 0 CA-C-O 121.843 0.83 . . . . 1.0 109.995 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 22.5 m-20 -65.78 -39.16 90.72 Favored 'General case' 0 N--CA 1.429 -1.477 0 C-N-CA 125.272 1.429 . . . . 1.0 113.581 179.131 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 8.6 t -65.07 -43.29 92.7 Favored 'General case' 0 N--CA 1.43 -1.473 0 O-C-N 120.951 -1.093 . . . . 1.0 111.786 -178.854 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 14.0 mt-10 -58.36 -60.83 3.16 Favored 'General case' 0 N--CA 1.429 -1.483 0 C-N-CA 124.694 1.197 . . . . 1.0 112.364 171.148 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 1.1 t80 -53.26 -38.48 63.06 Favored 'General case' 0 N--CA 1.43 -1.425 0 N-CA-C 115.911 1.819 . . . . 1.0 115.911 179.229 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 2.5 m-70 -61.18 -50.56 72.66 Favored 'General case' 0 N--CA 1.43 -1.439 0 N-CA-C 115.524 1.676 . . . . 1.0 115.524 170.224 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 23.1 ttm180 -67.81 -45.38 74.91 Favored 'General case' 0 N--CA 1.43 -1.47 0 C-N-CA 124.17 0.988 . . . . 1.0 112.207 -176.106 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 83.4 mt -55.26 -45.59 76.12 Favored 'General case' 0 N--CA 1.43 -1.464 0 C-N-CA 126.507 1.923 . . . . 1.0 113.611 172.367 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -56.84 -55.49 33.77 Favored 'General case' 0 N--CA 1.43 -1.467 0 C-N-CA 125.27 1.428 . . . . 1.0 113.152 173.949 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -56.3 -43.53 79.01 Favored 'General case' 0 N--CA 1.431 -1.415 0 C-N-CA 124.228 1.011 . . . . 1.0 112.617 -176.05 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 28.3 mm100 -63.4 -53.86 45.76 Favored 'General case' 0 N--CA 1.43 -1.441 0 N-CA-C 115.165 1.542 . . . . 1.0 115.165 173.846 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 2.4 pp -65.2 -47.18 77.79 Favored 'General case' 0 N--CA 1.43 -1.443 0 O-C-N 120.387 -1.446 . . . . 1.0 114.272 -177.697 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 39.8 m0 -52.87 -50.04 64.61 Favored 'General case' 0 N--CA 1.43 -1.468 0 C-N-CA 126.953 2.101 . . . . 1.0 113.447 174.256 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 44.0 tp -60.79 -49.34 77.87 Favored 'General case' 0 N--CA 1.429 -1.517 0 C-N-CA 123.651 0.78 . . . . 1.0 112.719 177.49 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 36.5 m -59.11 -53.15 61.63 Favored 'General case' 0 N--CA 1.431 -1.398 0 C-N-CA 125.818 1.647 . . . . 1.0 113.276 -178.676 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 78.8 mt -57.64 -54.1 35.87 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.464 0 C-N-CA 125.839 1.656 . . . . 1.0 114.169 174.989 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 31.8 tt0 -60.18 -48.42 81.82 Favored 'General case' 0 N--CA 1.429 -1.496 0 CA-C-N 120.072 1.306 . . . . 1.0 113.117 -177.774 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 42.9 tt0 -57.85 -48.57 79.41 Favored 'General case' 0 N--CA 1.429 -1.511 0 C-N-CA 125.102 1.361 . . . . 1.0 114.164 178.144 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -71.15 -29.64 65.48 Favored 'General case' 0 N--CA 1.43 -1.456 0 N-CA-C 113.056 0.761 . . . . 1.0 113.056 -177.548 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 5.3 tp -67.14 -50.92 59.59 Favored 'General case' 0 N--CA 1.43 -1.446 0 O-C-N 120.919 -1.113 . . . . 1.0 112.597 171.393 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 11.3 t70 -62.31 -36.42 82.1 Favored 'General case' 0 N--CA 1.429 -1.507 0 O-C-N 121.023 -1.048 . . . . 1.0 112.889 -177.425 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 21.2 t0 -90.81 21.89 3.88 Favored 'General case' 0 N--CA 1.43 -1.438 0 O-C-N 120.486 -1.384 . . . . 1.0 113.847 177.515 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 24' ' ' TRP . . . . . . . . . . . . . 47.0 t-105 -84.56 -59.7 2.29 Favored 'General case' 0 N--CA 1.43 -1.452 0 O-C-N 119.025 -2.297 . . . . 1.0 113.691 -179.445 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 7.0 t70 67.03 -132.0 0.14 Allowed 'General case' 0 N--CA 1.43 -1.453 0 C-N-CA 126.784 2.034 . . . . 1.0 112.603 -176.32 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 93.1 -138.38 14.09 Favored Glycine 0 N--CA 1.43 -1.709 0 O-C-N 120.737 -1.227 . . . . 1.0 112.691 176.116 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -82.23 -26.27 33.4 Favored 'General case' 0 N--CA 1.429 -1.489 0 O-C-N 120.592 -1.534 . . . . 1.0 109.79 172.589 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 4.4 p -75.36 144.27 42.4 Favored 'General case' 0 N--CA 1.429 -1.498 0 C-N-CA 126.506 1.923 . . . . 1.0 114.434 174.642 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . 0.41 ' H ' ' HG2' ' A' ' 44' ' ' GLU . 13.8 t70 -104.36 138.43 40.8 Favored 'General case' 0 N--CA 1.43 -1.469 0 N-CA-C 104.137 -2.542 . . . . 1.0 104.137 162.925 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -146.15 115.48 1.47 Allowed 'Isoleucine or valine' 0 N--CA 1.429 -1.481 0 CA-C-O 122.84 1.305 . . . . 1.0 108.62 -157.653 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 13.8 m-20 -126.47 143.3 51.24 Favored 'General case' 0 N--CA 1.429 -1.493 0 C-N-CA 124.103 0.961 . . . . 1.0 109.291 168.625 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 17.8 t -109.67 149.9 29.05 Favored 'General case' 0 N--CA 1.43 -1.432 0 O-C-N 119.832 -1.793 . . . . 1.0 108.203 164.627 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 17.2 mt-10 -113.65 142.39 46.06 Favored 'General case' 0 N--CA 1.429 -1.511 0 O-C-N 120.829 -1.169 . . . . 1.0 108.113 176.822 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 3.3 tp -122.47 110.34 26.62 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.484 0 CA-C-O 124.086 1.898 . . . . 1.0 107.259 -178.099 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 48.3 m-80 -108.95 73.75 0.87 Allowed 'General case' 0 N--CA 1.431 -1.396 0 CA-C-N 114.477 -1.238 . . . . 1.0 109.088 176.677 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . 73.35 -7.65 11.3 Favored Glycine 0 N--CA 1.43 -1.761 0 N-CA-C 117.618 1.807 . . . . 1.0 117.618 171.503 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 151.91 -33.7 0.87 Allowed Glycine 0 N--CA 1.43 -1.764 0 N-CA-C 109.127 -1.589 . . . . 1.0 109.127 -168.734 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 64.7 t -79.27 105.94 9.47 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.43 0 O-C-N 120.397 -1.649 . . . . 1.0 109.595 175.5 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 18.5 mt -94.8 129.16 41.87 Favored 'General case' 0 N--CA 1.43 -1.464 0 CA-C-O 123.074 1.416 . . . . 1.0 110.206 175.667 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 18.6 p -126.52 121.89 33.61 Favored 'General case' 0 N--CA 1.43 -1.455 0 N-CA-C 107.358 -1.349 . . . . 1.0 107.358 -179.713 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 74.2 mt -97.2 122.28 48.59 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.479 0 C-N-CA 124.721 1.208 . . . . 1.0 109.32 -169.866 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 21.8 p -123.74 108.38 12.46 Favored 'General case' 0 N--CA 1.431 -1.396 0 N-CA-C 114.863 1.431 . . . . 1.0 114.863 -171.55 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 43' ' ' PHE . . . . . . . . . . . . . 9.0 p90 -114.55 164.86 13.42 Favored 'General case' 0 N--CA 1.429 -1.49 0 O-C-N 119.633 -1.917 . . . . 1.0 113.894 178.75 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . 0.41 ' HG2' ' H ' ' A' ' 29' ' ' ASP . 0.5 OUTLIER -61.76 -20.18 63.27 Favored 'General case' 0 N--CA 1.43 -1.442 0 C-N-CA 128.77 2.828 . . . . 1.0 118.371 -166.779 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 22.5 t30 -66.69 -15.08 63.26 Favored 'General case' 0 N--CA 1.429 -1.491 0 C-N-CA 124.674 1.19 . . . . 1.0 113.618 173.583 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 101.48 -5.25 54.72 Favored Glycine 0 N--CA 1.431 -1.686 0 O-C-N 120.508 -1.37 . . . . 1.0 113.066 171.197 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 70.0 m -93.73 159.28 15.28 Favored 'General case' 0 N--CA 1.43 -1.425 0 O-C-N 121.467 -1.02 . . . . 1.0 111.33 178.493 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 24.0 pttm -142.29 140.08 32.08 Favored 'General case' 0 N--CA 1.429 -1.497 0 O-C-N 121.526 -0.734 . . . . 1.0 111.566 -178.784 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -108.45 143.95 17.88 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.453 0 C-N-CA 126.701 2.0 . . . . 1.0 107.572 179.549 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 9.7 mm -126.38 122.43 61.21 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.458 0 C-N-CA 124.227 1.011 . . . . 1.0 110.816 -163.33 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 3.7 mt -124.61 108.18 19.79 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.428 0 CA-C-O 123.328 1.537 . . . . 1.0 112.874 -179.77 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 52' ' ' ASN . . . . . 0.444 ' H ' ' HD1' ' A' ' 61' ' ' TRP . 29.1 m-80 -120.44 160.63 22.73 Favored 'General case' 0 N--CA 1.429 -1.481 0 C-N-CA 128.224 2.61 . . . . 1.0 108.445 173.497 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 10.3 ptt180 -141.68 140.21 33.15 Favored 'General case' 0 N--CA 1.43 -1.453 0 C-N-CA 124.713 1.205 . . . . 1.0 111.737 174.083 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 24.6 mm100 -110.02 114.46 28.01 Favored 'General case' 0 N--CA 1.431 -1.406 0 C-N-CA 126.004 1.722 . . . . 1.0 108.522 174.558 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 54.8 mt-10 -48.09 -47.48 65.37 Favored Pre-proline 0 N--CA 1.431 -1.414 0 N-CA-C 119.479 3.14 . . . . 1.0 119.479 -175.548 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 50.9 Cg_exo -73.01 -11.41 25.4 Favored 'Trans proline' 0 N--CA 1.434 -2.021 0 CA-C-N 126.022 3.186 . . . . 1.0 114.829 -175.468 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 38.5 mt -84.18 -39.67 19.09 Favored 'General case' 0 N--CA 1.43 -1.443 0 CA-C-N 119.269 0.941 . . . . 1.0 111.191 -174.977 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 19.8 m80 71.33 23.73 3.91 Favored 'General case' 0 CA--C 1.488 -1.433 0 C-N-CA 125.448 1.499 . . . . 1.0 113.866 -179.423 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 1.7 pt20 -131.32 156.58 45.24 Favored 'General case' 0 N--CA 1.429 -1.483 0 C-N-CA 127.898 2.479 . . . . 1.0 106.072 172.903 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 48.0 t -116.41 158.19 16.98 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.43 0 O-C-N 121.185 -0.947 . . . . 1.0 108.687 -171.732 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 61' ' ' TRP . . . . . 0.444 ' HD1' ' H ' ' A' ' 52' ' ' ASN . 0.0 OUTLIER -101.67 152.55 20.7 Favored 'General case' 0 N--CA 1.43 -1.436 0 O-C-N 119.831 -1.793 . . . . 1.0 114.194 176.018 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 93.7 mt -125.83 97.99 5.36 Favored 'General case' 0 N--CA 1.428 -1.55 0 C-N-CA 125.957 1.703 . . . . 1.0 109.056 164.71 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . 0.406 ' HA ' ' HA2' ' A' ' 68' ' ' GLY . . . -94.49 141.75 28.23 Favored 'General case' 0 N--CA 1.43 -1.44 0 O-C-N 120.285 -1.509 . . . . 1.0 110.478 167.451 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 64' ' ' THR . . . . . . . . . . . . . 74.5 p -142.49 -119.71 0.1 Allowed 'General case' 0 N--CA 1.43 -1.452 0 C-N-CA 124.79 1.236 . . . . 1.0 108.223 -165.43 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 3.5 tmtt? -101.53 -40.83 6.85 Favored 'General case' 0 N--CA 1.431 -1.419 0 O-C-N 120.503 -1.373 . . . . 1.0 109.717 170.134 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 51.2 tt0 -74.22 -25.93 59.95 Favored 'General case' 0 N--CA 1.429 -1.484 0 N-CA-C 116.863 2.171 . . . . 1.0 116.863 -164.101 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 157.7 -34.99 0.54 Allowed Glycine 0 N--CA 1.43 -1.728 0 O-C-N 119.585 -1.947 . . . . 1.0 115.65 175.501 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 68' ' ' GLY . . . . . 0.406 ' HA2' ' HA ' ' A' ' 63' ' ' ALA . . . 117.17 115.05 2.76 Favored Glycine 0 N--CA 1.429 -1.775 0 C-N-CA 125.625 1.583 . . . . 1.0 112.806 -179.19 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -104.34 142.81 33.9 Favored 'General case' 0 N--CA 1.43 -1.445 0 C-N-CA 125.498 1.519 . . . . 1.0 106.963 175.444 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 3.4 p-80 -109.25 152.79 24.74 Favored 'General case' 0 N--CA 1.43 -1.438 0 O-C-N 119.082 -2.262 . . . . 1.0 110.545 165.68 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 48.8 p90 -129.77 131.37 46.21 Favored 'General case' 0 N--CA 1.43 -1.472 0 N-CA-C 113.975 1.102 . . . . 1.0 113.975 -166.068 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 32.7 m-20 -110.01 169.7 8.55 Favored 'General case' 0 N--CA 1.429 -1.49 0 C-N-CA 126.356 1.863 . . . . 1.0 109.21 -176.197 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 50.9 tp -115.97 114.22 24.32 Favored 'General case' 0 N--CA 1.43 -1.447 0 O-C-N 119.984 -1.698 . . . . 1.0 110.584 -178.164 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 18.5 mttm -71.05 -60.21 2.36 Favored 'General case' 0 N--CA 1.431 -1.408 0 O-C-N 120.124 -1.61 . . . . 1.0 112.984 164.729 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -171.56 -73.65 0.04 OUTLIER Glycine 0 N--CA 1.429 -1.775 0 O-C-N 120.622 -1.299 . . . . 1.0 113.518 -179.38 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 4.2 t70 -107.34 26.98 9.54 Favored 'General case' 0 N--CA 1.43 -1.45 0 CA-C-O 123.141 1.448 . . . . 1.0 107.831 174.615 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 1.7 pm0 -161.19 116.71 2.14 Favored 'General case' 0 N--CA 1.43 -1.427 0 N-CA-C 105.205 -2.146 . . . . 1.0 105.205 -168.949 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 78' ' ' TRP . . . . . . . . . . . . . 97.0 m95 -80.95 130.51 35.06 Favored 'General case' 0 N--CA 1.429 -1.505 0 N-CA-C 105.011 -2.218 . . . . 1.0 105.011 162.206 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -126.36 135.32 64.14 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.482 0 O-C-N 119.529 -1.982 . . . . 1.0 108.041 -171.325 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 30.1 m -84.38 122.14 28.52 Favored 'General case' 0 N--CA 1.43 -1.46 0 O-C-N 120.05 -1.656 . . . . 1.0 114.553 -171.275 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 13.2 t70 -84.86 55.21 3.36 Favored 'General case' 0 N--CA 1.429 -1.489 0 O-C-N 119.757 -1.84 . . . . 1.0 112.608 -177.228 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 1.1 tmt_? -148.38 81.7 1.47 Allowed 'General case' 0 N--CA 1.43 -1.428 0 O-C-N 120.36 -1.463 . . . . 1.0 107.347 179.884 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 83' ' ' SER . . . . . . . . . . . . 0.268 16.3 m 79.23 -44.69 0.34 Allowed 'General case' 0 N--CA 1.429 -1.488 0 C-N-CA 127.397 2.279 . . . . 1.0 116.754 175.117 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -159.48 103.19 0.22 Allowed Glycine 0 N--CA 1.431 -1.693 0 N-CA-C 109.128 -1.589 . . . . 1.0 109.128 -167.063 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 1.8 pm0 -87.43 105.97 17.65 Favored 'General case' 0 N--CA 1.429 -1.521 0 N-CA-C 119.424 3.12 . . . . 1.0 119.424 -153.421 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 7.3 m -160.74 122.53 3.08 Favored 'General case' 0 N--CA 1.43 -1.434 0 O-C-N 118.8 -2.438 . . . . 1.0 112.34 174.823 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 41.5 t80 -63.35 -80.17 0.03 OUTLIER 'General case' 0 N--CA 1.43 -1.46 0 N-CA-C 117.254 2.316 . . . . 1.0 117.254 -176.614 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 88' ' ' TRP . . . . . . . . . . . . . 72.6 m95 -63.21 -24.46 67.89 Favored 'General case' 0 N--CA 1.43 -1.432 0 O-C-N 120.442 -1.411 . . . . 1.0 113.892 -169.809 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 1.3 t70 -79.37 -42.76 24.86 Favored 'General case' 0 N--CA 1.428 -1.531 0 C-N-CA 125.87 1.668 . . . . 1.0 113.049 178.568 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 38.5 tp -69.49 -40.2 77.19 Favored 'General case' 0 N--CA 1.431 -1.417 0 O-C-N 119.137 -2.227 . . . . 1.0 111.135 175.514 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 21.4 tp -51.37 -41.4 60.62 Favored 'General case' 0 N--CA 1.43 -1.434 0 C-N-CA 126.926 2.09 . . . . 1.0 114.85 168.049 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 2.0 tm-20 -61.33 -46.42 90.32 Favored 'General case' 0 N--CA 1.43 -1.426 0 C-N-CA 125.627 1.571 . . . . 1.0 113.31 171.085 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 15.4 tt0 -60.96 -46.04 92.31 Favored 'General case' 0 N--CA 1.429 -1.477 0 O-C-N 120.785 -1.197 . . . . 1.0 113.09 176.209 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -58.16 -36.99 73.82 Favored 'General case' 0 N--CA 1.43 -1.425 0 C-N-CA 127.001 2.12 . . . . 1.0 114.703 172.101 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 95' ' ' ALA . . . . . 0.585 ' HB1' ' HB ' ' A' ' 103' ' ' VAL . . . -75.31 -41.34 57.14 Favored 'General case' 0 N--CA 1.428 -1.542 0 O-C-N 119.787 -1.821 . . . . 1.0 113.09 178.42 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 29.8 m -58.23 -28.5 64.92 Favored 'General case' 0 N--CA 1.429 -1.509 0 C-N-CA 126.809 2.044 . . . . 1.0 112.954 169.912 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -69.94 -55.93 8.37 Favored 'General case' 0 N--CA 1.431 -1.413 0 C-N-CA 127.706 2.402 . . . . 1.0 111.891 171.672 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 47.5 mt-30 -75.14 -40.47 59.64 Favored 'General case' 0 N--CA 1.43 -1.453 0 N-CA-C 115.829 1.788 . . . . 1.0 115.829 -175.868 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -81.24 -36.02 30.48 Favored 'General case' 0 N--CA 1.431 -1.402 0 O-C-N 120.376 -1.453 . . . . 1.0 112.619 -179.241 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . 79.44 36.0 27.89 Favored Glycine 0 N--CA 1.429 -1.824 0 O-C-N 120.972 -1.08 . . . . 1.0 111.782 -173.551 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 19.4 tt0 -170.79 145.98 2.52 Favored 'General case' 0 N--CA 1.429 -1.496 0 N-CA-C 103.93 -2.619 . . . . 1.0 103.93 -168.911 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 57.4 m -72.25 97.12 1.93 Allowed 'General case' 0 N--CA 1.429 -1.476 0 CA-C-N 120.851 1.66 . . . . 1.0 111.883 178.957 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 103' ' ' VAL . . . . . 0.585 ' HB ' ' HB1' ' A' ' 95' ' ' ALA . 85.6 t -95.91 106.7 18.65 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.434 0 N-CA-C 106.314 -1.735 . . . . 1.0 106.314 171.802 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 35.6 p -132.24 136.89 47.3 Favored 'General case' 0 N--CA 1.429 -1.497 0 C-N-CA 124.171 0.988 . . . . 1.0 109.995 -171.862 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 37.2 m-85 -93.68 -10.35 34.75 Favored 'General case' 0 N--CA 1.43 -1.429 0 C-N-CA 124.265 1.026 . . . . 1.0 112.129 178.904 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 9.7 mmm180 . . . . . 0 C--O 1.26 1.63 0 C-N-CA 124.489 1.116 . . . . 1.0 109.332 177.582 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 7.1 p30 . . . . . 0 N--CA 1.43 -1.458 0 N-CA-C 113.842 1.053 . . . . 1.0 113.842 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 35.3 t70 -55.92 -40.08 72.59 Favored 'General case' 0 N--CA 1.429 -1.479 0 C-N-CA 127.125 2.17 . . . . 1.0 113.46 -178.543 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 5.2 p -68.49 -37.94 80.55 Favored 'General case' 0 N--CA 1.43 -1.467 0 C-N-CA 126.274 1.83 . . . . 1.0 114.359 174.972 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 14.2 tp10 -67.74 -53.06 30.44 Favored 'General case' 0 N--CA 1.43 -1.435 0 C-N-CA 125.226 1.41 . . . . 1.0 110.115 177.925 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 16.3 t80 -47.25 -50.94 20.17 Favored 'General case' 0 N--CA 1.431 -1.425 0 C-N-CA 127.425 2.29 . . . . 1.0 114.821 169.657 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 35.2 m-70 -63.97 -41.43 97.56 Favored 'General case' 0 N--CA 1.43 -1.452 0 N-CA-C 114.907 1.447 . . . . 1.0 114.907 177.989 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -70.76 -37.19 73.38 Favored 'General case' 0 N--CA 1.43 -1.435 0 O-C-N 120.366 -1.459 . . . . 1.0 114.074 178.887 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 79.7 mt -59.58 -51.55 69.37 Favored 'General case' 0 N--CA 1.43 -1.444 0 C-N-CA 124.99 1.316 . . . . 1.0 111.747 168.239 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -54.06 -50.34 66.95 Favored 'General case' 0 N--CA 1.431 -1.416 0 C-N-CA 125.011 1.324 . . . . 1.0 113.458 176.991 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -51.58 -49.71 61.57 Favored 'General case' 0 N--CA 1.43 -1.425 0 N-CA-C 114.783 1.401 . . . . 1.0 114.783 173.136 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 12.2 pt20 -68.9 -33.27 73.49 Favored 'General case' 0 N--CA 1.43 -1.433 0 N-CA-C 115.583 1.697 . . . . 1.0 115.583 179.764 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 84.8 mt -66.74 -59.07 3.89 Favored 'General case' 0 N--CA 1.431 -1.419 0 O-C-N 120.087 -1.633 . . . . 1.0 111.02 174.753 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 1.2 m-90 -50.3 -50.11 51.58 Favored 'General case' 0 N--CA 1.429 -1.487 0 C-N-CA 125.65 1.58 . . . . 1.0 113.27 -179.565 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 41.0 tp -61.85 -59.05 5.71 Favored 'General case' 0 N--CA 1.43 -1.447 0 N-CA-C 113.626 0.973 . . . . 1.0 113.626 175.775 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 59.6 m -64.88 -37.42 87.58 Favored 'General case' 0 N--CA 1.431 -1.4 0 N-CA-C 114.252 1.204 . . . . 1.0 114.252 -173.621 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 93.5 mt -64.63 -54.24 32.7 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.458 0 C-N-CA 124.923 1.289 . . . . 1.0 111.686 174.83 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 1.7 tt0 -55.48 -49.66 71.94 Favored 'General case' 0 N--CA 1.43 -1.473 0 C-N-CA 123.984 0.914 . . . . 1.0 113.386 178.565 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 44.4 tt0 -54.65 -49.1 71.38 Favored 'General case' 0 N--CA 1.429 -1.493 0 C-N-CA 125.966 1.706 . . . . 1.0 114.025 174.173 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 7.4 tpm_? -58.95 -45.92 89.29 Favored 'General case' 0 N--CA 1.431 -1.406 0 O-C-N 120.726 -1.234 . . . . 1.0 114.291 179.818 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 3.8 pp -83.51 -26.97 29.71 Favored 'General case' 0 N--CA 1.431 -1.384 0 N-CA-C 115.097 1.517 . . . . 1.0 115.097 -177.387 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 8.7 t70 -62.71 -34.09 76.44 Favored 'General case' 0 CA--C 1.488 -1.405 0 O-C-N 120.336 -1.478 . . . . 1.0 113.342 163.591 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 19.2 t70 -70.59 -55.08 9.65 Favored 'General case' 0 N--CA 1.43 -1.472 0 C-N-CA 126.201 1.8 . . . . 1.0 114.559 178.405 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 24' ' ' TRP . . . . . . . . . . . . . 32.4 t-105 -73.03 138.68 46.11 Favored 'General case' 0 N--CA 1.43 -1.456 0 O-C-N 120.703 -1.248 . . . . 1.0 113.104 -172.643 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 63.3 m-20 -84.16 -141.33 0.07 Allowed 'General case' 0 N--CA 1.431 -1.408 0 O-C-N 120.327 -1.483 . . . . 1.0 112.054 177.519 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 164.3 -164.8 36.9 Favored Glycine 0 N--CA 1.431 -1.664 0 O-C-N 118.592 -2.568 . . . . 1.0 114.181 -175.221 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 37.4 t70 -86.84 -53.43 4.92 Favored 'General case' 0 N--CA 1.43 -1.463 0 C-N-CA 125.238 1.415 . . . . 1.0 107.911 169.242 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 4.5 t -82.7 -176.48 6.3 Favored 'General case' 0 N--CA 1.431 -1.414 0 C-N-CA 125.728 1.611 . . . . 1.0 109.691 178.94 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 32.9 t0 -99.85 178.63 4.76 Favored 'General case' 0 N--CA 1.43 -1.449 0 O-C-N 120.26 -1.525 . . . . 1.0 108.142 175.218 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 9.3 tp -152.26 126.58 1.41 Allowed 'Isoleucine or valine' 0 N--CA 1.43 -1.431 0 N-CA-C 106.936 -1.505 . . . . 1.0 106.936 -173.974 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 28.4 t70 -131.73 119.07 20.82 Favored 'General case' 0 N--CA 1.43 -1.439 0 CA-C-O 122.956 1.36 . . . . 1.0 109.13 163.299 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 17.3 p -86.21 131.17 34.3 Favored 'General case' 0 N--CA 1.43 -1.445 0 O-C-N 120.088 -1.632 . . . . 1.0 111.228 174.349 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 41.0 mm-40 -100.06 137.5 38.42 Favored 'General case' 0 N--CA 1.429 -1.488 0 C-N-CA 124.708 1.203 . . . . 1.0 108.916 174.651 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 3.5 tp -127.42 114.1 34.79 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.407 0 CA-C-O 124.046 1.879 . . . . 1.0 106.245 178.81 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 1.6 t-20 -125.81 179.98 4.93 Favored 'General case' 0 N--CA 1.43 -1.427 0 C-N-CA 124.805 1.242 . . . . 1.0 107.828 176.663 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -71.36 87.36 0.41 Allowed Glycine 0 N--CA 1.431 -1.653 0 O-C-N 120.566 -1.334 . . . . 1.0 115.898 -168.657 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 82.2 23.57 56.67 Favored Glycine 0 N--CA 1.429 -1.792 0 C-N-CA 125.379 1.466 . . . . 1.0 112.526 -171.889 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 61.8 t -138.84 135.05 42.92 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.475 0 CA-C-N 118.307 1.053 . . . . 1.0 109.109 -173.253 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 31.1 mt -118.07 142.01 47.86 Favored 'General case' 0 N--CA 1.43 -1.427 0 CA-C-O 122.919 1.343 . . . . 1.0 108.799 166.273 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -138.49 111.3 7.71 Favored 'General case' 0 N--CA 1.43 -1.426 0 O-C-N 120.422 -1.424 . . . . 1.0 108.436 178.032 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 70.3 mt -96.83 105.41 17.07 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.467 0 N-CA-C 107.362 -1.347 . . . . 1.0 107.362 -165.859 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 14.0 m -118.44 131.2 56.28 Favored 'General case' 0 N--CA 1.43 -1.457 0 CA-C-N 118.896 0.771 . . . . 1.0 112.994 -163.053 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 43' ' ' PHE . . . . . . . . . . . . . 1.4 m-85 -99.56 173.68 6.61 Favored 'General case' 0 N--CA 1.43 -1.431 0 O-C-N 120.608 -1.308 . . . . 1.0 111.193 -179.381 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -71.77 -19.03 62.08 Favored 'General case' 0 N--CA 1.429 -1.481 0 O-C-N 119.219 -2.175 . . . . 1.0 113.476 -179.466 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 29.0 t-20 -67.21 -17.97 65.05 Favored 'General case' 0 N--CA 1.429 -1.502 0 C-N-CA 126.811 2.044 . . . . 1.0 113.512 170.731 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 92.34 -14.9 63.5 Favored Glycine 0 N--CA 1.43 -1.74 0 O-C-N 119.962 -1.712 . . . . 1.0 113.683 179.666 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 13.8 m -77.8 167.86 20.86 Favored 'General case' 0 N--CA 1.431 -1.425 0 O-C-N 121.082 -1.246 . . . . 1.0 111.077 172.943 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 12.9 ptpt -169.93 157.68 6.82 Favored 'General case' 0 N--CA 1.43 -1.439 0 O-C-N 121.156 -0.965 . . . . 1.0 113.07 -162.668 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 5.3 mm -101.54 137.11 30.39 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.438 0 C-N-CA 125.791 1.636 . . . . 1.0 107.389 171.823 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 16.1 mm -111.17 116.85 53.61 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.437 0 C-N-CA 125.032 1.333 . . . . 1.0 109.382 -178.013 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 3.0 mt -125.43 124.76 67.68 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.506 0 O-C-N 120.717 -1.239 . . . . 1.0 110.695 179.297 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 52' ' ' ASN . . . . . 0.481 ' H ' ' HD1' ' A' ' 61' ' ' TRP . 26.6 t30 -162.52 172.93 14.7 Favored 'General case' 0 N--CA 1.43 -1.471 0 N-CA-C 103.142 -2.91 . . . . 1.0 103.142 -172.815 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 1.9 ptm180 -139.76 150.57 44.93 Favored 'General case' 0 N--CA 1.429 -1.524 0 CA-C-O 122.546 1.165 . . . . 1.0 112.337 -158.913 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 15.8 mm-40 -107.16 -108.42 0.31 Allowed 'General case' 0 N--CA 1.43 -1.448 0 C-N-CA 124.653 1.181 . . . . 1.0 109.562 -167.173 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 33.2 mm-40 -79.23 135.75 57.6 Favored Pre-proline 0 N--CA 1.43 -1.446 0 CA-C-O 117.718 -1.134 . . . . 1.0 112.799 -172.041 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 98.5 Cg_endo -73.45 62.69 4.46 Favored 'Trans proline' 0 N--CA 1.434 -1.999 0 C-N-CA 123.277 2.651 . . . . 1.0 112.319 162.997 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 57' ' ' LEU . . . . . 0.432 ' O ' ' HD2' ' A' ' 58' ' ' HIS . 73.1 mt -120.32 -103.0 0.41 Allowed 'General case' 0 N--CA 1.429 -1.493 0 N-CA-C 102.841 -3.022 . . . . 1.0 102.841 164.483 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 58' ' ' HIS . . . . . 0.432 ' HD2' ' O ' ' A' ' 57' ' ' LEU . 42.0 m170 -132.47 92.02 3.01 Favored 'General case' 0 N--CA 1.429 -1.489 0 N-CA-C 106.622 -1.622 . . . . 1.0 106.622 159.412 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 22.1 tt0 -158.68 122.05 3.84 Favored 'General case' 0 N--CA 1.429 -1.516 0 CA-C-N 121.687 2.04 . . . . 1.0 114.161 173.005 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 86.4 t -133.36 157.57 42.63 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.451 0 C-N-CA 127.031 2.132 . . . . 1.0 109.437 -179.013 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 61' ' ' TRP . . . . . 0.481 ' HD1' ' H ' ' A' ' 52' ' ' ASN . 0.0 OUTLIER -111.36 156.06 22.16 Favored 'General case' 0 N--CA 1.429 -1.505 0 C-N-CA 127.867 2.467 . . . . 1.0 109.755 -174.169 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . 0.277 2.3 pt? -150.91 134.01 16.03 Favored 'General case' 0 N--CA 1.432 -1.364 0 CA-C-N 120.686 1.584 . . . . 1.0 113.916 150.939 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -120.08 147.29 45.03 Favored 'General case' 0 N--CA 1.429 -1.514 0 C-N-CA 125.367 1.467 . . . . 1.0 114.429 -179.557 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 64' ' ' THR . . . . . . . . . . . . . 12.5 t -153.96 -149.52 0.29 Allowed 'General case' 0 N--CA 1.429 -1.509 0 C-N-CA 126.745 2.018 . . . . 1.0 112.388 -172.694 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 5.6 tmtm? -63.56 -53.57 49.64 Favored 'General case' 0 N--CA 1.43 -1.456 0 C-N-CA 130.116 3.366 . . . . 1.0 114.362 -174.404 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 31.3 tt0 -82.24 2.19 33.02 Favored 'General case' 0 N--CA 1.429 -1.492 0 CA-C-O 122.581 1.181 . . . . 1.0 111.602 -177.008 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 117.5 -72.92 0.29 Allowed Glycine 0 N--CA 1.43 -1.732 0 N-CA-C 107.343 -2.303 . . . . 1.0 107.343 -177.4 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 106.06 -173.43 19.85 Favored Glycine 0 N--CA 1.43 -1.733 0 C-N-CA 124.229 0.918 . . . . 1.0 112.486 -176.382 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -162.05 169.83 20.29 Favored 'General case' 0 N--CA 1.431 -1.423 0 N-CA-C 107.284 -1.376 . . . . 1.0 107.284 -173.008 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 19.8 p80 -79.87 159.9 26.25 Favored 'General case' 0 N--CA 1.431 -1.422 0 O-C-N 119.775 -1.828 . . . . 1.0 114.653 174.504 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 71' ' ' PHE . . . . . . . . . . . . 0.3 72.3 t80 -112.21 113.77 26.2 Favored 'General case' 0 N--CA 1.431 -1.402 0 C-N-CA 127.744 2.418 . . . . 1.0 107.019 -158.565 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 5.7 m-20 -134.12 155.1 50.66 Favored 'General case' 0 N--CA 1.43 -1.459 0 CA-C-O 121.851 0.834 . . . . 1.0 110.546 -173.99 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 8.0 tt -97.37 133.53 41.84 Favored 'General case' 0 N--CA 1.431 -1.42 0 O-C-N 119.68 -1.888 . . . . 1.0 111.869 -166.677 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 53.5 tttm -101.81 -56.39 2.29 Favored 'General case' 0 N--CA 1.43 -1.471 0 O-C-N 120.823 -1.173 . . . . 1.0 109.556 174.539 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -157.03 -96.91 0.12 Allowed Glycine 0 N--CA 1.431 -1.677 0 O-C-N 121.035 -1.041 . . . . 1.0 111.346 175.863 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 27.9 m-20 -89.72 16.31 8.17 Favored 'General case' 0 N--CA 1.429 -1.479 0 O-C-N 121.047 -1.266 . . . . 1.0 111.405 179.94 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 32.9 tt0 -166.02 132.83 2.66 Favored 'General case' 0 N--CA 1.43 -1.427 0 N-CA-C 102.046 -3.316 . . . . 1.0 102.046 -161.484 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 78' ' ' TRP . . . . . . . . . . . . . 50.2 m95 -87.75 144.88 26.39 Favored 'General case' 0 N--CA 1.432 -1.37 0 N-CA-C 106.322 -1.732 . . . . 1.0 106.322 175.186 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 9.4 pt -102.35 167.54 2.33 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.485 0 N-CA-C 106.618 -1.623 . . . . 1.0 106.618 174.083 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 1.4 m -89.79 135.65 33.5 Favored 'General case' 0 N--CA 1.429 -1.484 0 O-C-N 120.195 -1.565 . . . . 1.0 107.193 155.29 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 36.8 t70 -59.94 -38.87 83.66 Favored 'General case' 0 N--CA 1.43 -1.447 0 CA-C-N 120.689 1.586 . . . . 1.0 115.069 -174.238 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -9.85 -84.34 0.0 OUTLIER 'General case' 0 N--CA 1.43 -1.467 0 C-N-CA 131.628 3.971 . . . . 1.0 118.457 176.634 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 58.8 m -111.19 -12.79 14.09 Favored 'General case' 0 CA--C 1.489 -1.371 0 O-C-N 120.485 -1.384 . . . . 1.0 109.588 158.126 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 115.85 76.41 0.63 Allowed Glycine 0 N--CA 1.43 -1.763 0 N-CA-C 108.041 -2.023 . . . . 1.0 108.041 -173.509 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 5.2 mm-40 -100.74 -136.4 0.31 Allowed 'General case' 0 N--CA 1.431 -1.419 0 N-CA-C 109.141 -0.688 . . . . 1.0 109.141 -175.583 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 95.5 m -154.2 133.95 12.94 Favored 'General case' 0 N--CA 1.43 -1.445 0 O-C-N 120.156 -1.59 . . . . 1.0 110.402 -171.317 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 1.1 t80 -38.02 -92.13 0.0 OUTLIER 'General case' 0 CA--C 1.489 -1.375 0 C-N-CA 128.432 2.693 . . . . 1.0 115.842 168.895 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 88' ' ' TRP . . . . . . . . . . . . . 50.7 m95 -63.16 -32.69 74.14 Favored 'General case' 0 N--CA 1.431 -1.419 0 C-N-CA 125.649 1.58 . . . . 1.0 113.454 -167.195 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 35.7 t70 -77.96 -42.94 31.24 Favored 'General case' 0 N--CA 1.43 -1.456 0 C-N-CA 125.088 1.355 . . . . 1.0 113.027 -175.898 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 35.0 tp -75.3 -38.9 60.08 Favored 'General case' 0 N--CA 1.43 -1.46 0 O-C-N 119.427 -2.045 . . . . 1.0 111.332 179.335 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 41.9 tp -54.78 -38.64 67.51 Favored 'General case' 0 N--CA 1.43 -1.427 0 C-N-CA 126.33 1.852 . . . . 1.0 113.626 168.106 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 3.4 tm-20 -56.85 -59.9 4.35 Favored 'General case' 0 N--CA 1.429 -1.506 0 C-N-CA 124.611 1.164 . . . . 1.0 112.043 165.875 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 35.9 mt-30 -51.92 -41.81 62.29 Favored 'General case' 0 N--CA 1.43 -1.425 0 N-CA-C 116.28 1.956 . . . . 1.0 116.28 177.394 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -59.19 -58.39 8.84 Favored 'General case' 0 N--CA 1.43 -1.473 0 C-N-CA 126.523 1.929 . . . . 1.0 113.906 172.424 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -62.77 -49.11 76.3 Favored 'General case' 0 N--CA 1.429 -1.507 0 O-C-N 120.41 -1.431 . . . . 1.0 113.446 179.783 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 66.1 m -48.18 -47.55 35.11 Favored 'General case' 0 N--CA 1.43 -1.437 0 C-N-CA 127.859 2.464 . . . . 1.0 114.913 170.501 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 6.6 pt20 -73.4 -30.93 63.59 Favored 'General case' 0 N--CA 1.43 -1.441 0 O-C-N 120.306 -1.496 . . . . 1.0 114.428 -179.222 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 49.7 mt-30 -81.03 -37.93 28.3 Favored 'General case' 0 N--CA 1.431 -1.379 0 O-C-N 120.323 -1.486 . . . . 1.0 113.868 174.715 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -79.42 -42.76 24.73 Favored 'General case' 0 N--CA 1.43 -1.456 0 O-C-N 120.32 -1.488 . . . . 1.0 114.98 -179.686 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . 106.98 17.75 11.35 Favored Glycine 0 N--CA 1.431 -1.695 0 O-C-N 120.683 -1.261 . . . . 1.0 115.762 175.408 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 4.9 tt0 -162.41 152.78 16.81 Favored 'General case' 0 N--CA 1.43 -1.455 0 N-CA-C 104.946 -2.242 . . . . 1.0 104.946 179.527 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 35.1 m -53.48 108.31 0.33 Allowed 'General case' 0 N--CA 1.43 -1.463 0 C-N-CA 125.238 1.415 . . . . 1.0 114.571 175.317 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 49.0 t -89.43 110.49 21.69 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.414 0 CA-C-O 123.258 1.504 . . . . 1.0 108.244 176.892 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 61.5 m -94.19 98.98 11.33 Favored 'General case' 0 N--CA 1.43 -1.46 0 N-CA-C 113.615 0.968 . . . . 1.0 113.615 -162.525 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 88.5 m-85 -89.17 -32.91 17.24 Favored 'General case' 0 N--CA 1.429 -1.485 0 O-C-N 120.961 -1.087 . . . . 1.0 112.884 176.738 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 30.7 mmt180 . . . . . 0 C--O 1.26 1.647 0 N-CA-C 107.3 -1.37 . . . . 1.0 107.3 172.78 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 62.2 t30 . . . . . 0 N--CA 1.43 -1.438 0 CA-C-O 121.068 0.461 . . . . 0.0 109.979 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 31.1 t70 -64.61 -54.92 24.39 Favored 'General case' 0 N--CA 1.429 -1.48 0 C-N-CA 126.701 2.0 . . . . 0.0 113.678 -175.513 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 9.5 t -65.71 -35.25 80.21 Favored 'General case' 0 N--CA 1.429 -1.479 0 O-C-N 120.066 -1.646 . . . . 0.0 112.696 178.392 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 6.6 tp10 -60.51 -54.93 39.61 Favored 'General case' 0 N--CA 1.431 -1.424 0 C-N-CA 125.433 1.493 . . . . 0.0 112.446 175.616 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 23.2 t80 -46.12 -50.46 15.4 Favored 'General case' 0 N--CA 1.428 -1.54 0 C-N-CA 126.504 1.922 . . . . 0.0 115.2 168.89 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 34.1 t60 -67.56 -46.01 73.96 Favored 'General case' 0 N--CA 1.429 -1.5 0 O-C-N 121.189 -0.944 . . . . 0.0 113.125 179.775 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 51.1 ttt180 -63.04 -45.82 90.43 Favored 'General case' 0 N--CA 1.431 -1.384 0 O-C-N 120.872 -1.142 . . . . 0.0 113.268 -178.224 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 76.8 mt -58.66 -48.08 82.29 Favored 'General case' 0 N--CA 1.429 -1.476 0 C-N-CA 124.818 1.247 . . . . 0.0 112.774 172.959 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -58.94 -48.75 80.38 Favored 'General case' 0 N--CA 1.432 -1.368 0 C-N-CA 124.549 1.14 . . . . 0.0 113.712 178.402 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -62.7 -36.45 82.97 Favored 'General case' 0 N--CA 1.431 -1.4 0 C-N-CA 124.776 1.23 . . . . 0.0 114.148 175.967 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 27.1 mm-40 -64.72 -47.93 76.49 Favored 'General case' 0 N--CA 1.43 -1.45 0 O-C-N 120.491 -1.381 . . . . 0.0 114.435 174.218 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 2.9 pp -69.1 -40.34 78.44 Favored 'General case' 0 N--CA 1.43 -1.458 0 O-C-N 120.12 -1.613 . . . . 0.0 113.884 175.969 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 0.3 OUTLIER -40.76 -58.87 1.54 Allowed 'General case' 0 N--CA 1.43 -1.442 0 C-N-CA 127.445 2.298 . . . . 0.0 113.8 164.584 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 41.4 tp -63.89 -43.05 97.16 Favored 'General case' 0 N--CA 1.43 -1.468 0 C-N-CA 126.137 1.775 . . . . 0.0 113.515 -178.462 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 58.5 m -61.03 -49.7 76.32 Favored 'General case' 0 N--CA 1.431 -1.408 0 C-N-CA 125.043 1.337 . . . . 0.0 113.269 175.192 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 93.8 mt -55.99 -54.02 31.79 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.447 0 C-N-CA 126.037 1.735 . . . . 0.0 112.943 173.899 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 2.3 tm-20 -56.5 -55.11 37.82 Favored 'General case' 0 N--CA 1.429 -1.485 0 C-N-CA 124.912 1.285 . . . . 0.0 113.213 -178.042 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 34.3 mt-10 -68.13 -35.2 77.72 Favored 'General case' 0 N--CA 1.43 -1.441 0 N-CA-C 116.099 1.889 . . . . 0.0 116.099 -179.382 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 22.7 tpp180 -65.11 -40.06 93.99 Favored 'General case' 0 N--CA 1.43 -1.45 0 O-C-N 119.839 -1.788 . . . . 0.0 112.503 175.743 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 69.1 mt -74.65 -43.1 57.03 Favored 'General case' 0 N--CA 1.431 -1.397 0 N-CA-C 114.354 1.242 . . . . 0.0 114.354 176.91 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 12.5 t70 -54.42 -31.98 56.37 Favored 'General case' 0 N--CA 1.431 -1.415 0 C-N-CA 125.414 1.485 . . . . 0.0 113.697 171.792 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 32.9 t70 -78.51 -15.08 59.0 Favored 'General case' 0 N--CA 1.431 -1.401 0 O-C-N 119.642 -1.911 . . . . 0.0 116.085 174.33 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 24' ' ' TRP . . . . . . . . . . . . . 14.5 t-105 -90.77 121.42 32.63 Favored 'General case' 0 N--CA 1.43 -1.446 0 O-C-N 118.962 -2.336 . . . . 0.0 112.872 -170.347 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 6.5 t70 -120.76 171.77 8.36 Favored 'General case' 0 N--CA 1.43 -1.454 0 O-C-N 119.987 -1.696 . . . . 0.0 110.744 -175.099 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 171.89 -135.42 3.4 Favored Glycine 0 N--CA 1.43 -1.751 0 O-C-N 119.987 -1.695 . . . . 0.0 114.123 -174.971 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 31.5 t0 -84.39 -39.25 19.27 Favored 'General case' 0 N--CA 1.431 -1.39 0 C-N-CA 125.576 1.55 . . . . 0.0 108.667 177.741 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 68.3 m -101.88 143.39 31.83 Favored 'General case' 0 N--CA 1.431 -1.405 0 C-N-CA 124.714 1.206 . . . . 0.0 111.568 -178.363 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 31.2 t0 -86.03 160.12 19.4 Favored 'General case' 0 N--CA 1.43 -1.445 0 O-C-N 121.295 -0.878 . . . . 0.0 109.428 174.554 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -157.35 114.92 0.22 Allowed 'Isoleucine or valine' 0 N--CA 1.43 -1.46 0 CA-C-O 123.067 1.413 . . . . 0.0 107.932 -168.048 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 11.4 m-20 -123.17 131.41 53.67 Favored 'General case' 0 N--CA 1.429 -1.501 0 N-CA-C 107.042 -1.466 . . . . 0.0 107.042 171.334 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 71.3 m -92.64 148.48 22.03 Favored 'General case' 0 N--CA 1.429 -1.503 0 O-C-N 119.471 -2.018 . . . . 0.0 110.431 171.053 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 50.6 mt-10 -102.5 138.12 39.83 Favored 'General case' 0 N--CA 1.43 -1.455 0 C-N-CA 125.54 1.536 . . . . 0.0 109.329 -176.753 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 3.7 mp -124.8 109.08 21.44 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.416 0 CA-C-O 123.745 1.736 . . . . 0.0 107.472 -176.644 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 47.5 t30 -130.73 71.14 1.46 Allowed 'General case' 0 N--CA 1.43 -1.439 0 C-N-CA 125.812 1.645 . . . . 0.0 110.486 179.981 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . 72.27 -101.42 1.05 Allowed Glycine 0 N--CA 1.43 -1.733 0 O-C-N 119.784 -1.822 . . . . 0.0 114.572 174.571 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -105.9 24.55 26.47 Favored Glycine 0 N--CA 1.43 -1.75 0 O-C-N 121.607 -0.937 . . . . 0.0 111.366 173.489 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 95.9 t -122.04 124.71 71.85 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.43 0 C-N-CA 125.539 1.536 . . . . 0.0 107.775 174.532 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 58.3 mt -111.62 140.75 45.98 Favored 'General case' 0 N--CA 1.429 -1.503 0 N-CA-C 107.604 -1.258 . . . . 0.0 107.604 161.83 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 1.2 m -134.57 125.07 26.52 Favored 'General case' 0 N--CA 1.431 -1.38 0 O-C-N 120.292 -1.505 . . . . 0.0 107.979 175.883 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 36.4 mt -96.32 116.62 38.74 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.437 0 N-CA-C 107.236 -1.394 . . . . 0.0 107.236 -175.601 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 86.4 m -127.6 111.61 13.94 Favored 'General case' 0 N--CA 1.43 -1.434 0 CA-C-O 123.713 1.721 . . . . 0.0 113.107 -169.292 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 43' ' ' PHE . . . . . . . . . . . . . 7.5 p90 -120.31 160.14 23.61 Favored 'General case' 0 N--CA 1.43 -1.461 0 C-N-CA 126.546 1.938 . . . . 0.0 112.209 178.938 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 25.8 mt-10 -52.88 -25.55 12.03 Favored 'General case' 0 N--CA 1.431 -1.421 0 N-CA-C 119.402 3.112 . . . . 0.0 119.402 -165.605 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 2.2 t-20 -66.77 -9.19 34.31 Favored 'General case' 0 N--CA 1.429 -1.495 0 C-N-CA 124.625 1.17 . . . . 0.0 113.998 177.686 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 94.56 25.2 16.21 Favored Glycine 0 N--CA 1.43 -1.747 0 O-C-N 120.506 -1.371 . . . . 0.0 110.712 177.107 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 18.3 m -89.52 163.88 15.03 Favored 'General case' 0 N--CA 1.429 -1.479 0 C-N-CA 125.523 1.529 . . . . 0.0 113.298 -170.528 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 36.5 ttmt -151.58 99.37 2.6 Favored 'General case' 0 N--CA 1.431 -1.401 0 O-C-N 121.549 -0.719 . . . . 0.0 111.237 -170.697 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 4.1 mm -101.58 107.91 22.5 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.457 0 N-CA-C 105.028 -2.212 . . . . 0.0 105.028 174.737 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 50' ' ' ILE . . . . . 0.42 HG23 ' HB3' ' A' ' 63' ' ' ALA . 3.4 tp -111.49 120.88 62.99 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.478 0 CA-C-O 123.438 1.59 . . . . 0.0 109.246 -169.824 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 2.4 mt -124.26 120.98 60.71 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.474 0 C-N-CA 125.653 1.581 . . . . 0.0 109.766 -173.994 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 7.5 t-20 -158.42 158.8 34.87 Favored 'General case' 0 N--CA 1.431 -1.389 0 CA-C-O 123.681 1.705 . . . . 0.0 106.843 -172.184 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 37.2 ptt180 -133.25 138.25 46.4 Favored 'General case' 0 N--CA 1.43 -1.454 0 C-N-CA 126.546 1.938 . . . . 0.0 111.077 -163.813 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 13.7 pt20 -100.36 137.58 38.59 Favored 'General case' 0 N--CA 1.43 -1.429 0 CA-C-O 122.496 1.141 . . . . 0.0 108.528 176.977 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 15.5 mm-40 -59.72 -49.02 93.87 Favored Pre-proline 0 N--CA 1.428 -1.531 0 CA-C-O 116.166 -1.874 . . . . 0.0 115.916 174.618 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 88.4 Cg_endo -75.21 139.78 24.16 Favored 'Trans proline' 0 C--N 1.301 -1.972 0 CA-C-N 126.04 3.193 . . . . 0.0 112.056 165.058 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . 0.368 5.5 mp 74.65 127.38 0.04 OUTLIER 'General case' 0 N--CA 1.431 -1.387 0 CA-C-O 124.354 2.026 . . . . 0.0 115.927 -176.22 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 24.1 m80 -76.94 40.24 0.25 Allowed 'General case' 0 N--CA 1.43 -1.438 0 C-N-CA 126.712 2.005 . . . . 0.0 115.016 -177.756 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 7.1 mp0 -127.61 132.18 49.82 Favored 'General case' 0 N--CA 1.43 -1.466 0 C-N-CA 128.591 2.756 . . . . 0.0 107.851 -171.567 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 60' ' ' VAL . . . . . 0.438 ' HB ' ' CE1' ' A' ' 71' ' ' PHE . 29.4 t -113.58 154.49 14.96 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.4 0 O-C-N 119.941 -1.724 . . . . 0.0 108.368 177.745 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 61' ' ' TRP . . . . . 0.436 ' HA ' ' HA ' ' A' ' 70' ' ' HIS 0.28 0.0 OUTLIER -89.3 154.0 20.44 Favored 'General case' 0 N--CA 1.429 -1.477 0 N-CA-C 115.045 1.498 . . . . 0.0 115.045 -178.67 . . . . . . . . 4 4 . 1 . 009 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -117.77 92.31 3.8 Favored 'General case' 0 N--CA 1.43 -1.46 0 N-CA-C 104.916 -2.253 . . . . 0.0 104.916 165.842 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . 0.42 ' HB3' HG23 ' A' ' 50' ' ' ILE . . . -104.22 100.89 10.63 Favored 'General case' 0 N--CA 1.431 -1.389 0 CA-C-O 123.689 1.709 . . . . 0.0 110.972 177.534 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 64' ' ' THR . . . . . . . . . . . . . 9.2 t -149.74 172.67 14.72 Favored 'General case' 0 N--CA 1.431 -1.4 0 C-N-CA 126.259 1.824 . . . . 0.0 106.893 -171.234 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 42.4 tptt -78.88 53.36 1.37 Allowed 'General case' 0 N--CA 1.43 -1.468 0 C-N-CA 126.579 1.952 . . . . 0.0 114.77 -166.439 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 38.4 tp60 -130.33 -24.33 2.56 Favored 'General case' 0 N--CA 1.43 -1.434 0 O-C-N 119.992 -1.693 . . . . 0.0 109.363 163.5 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 132.21 112.9 1.44 Allowed Glycine 0 N--CA 1.43 -1.71 0 N-CA-C 107.227 -2.349 . . . . 0.0 107.227 -167.199 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . -71.21 120.48 8.5 Favored Glycine 0 N--CA 1.429 -1.789 0 O-C-N 120.695 -1.473 . . . . 0.0 116.105 -177.195 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 18.6 m-30 -118.11 170.79 8.57 Favored 'General case' 0 N--CA 1.43 -1.459 0 C-N-CA 126.265 1.826 . . . . 0.0 108.7 -175.993 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 70' ' ' HIS . . . . . 0.436 ' HA ' ' HA ' ' A' ' 61' ' ' TRP . 3.0 p80 -120.74 159.25 25.78 Favored 'General case' 0 N--CA 1.43 -1.465 0 O-C-N 119.226 -2.171 . . . . 0.0 110.93 165.318 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 71' ' ' PHE . . . . . 0.438 ' CE1' ' HB ' ' A' ' 60' ' ' VAL . 0.0 OUTLIER -117.66 153.66 32.94 Favored 'General case' 0 N--CA 1.429 -1.491 0 N-CA-C 117.471 2.397 . . . . 0.0 117.471 -165.43 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 -127.98 145.47 50.96 Favored 'General case' 0 N--CA 1.43 -1.433 0 C-N-CA 124.659 1.184 . . . . 0.0 110.286 178.126 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 60.0 tp -96.1 114.26 25.94 Favored 'General case' 0 N--CA 1.429 -1.477 0 O-C-N 119.883 -1.761 . . . . 0.0 111.609 -178.108 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 74.1 mmtt -82.95 -11.79 57.86 Favored 'General case' 0 N--CA 1.43 -1.451 0 C-N-CA 124.875 1.27 . . . . 0.0 113.185 174.037 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . 121.96 -61.28 0.55 Allowed Glycine 0 N--CA 1.429 -1.768 0 N-CA-C 109.137 -1.585 . . . . 0.0 109.137 178.486 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 6.2 p-10 -89.51 -20.32 23.97 Favored 'General case' 0 N--CA 1.431 -1.392 0 C-N-CA 124.909 1.284 . . . . 0.0 113.162 179.039 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 6.5 tp10 -147.76 136.48 21.86 Favored 'General case' 0 N--CA 1.43 -1.458 0 N-CA-C 107.115 -1.439 . . . . 0.0 107.115 -174.422 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 78' ' ' TRP . . . . . . . . . . . . . 95.7 m95 -80.94 111.22 17.22 Favored 'General case' 0 N--CA 1.431 -1.405 0 N-CA-C 105.927 -1.879 . . . . 0.0 105.927 159.94 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -106.08 155.7 6.96 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.473 0 N-CA-C 105.657 -1.979 . . . . 0.0 105.657 179.658 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 66.4 m -85.4 146.87 26.78 Favored 'General case' 0 N--CA 1.43 -1.457 0 O-C-N 119.597 -1.939 . . . . 0.0 111.946 -175.987 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 51.6 t0 -66.68 -52.07 48.87 Favored 'General case' 0 N--CA 1.43 -1.46 0 C-N-CA 126.011 1.724 . . . . 0.0 112.301 179.261 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 4.4 mmp_? -67.65 129.38 39.73 Favored 'General case' 0 N--CA 1.43 -1.456 0 C-N-CA 124.812 1.245 . . . . 0.0 110.916 173.756 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 71.2 m 70.94 -59.48 0.54 Allowed 'General case' 0 N--CA 1.43 -1.458 0 C-N-CA 126.84 2.056 . . . . 0.0 115.054 -179.175 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 119.99 63.39 0.26 Allowed Glycine 0 N--CA 1.431 -1.665 0 C-N-CA 126.286 1.898 . . . . 0.0 108.751 -172.589 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 15.2 mm-40 -108.64 -152.83 0.5 Allowed 'General case' 0 N--CA 1.43 -1.448 0 N-CA-C 108.092 -1.077 . . . . 0.0 108.092 -170.994 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 8.9 m -150.33 129.83 13.02 Favored 'General case' 0 N--CA 1.431 -1.413 0 O-C-N 119.428 -2.045 . . . . 0.0 109.861 -158.397 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 4.0 t80 -53.12 -81.85 0.01 OUTLIER 'General case' 0 N--CA 1.431 -1.409 0 N-CA-C 119.12 3.008 . . . . 0.0 119.12 -175.945 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 88' ' ' TRP . . . . . . . . . . . . . 84.9 m95 -67.25 -26.43 66.57 Favored 'General case' 0 N--CA 1.43 -1.429 0 O-C-N 119.841 -1.787 . . . . 0.0 113.423 -167.751 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 17.4 t70 -77.94 -36.97 48.65 Favored 'General case' 0 N--CA 1.432 -1.358 0 C-N-CA 126.171 1.788 . . . . 0.0 113.034 179.428 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 42.2 tp -70.76 -44.41 66.79 Favored 'General case' 0 N--CA 1.43 -1.449 0 O-C-N 119.862 -1.774 . . . . 0.0 111.241 173.046 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 9.0 tt -51.03 -48.17 61.53 Favored 'General case' 0 N--CA 1.431 -1.391 0 C-N-CA 127.238 2.215 . . . . 0.0 112.721 171.622 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 23.8 tt0 -53.08 -55.77 21.34 Favored 'General case' 0 N--CA 1.43 -1.438 0 C-N-CA 126.109 1.764 . . . . 0.0 113.468 168.739 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 9.1 tt0 -52.42 -52.91 51.35 Favored 'General case' 0 N--CA 1.428 -1.551 0 C-N-CA 125.424 1.49 . . . . 0.0 113.958 -178.419 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -66.62 -42.45 86.78 Favored 'General case' 0 N--CA 1.43 -1.466 0 N-CA-C 113.926 1.084 . . . . 0.0 113.926 -178.979 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -67.56 -35.82 79.77 Favored 'General case' 0 N--CA 1.43 -1.446 0 O-C-N 120.674 -1.266 . . . . 0.0 113.294 176.516 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 78.9 m -61.05 -47.07 88.07 Favored 'General case' 0 N--CA 1.431 -1.388 0 C-N-CA 125.835 1.654 . . . . 0.0 112.248 174.268 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 16.3 pt20 -78.29 -10.67 59.77 Favored 'General case' 0 N--CA 1.43 -1.456 0 N-CA-C 114.783 1.401 . . . . 0.0 114.783 177.688 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 4.0 mm-40 -76.79 -50.38 13.64 Favored 'General case' 0 N--CA 1.429 -1.495 0 O-C-N 120.261 -1.524 . . . . 0.0 112.913 163.299 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -80.15 -42.97 22.45 Favored 'General case' 0 N--CA 1.43 -1.469 0 N-CA-C 115.493 1.664 . . . . 0.0 115.493 -174.795 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . 95.51 21.43 24.33 Favored Glycine 0 N--CA 1.43 -1.753 0 C-N-CA 124.567 1.08 . . . . 0.0 112.957 -173.713 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 16.4 pt-20 -157.56 164.18 37.59 Favored 'General case' 0 N--CA 1.43 -1.438 0 N-CA-C 105.914 -1.884 . . . . 0.0 105.914 173.399 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 49.1 m -72.43 102.93 3.31 Favored 'General case' 0 N--CA 1.431 -1.4 0 CA-C-N 119.936 1.243 . . . . 0.0 113.053 -173.0 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 4.3 t -98.49 85.68 1.32 Allowed 'Isoleucine or valine' 0 N--CA 1.429 -1.475 0 CA-C-O 123.359 1.552 . . . . 0.0 109.84 -179.024 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 27.9 p -115.84 156.75 25.53 Favored 'General case' 0 N--CA 1.43 -1.454 0 C-N-CA 125.669 1.587 . . . . 0.0 114.064 -170.322 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 29.6 m-85 -102.96 -34.61 8.87 Favored 'General case' 0 N--CA 1.429 -1.493 0 C-N-CA 125.834 1.654 . . . . 0.0 110.011 165.949 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 30.7 mmt180 . . . . . 0 C--O 1.26 1.65 0 O-C-N 121.513 -0.742 . . . . 0.0 109.539 -177.643 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 33.9 p-10 . . . . . 0 N--CA 1.43 -1.465 0 N-CA-C 113.458 0.91 . . . . 1.0 113.458 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 11.2 t70 -56.15 -54.36 46.03 Favored 'General case' 0 N--CA 1.43 -1.458 0 C-N-CA 127.554 2.342 . . . . 1.0 112.862 179.297 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 62.5 m -52.92 -53.64 46.39 Favored 'General case' 0 N--CA 1.43 -1.462 0 C-N-CA 126.516 1.926 . . . . 1.0 113.994 176.237 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 5.8 mm-40 -65.17 -49.04 71.36 Favored 'General case' 0 N--CA 1.43 -1.445 0 C-N-CA 125.616 1.566 . . . . 1.0 113.601 -178.034 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 12.9 t80 -61.96 -38.25 87.81 Favored 'General case' 0 N--CA 1.43 -1.43 0 N-CA-C 114.272 1.212 . . . . 1.0 114.272 173.373 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 23.6 t60 -65.56 -37.53 86.96 Favored 'General case' 0 N--CA 1.43 -1.445 0 O-C-N 119.882 -1.761 . . . . 1.0 113.2 176.422 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 1.7 tpm_? -59.12 -54.5 46.27 Favored 'General case' 0 N--CA 1.431 -1.422 0 C-N-CA 125.565 1.546 . . . . 1.0 112.353 171.796 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 81.5 mt -57.03 -49.13 76.74 Favored 'General case' 0 N--CA 1.429 -1.506 0 C-N-CA 125.043 1.337 . . . . 1.0 113.806 174.629 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -56.67 -48.34 77.82 Favored 'General case' 0 N--CA 1.431 -1.384 0 C-N-CA 127.087 2.155 . . . . 1.0 114.511 -178.283 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -59.78 -52.57 64.89 Favored 'General case' 0 N--CA 1.429 -1.502 0 O-C-N 121.29 -0.881 . . . . 1.0 112.498 171.639 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 39.6 mt-30 -55.2 -45.9 75.86 Favored 'General case' 0 N--CA 1.43 -1.458 0 N-CA-C 117.839 2.533 . . . . 1.0 117.839 177.637 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 4.0 pp -65.67 -38.51 89.52 Favored 'General case' 0 N--CA 1.43 -1.474 0 O-C-N 120.707 -1.246 . . . . 1.0 113.669 175.679 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 0.1 OUTLIER -49.84 -56.52 10.09 Favored 'General case' 0 N--CA 1.429 -1.506 0 N-CA-C 113.988 1.107 . . . . 1.0 113.988 167.894 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 38.1 mt -56.46 -44.21 80.31 Favored 'General case' 0 N--CA 1.43 -1.431 0 CA-C-O 122.183 0.992 . . . . 1.0 113.313 178.743 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 14.9 m -57.56 -54.21 49.44 Favored 'General case' 0 N--CA 1.431 -1.411 0 C-N-CA 125.047 1.339 . . . . 1.0 113.323 178.981 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 80.9 mt -59.62 -46.86 92.79 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.416 0 C-N-CA 126.879 2.072 . . . . 1.0 113.541 177.213 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 26.1 mt-10 -52.67 -57.61 9.52 Favored 'General case' 0 N--CA 1.43 -1.469 0 C-N-CA 126.225 1.81 . . . . 1.0 112.248 176.526 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -53.45 -54.93 29.86 Favored 'General case' 0 CA--C 1.489 -1.391 0 C-N-CA 125.174 1.39 . . . . 1.0 113.545 174.421 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 3.4 tpt180 -57.9 -49.05 78.05 Favored 'General case' 0 N--CA 1.431 -1.42 0 N-CA-C 114.992 1.479 . . . . 1.0 114.992 -171.508 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -80.9 -32.82 34.63 Favored 'General case' 0 N--CA 1.43 -1.458 0 N-CA-C 114.255 1.206 . . . . 1.0 114.255 177.84 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 15.0 t70 -56.02 -49.32 74.0 Favored 'General case' 0 N--CA 1.428 -1.532 0 O-C-N 119.738 -1.851 . . . . 1.0 114.064 172.448 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 13.6 t70 -52.83 -45.41 67.31 Favored 'General case' 0 N--CA 1.43 -1.427 0 C-N-CA 128.081 2.553 . . . . 1.0 117.206 -175.356 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 24' ' ' TRP . . . . . . . . . . . . . 76.9 t-105 -43.9 -65.12 0.54 Allowed 'General case' 0 N--CA 1.43 -1.472 0 C-N-CA 127.677 2.391 . . . . 1.0 116.57 -169.594 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 40.4 t0 59.34 70.03 0.67 Allowed 'General case' 0 N--CA 1.43 -1.46 0 C-N-CA 126.653 1.981 . . . . 1.0 114.161 173.231 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -99.65 -134.29 8.44 Favored Glycine 0 N--CA 1.429 -1.818 0 CA-C-O 122.823 1.235 . . . . 1.0 113.386 -175.45 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -72.69 -34.52 67.22 Favored 'General case' 0 N--CA 1.43 -1.447 0 C-N-CA 125.024 1.329 . . . . 1.0 109.64 174.547 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 36.1 m -89.3 148.84 23.33 Favored 'General case' 0 N--CA 1.43 -1.429 0 CA-C-O 122.899 1.333 . . . . 1.0 113.033 -179.926 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 22.5 t0 -76.84 172.84 12.47 Favored 'General case' 0 N--CA 1.431 -1.381 0 C-N-CA 125.187 1.395 . . . . 1.0 110.135 170.432 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 5.4 tp -157.04 114.78 0.23 Allowed 'Isoleucine or valine' 0 N--CA 1.43 -1.464 0 CA-C-O 123.477 1.608 . . . . 1.0 108.253 -164.78 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 7.5 t0 -131.68 102.31 5.84 Favored 'General case' 0 N--CA 1.431 -1.388 0 O-C-N 120.507 -1.371 . . . . 1.0 108.806 170.767 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 27.3 p -89.58 124.45 34.56 Favored 'General case' 0 N--CA 1.431 -1.424 0 O-C-N 120.241 -1.537 . . . . 1.0 111.669 -178.697 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 5.2 mm-40 -94.34 135.13 36.09 Favored 'General case' 0 N--CA 1.429 -1.478 0 O-C-N 120.087 -1.633 . . . . 1.0 110.623 -177.191 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 1.6 tp -131.42 115.89 30.31 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.422 0 C-N-CA 126.758 2.023 . . . . 1.0 107.357 -176.929 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 4.9 t-20 -147.66 81.42 1.51 Allowed 'General case' 0 N--CA 1.431 -1.423 0 O-C-N 121.62 -0.675 . . . . 1.0 111.374 172.281 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . 68.27 -70.49 0.34 Allowed Glycine 0 N--CA 1.429 -1.808 0 C-N-CA 126.777 2.132 . . . . 1.0 118.221 167.815 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -119.5 -3.07 12.93 Favored Glycine 0 N--CA 1.43 -1.762 0 C-N-CA 126.125 1.821 . . . . 1.0 112.24 179.693 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 21.5 t -120.99 123.78 70.85 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.457 0 CA-C-N 118.538 1.169 . . . . 1.0 109.689 -177.707 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 42.1 mt -110.23 135.67 50.63 Favored 'General case' 0 N--CA 1.431 -1.408 0 O-C-N 120.286 -1.509 . . . . 1.0 108.707 163.254 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -136.91 107.51 6.54 Favored 'General case' 0 N--CA 1.431 -1.407 0 N-CA-C 107.183 -1.414 . . . . 1.0 107.183 -178.329 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 6.5 mt -100.46 114.62 39.8 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.513 0 O-C-N 119.457 -2.027 . . . . 1.0 108.664 -168.075 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 23.0 m -116.03 131.94 56.8 Favored 'General case' 0 N--CA 1.43 -1.436 0 CA-C-O 121.473 0.654 . . . . 1.0 111.265 -167.102 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 43' ' ' PHE . . . . . . . . . . . . 0.263 0.2 OUTLIER -120.55 173.03 7.42 Favored 'General case' 0 N--CA 1.429 -1.486 0 C-N-CA 124.624 1.17 . . . . 1.0 112.481 177.142 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -57.88 -33.32 68.59 Favored 'General case' 0 N--CA 1.431 -1.418 0 N-CA-C 118.256 2.687 . . . . 1.0 118.256 -160.097 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -69.46 -13.78 62.53 Favored 'General case' 0 N--CA 1.43 -1.459 0 C-N-CA 125.543 1.537 . . . . 1.0 113.283 -179.775 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 82.27 38.32 13.12 Favored Glycine 0 N--CA 1.429 -1.772 0 O-C-N 119.868 -1.77 . . . . 1.0 109.228 -168.793 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 68.8 m -120.86 151.61 39.43 Favored 'General case' 0 CA--C 1.489 -1.4 0 N-CA-C 106.145 -1.798 . . . . 1.0 106.145 179.456 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 47.6 pttt -161.3 165.64 28.82 Favored 'General case' 0 N--CA 1.431 -1.411 0 N-CA-C 113.905 1.076 . . . . 1.0 113.905 -165.54 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 5.7 mm -112.86 135.23 52.95 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.506 0 C-N-CA 127.327 2.251 . . . . 1.0 106.269 175.517 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 3.2 mm -117.88 114.46 45.42 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.466 0 C-N-CA 124.577 1.151 . . . . 1.0 108.737 -179.912 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 4.7 mt -128.08 128.25 68.62 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.5 0 CA-C-O 123.006 1.384 . . . . 1.0 111.617 -176.902 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 52' ' ' ASN . . . . . 0.459 ' H ' ' HD1' ' A' ' 61' ' ' TRP . 14.0 t-20 -160.96 174.41 13.83 Favored 'General case' 0 N--CA 1.43 -1.452 0 N-CA-C 102.809 -3.034 . . . . 1.0 102.809 -178.349 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 12.6 ptt180 -142.46 135.26 28.25 Favored 'General case' 0 CA--C 1.489 -1.374 0 N-CA-C 108.66 -0.867 . . . . 1.0 108.66 -169.263 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 55.2 mm-40 -139.46 67.02 1.39 Allowed 'General case' 0 N--CA 1.431 -1.393 0 N-CA-C 106.892 -1.522 . . . . 1.0 106.892 -171.401 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 55' ' ' GLU . . . . . 0.426 ' H ' ' HG3' ' A' ' 55' ' ' GLU . 1.0 OUTLIER -70.91 126.82 92.17 Favored Pre-proline 0 N--CA 1.43 -1.438 0 N-CA-C 117.24 2.311 . . . . 1.0 117.24 -157.655 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 49.6 Cg_endo -76.63 -55.62 0.06 OUTLIER 'Trans proline' 0 C--N 1.299 -2.069 0 C-N-CA 122.052 1.835 . . . . 1.0 109.812 150.908 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 57' ' ' LEU . . . . . 0.419 ' HB2' ' H ' ' A' ' 58' ' ' HIS . 40.8 mt -115.96 -93.23 0.5 Allowed 'General case' 0 N--CA 1.429 -1.508 0 C-N-CA 124.932 1.293 . . . . 1.0 109.307 -177.692 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 58' ' ' HIS . . . . . 0.419 ' H ' ' HB2' ' A' ' 57' ' ' LEU . 51.4 m170 -132.76 78.96 1.82 Allowed 'General case' 0 N--CA 1.43 -1.436 0 C-N-CA 126.68 1.992 . . . . 1.0 106.604 175.892 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 12.0 tt0 -138.47 140.43 39.23 Favored 'General case' 0 N--CA 1.43 -1.45 0 O-C-N 119.908 -1.745 . . . . 1.0 108.252 -170.389 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 48.9 t -119.85 154.43 22.71 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.381 0 N-CA-C 106.198 -1.778 . . . . 1.0 106.198 -177.611 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 61' ' ' TRP . . . . . 0.459 ' HD1' ' H ' ' A' ' 52' ' ' ASN . 0.0 OUTLIER -99.42 148.44 24.21 Favored 'General case' 0 N--CA 1.43 -1.45 0 O-C-N 120.555 -1.341 . . . . 1.0 110.092 178.228 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -133.55 92.21 2.95 Favored 'General case' 0 N--CA 1.429 -1.477 0 O-C-N 120.38 -1.45 . . . . 1.0 111.829 176.862 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -103.71 149.9 24.54 Favored 'General case' 0 N--CA 1.43 -1.429 0 CA-C-O 123.628 1.68 . . . . 1.0 112.011 173.712 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 64' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -151.15 -82.92 0.09 Allowed 'General case' 0 N--CA 1.43 -1.438 0 N-CA-C 107.197 -1.409 . . . . 1.0 107.197 -171.161 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 42.8 tttp -122.88 -59.03 1.63 Allowed 'General case' 0 N--CA 1.43 -1.431 0 C-N-CA 123.696 0.798 . . . . 1.0 111.881 178.432 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 51.7 tt0 -121.1 -23.35 5.83 Favored 'General case' 0 N--CA 1.431 -1.417 0 N-CA-C 112.969 0.729 . . . . 1.0 112.969 -160.066 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . -90.84 -83.79 1.41 Allowed Glycine 0 N--CA 1.431 -1.668 0 O-C-N 120.627 -1.295 . . . . 1.0 114.762 -175.958 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 74.69 51.1 8.37 Favored Glycine 0 N--CA 1.43 -1.748 0 O-C-N 121.375 -1.074 . . . . 1.0 112.845 -166.425 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 11.0 m-30 -99.44 125.78 45.22 Favored 'General case' 0 N--CA 1.429 -1.475 0 O-C-N 121.257 -1.143 . . . . 1.0 108.648 -169.358 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 12.0 p-80 -92.37 156.45 17.22 Favored 'General case' 0 N--CA 1.43 -1.459 0 O-C-N 120.214 -1.554 . . . . 1.0 112.072 179.26 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 50.9 p90 -144.13 142.9 30.85 Favored 'General case' 0 N--CA 1.43 -1.448 0 N-CA-C 115.164 1.542 . . . . 1.0 115.164 -156.381 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -119.54 155.69 31.71 Favored 'General case' 0 N--CA 1.429 -1.476 0 C-N-CA 126.834 2.054 . . . . 1.0 110.866 -172.001 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 58.5 tp -92.35 117.4 29.86 Favored 'General case' 0 N--CA 1.43 -1.426 0 O-C-N 120.318 -1.489 . . . . 1.0 111.427 178.801 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 68.3 mmtt -79.99 -45.74 17.89 Favored 'General case' 0 N--CA 1.43 -1.473 0 O-C-N 120.746 -1.221 . . . . 1.0 113.122 170.034 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -174.92 -76.18 0.05 OUTLIER Glycine 0 N--CA 1.43 -1.73 0 O-C-N 121.001 -1.062 . . . . 1.0 112.453 -179.459 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 4.0 p-10 -101.67 0.33 35.94 Favored 'General case' 0 N--CA 1.429 -1.509 0 C-N-CA 124.876 1.27 . . . . 1.0 112.149 173.675 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 20.6 pt-20 -153.44 148.8 27.08 Favored 'General case' 0 N--CA 1.431 -1.404 0 N-CA-C 106.127 -1.805 . . . . 1.0 106.127 -174.764 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 78' ' ' TRP . . . . . . . . . . . . . 27.4 m95 -97.86 135.36 39.72 Favored 'General case' 0 N--CA 1.43 -1.442 0 N-CA-C 106.982 -1.488 . . . . 1.0 106.982 177.413 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 3.1 mt -104.87 134.38 46.45 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.426 0 C-N-CA 125.502 1.521 . . . . 1.0 107.186 177.832 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 75.4 m -82.58 127.6 33.51 Favored 'General case' 0 N--CA 1.432 -1.368 0 CA-C-N 115.403 -0.817 . . . . 1.0 108.841 -179.376 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 30.1 t70 -70.08 -37.9 75.57 Favored 'General case' 0 N--CA 1.43 -1.438 0 C-N-CA 124.16 0.984 . . . . 1.0 112.827 -166.894 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -75.51 121.0 21.71 Favored 'General case' 0 N--CA 1.43 -1.461 0 O-C-N 121.234 -0.916 . . . . 1.0 110.017 176.743 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 83' ' ' SER . . . . . . . . . . . . 0.378 80.2 p 72.59 -53.2 0.7 Allowed 'General case' 0 N--CA 1.43 -1.449 0 C-N-CA 128.065 2.546 . . . . 1.0 115.954 -173.028 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 116.54 80.12 0.79 Allowed Glycine 0 N--CA 1.43 -1.719 0 N-CA-C 109.123 -1.591 . . . . 1.0 109.123 -176.375 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 4.6 mm-40 -135.11 -156.02 0.69 Allowed 'General case' 0 N--CA 1.43 -1.458 0 N-CA-C 105.467 -2.049 . . . . 1.0 105.467 -172.158 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 18.8 m -145.71 137.64 25.31 Favored 'General case' 0 N--CA 1.431 -1.413 0 O-C-N 119.866 -1.771 . . . . 1.0 109.087 -154.267 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 1.3 t80 -30.72 -91.23 0.0 OUTLIER 'General case' 0 N--CA 1.43 -1.447 0 C-N-CA 128.702 2.801 . . . . 1.0 118.309 176.551 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 88' ' ' TRP . . . . . . . . . . . . . 56.0 m95 -73.72 -28.09 61.53 Favored 'General case' 0 N--CA 1.43 -1.463 0 O-C-N 120.794 -1.191 . . . . 1.0 111.499 -169.653 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 59.3 m-20 -74.75 -38.82 62.13 Favored 'General case' 0 N--CA 1.429 -1.506 0 C-N-CA 124.603 1.161 . . . . 1.0 114.06 -178.636 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 58.2 tp -69.64 -45.5 68.32 Favored 'General case' 0 N--CA 1.43 -1.435 0 O-C-N 119.611 -1.931 . . . . 1.0 109.79 174.338 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 60.9 tp -50.93 -44.84 60.36 Favored 'General case' 0 N--CA 1.43 -1.469 0 C-N-CA 125.678 1.591 . . . . 1.0 114.35 170.278 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 2.9 tm-20 -55.78 -49.04 74.24 Favored 'General case' 0 N--CA 1.431 -1.384 0 C-N-CA 126.495 1.918 . . . . 1.0 113.505 172.193 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 1.8 tm0? -61.27 -50.92 71.08 Favored 'General case' 0 N--CA 1.429 -1.499 0 N-CA-C 114.253 1.205 . . . . 1.0 114.253 176.288 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -54.43 -44.26 72.29 Favored 'General case' 0 N--CA 1.431 -1.41 0 C-N-CA 128.019 2.528 . . . . 1.0 115.256 174.544 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -72.97 -45.82 55.82 Favored 'General case' 0 N--CA 1.431 -1.418 0 O-C-N 120.299 -1.5 . . . . 1.0 113.868 178.203 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 91.9 m -50.52 -45.77 56.85 Favored 'General case' 0 N--CA 1.428 -1.549 0 C-N-CA 127.125 2.17 . . . . 1.0 112.891 168.997 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 2.7 tp60 -57.28 -54.75 43.29 Favored 'General case' 0 N--CA 1.432 -1.371 0 C-N-CA 126.31 1.844 . . . . 1.0 113.188 172.795 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 10.1 mm100 -58.41 -45.18 88.91 Favored 'General case' 0 N--CA 1.43 -1.449 0 N-CA-C 116.345 1.98 . . . . 1.0 116.345 176.648 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -78.51 -43.21 27.43 Favored 'General case' 0 N--CA 1.429 -1.481 0 O-C-N 120.302 -1.499 . . . . 1.0 113.402 -178.926 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . 97.27 13.69 44.45 Favored Glycine 0 N--CA 1.431 -1.699 0 C-N-CA 125.085 1.326 . . . . 1.0 111.7 -172.98 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 8.0 tt0 -157.13 144.99 19.12 Favored 'General case' 0 N--CA 1.43 -1.455 0 N-CA-C 106.226 -1.768 . . . . 1.0 106.226 -174.665 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 57.0 m -58.86 119.2 6.74 Favored 'General case' 0 N--CA 1.429 -1.515 0 C-N-CA 125.078 1.351 . . . . 1.0 114.51 -178.726 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 92.2 t -96.19 130.42 44.88 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.45 0 C-N-CA 125.53 1.532 . . . . 1.0 108.816 -179.025 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 7.5 t -93.2 96.76 10.21 Favored 'General case' 0 N--CA 1.429 -1.487 0 C-N-CA 125.449 1.5 . . . . 1.0 114.448 -170.346 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 14.9 m-85 -118.23 -18.97 9.16 Favored 'General case' 0 N--CA 1.431 -1.421 0 C-N-CA 124.87 1.268 . . . . 1.0 111.278 172.17 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.26 1.658 0 O-C-N 120.965 -1.085 . . . . 1.0 113.849 -168.911 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 2' ' ' ASN . . . . . 0.448 ' N ' ' HE2' ' A' ' 58' ' ' HIS . 80.6 m-20 . . . . . 0 N--CA 1.431 -1.413 0 CA-C-O 121.814 0.816 . . . . 1.0 111.081 . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 9.0 t70 -68.5 -42.31 78.79 Favored 'General case' 0 N--CA 1.429 -1.52 0 C-N-CA 124.635 1.174 . . . . 1.0 114.08 -172.328 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 15.9 t -64.17 -43.63 94.53 Favored 'General case' 0 N--CA 1.429 -1.478 0 O-C-N 120.473 -1.392 . . . . 1.0 112.904 175.846 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 9.4 mm-40 -55.02 -58.32 8.12 Favored 'General case' 0 N--CA 1.43 -1.433 0 C-N-CA 124.893 1.277 . . . . 1.0 113.168 172.908 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 31.3 t80 -50.59 -57.65 7.68 Favored 'General case' 0 N--CA 1.43 -1.426 0 N-CA-C 114.625 1.343 . . . . 1.0 114.625 172.873 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 37.4 m80 -65.07 -38.98 92.54 Favored 'General case' 0 N--CA 1.43 -1.436 0 N-CA-C 115.759 1.763 . . . . 1.0 115.759 -175.588 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 47.6 mtt-85 -62.79 -53.5 53.29 Favored 'General case' 0 N--CA 1.43 -1.432 0 CA-C-N 120.239 1.381 . . . . 1.0 112.972 172.14 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 98.2 mt -62.11 -42.86 99.65 Favored 'General case' 0 N--CA 1.43 -1.465 0 O-C-N 120.752 -1.217 . . . . 1.0 113.571 -178.394 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -62.78 -36.27 82.54 Favored 'General case' 0 N--CA 1.431 -1.424 0 N-CA-C 114.424 1.268 . . . . 1.0 114.424 174.965 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 10.8 t70 -61.17 -45.18 95.66 Favored 'General case' 0 N--CA 1.429 -1.491 0 O-C-N 120.569 -1.332 . . . . 1.0 111.762 172.741 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 29.4 mm100 -57.19 -39.85 76.2 Favored 'General case' 0 N--CA 1.429 -1.49 0 N-CA-C 115.019 1.488 . . . . 1.0 115.019 173.759 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 28.5 mt -59.78 -52.49 65.24 Favored 'General case' 0 N--CA 1.43 -1.452 0 O-C-N 120.312 -1.493 . . . . 1.0 112.942 171.436 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 0.7 OUTLIER -42.67 -56.11 3.28 Favored 'General case' 0 N--CA 1.43 -1.466 0 C-N-CA 127.028 2.131 . . . . 1.0 114.305 174.606 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 44.1 mt -60.32 -48.8 80.19 Favored 'General case' 0 N--CA 1.429 -1.51 0 C-N-CA 124.437 1.095 . . . . 1.0 113.701 176.279 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 24.1 m -64.67 -45.88 84.84 Favored 'General case' 0 N--CA 1.43 -1.43 0 C-N-CA 124.831 1.253 . . . . 1.0 113.539 -175.132 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 65.7 mt -59.53 -51.23 75.17 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.499 0 C-N-CA 126.018 1.727 . . . . 1.0 111.024 175.821 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 4.8 tt0 -55.62 -51.2 67.99 Favored 'General case' 0 N--CA 1.43 -1.438 0 N-CA-C 112.972 0.731 . . . . 1.0 112.972 176.064 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 13.0 tt0 -60.49 -44.75 95.61 Favored 'General case' 0 N--CA 1.429 -1.522 0 N-CA-C 115.3 1.592 . . . . 1.0 115.3 -178.493 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -67.54 -39.14 85.01 Favored 'General case' 0 N--CA 1.431 -1.42 0 O-C-N 119.925 -1.734 . . . . 1.0 112.465 178.113 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 15.2 mt -62.1 -57.11 12.78 Favored 'General case' 0 N--CA 1.431 -1.393 0 N-CA-C 114.628 1.344 . . . . 1.0 114.628 170.724 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 7.6 t70 -52.92 -37.99 61.35 Favored 'General case' 0 N--CA 1.432 -1.368 0 C-N-CA 127.092 2.157 . . . . 1.0 114.962 179.441 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 29.0 t70 -74.96 -0.42 18.66 Favored 'General case' 0 N--CA 1.429 -1.485 0 O-C-N 120.102 -1.624 . . . . 1.0 115.109 179.81 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 24' ' ' TRP . . . . . . . . . . . . . 68.4 t-105 -75.27 129.38 37.34 Favored 'General case' 0 N--CA 1.431 -1.385 0 O-C-N 118.433 -2.667 . . . . 1.0 112.496 172.237 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 34.3 m-20 -117.74 136.5 53.33 Favored 'General case' 0 N--CA 1.43 -1.465 0 N-CA-C 106.788 -1.56 . . . . 1.0 106.788 167.814 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -172.31 -149.01 6.46 Favored Glycine 0 N--CA 1.431 -1.672 0 N-CA-C 110.043 -1.223 . . . . 1.0 110.043 178.724 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 1.5 t70 -79.36 -28.8 41.98 Favored 'General case' 0 N--CA 1.43 -1.462 0 CA-C-O 122.293 1.044 . . . . 1.0 110.694 179.867 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 96.1 p -86.31 -164.41 1.04 Allowed 'General case' 0 N--CA 1.43 -1.465 0 C-N-CA 127.873 2.469 . . . . 1.0 113.749 -179.677 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 3.4 t70 -142.29 179.09 7.13 Favored 'General case' 0 N--CA 1.43 -1.444 0 O-C-N 120.313 -1.492 . . . . 1.0 109.851 176.21 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 7.4 tp -162.77 113.82 0.09 OUTLIER 'Isoleucine or valine' 0 N--CA 1.431 -1.411 0 CA-C-O 123.247 1.498 . . . . 1.0 110.626 -175.149 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -121.36 107.27 12.3 Favored 'General case' 0 N--CA 1.43 -1.458 0 O-C-N 120.363 -1.46 . . . . 1.0 108.991 169.593 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 91.2 m -87.03 139.02 30.99 Favored 'General case' 0 N--CA 1.43 -1.425 0 O-C-N 119.588 -1.945 . . . . 1.0 109.224 164.752 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -105.93 140.13 39.41 Favored 'General case' 0 N--CA 1.43 -1.429 0 C-N-CA 126.083 1.753 . . . . 1.0 110.85 -171.249 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 5.0 mm -115.32 106.85 21.35 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.453 0 C-N-CA 125.333 1.453 . . . . 1.0 107.796 -170.758 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 69.2 m-80 -128.36 -179.37 4.99 Favored 'General case' 0 N--CA 1.429 -1.481 0 O-C-N 120.465 -1.397 . . . . 1.0 110.636 176.069 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -73.22 94.86 0.73 Allowed Glycine 0 N--CA 1.431 -1.666 0 O-C-N 120.112 -1.618 . . . . 1.0 114.326 -167.174 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 78.19 25.33 61.89 Favored Glycine 0 N--CA 1.43 -1.741 0 C-N-CA 125.855 1.693 . . . . 1.0 112.675 -173.067 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 54.8 t -139.82 129.37 28.95 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.454 0 C-N-CA 124.176 0.99 . . . . 1.0 110.45 -167.139 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 14.4 mt -111.69 132.41 54.63 Favored 'General case' 0 N--CA 1.43 -1.445 0 N-CA-C 108.159 -1.052 . . . . 1.0 108.159 154.814 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 2.7 m -124.99 119.89 30.02 Favored 'General case' 0 N--CA 1.429 -1.481 0 N-CA-C 106.989 -1.486 . . . . 1.0 106.989 178.644 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 73.7 mt -93.92 120.53 43.47 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.437 0 O-C-N 120.767 -1.208 . . . . 1.0 108.206 -168.919 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 43.4 p -126.64 129.11 47.85 Favored 'General case' 0 N--CA 1.43 -1.438 0 CA-C-O 122.183 0.992 . . . . 1.0 111.619 178.577 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 43' ' ' PHE . . . . . . . . . . . . . 7.2 p90 -120.28 168.41 11.29 Favored 'General case' 0 N--CA 1.431 -1.424 0 O-C-N 120.372 -1.455 . . . . 1.0 109.57 172.563 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -64.52 -28.88 69.95 Favored 'General case' 0 N--CA 1.431 -1.423 0 N-CA-C 116.16 1.911 . . . . 1.0 116.16 -166.981 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 15.8 m-80 -66.82 -4.94 10.4 Favored 'General case' 0 N--CA 1.43 -1.461 0 C-N-CA 126.068 1.747 . . . . 1.0 114.824 173.181 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 103.23 15.74 22.69 Favored Glycine 0 N--CA 1.43 -1.717 0 O-C-N 120.063 -1.648 . . . . 1.0 116.894 158.874 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 3.2 t -91.86 -175.77 4.23 Favored 'General case' 0 N--CA 1.431 -1.404 0 CA-C-N 118.54 1.17 . . . . 1.0 113.639 -178.072 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -160.81 99.44 1.24 Allowed 'General case' 0 N--CA 1.43 -1.461 0 CA-C-O 122.967 1.365 . . . . 1.0 110.938 -174.401 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -107.58 119.95 58.08 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.443 0 N-CA-C 105.798 -1.927 . . . . 1.0 105.798 -174.468 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 3.7 tp -112.95 128.65 69.58 Favored 'Isoleucine or valine' 0 CA--C 1.488 -1.408 0 O-C-N 119.611 -1.931 . . . . 1.0 111.789 -165.897 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 4.1 mt -124.99 127.59 72.5 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.489 0 C-N-CA 126.749 2.02 . . . . 1.0 110.558 -179.173 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 52' ' ' ASN . . . . . 0.487 ' H ' ' HD1' ' A' ' 61' ' ' TRP . 6.8 t-20 -162.47 169.71 19.92 Favored 'General case' 0 N--CA 1.431 -1.416 0 N-CA-C 105.347 -2.094 . . . . 1.0 105.347 -165.706 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 34.4 ttp180 -155.03 136.17 13.91 Favored 'General case' 0 N--CA 1.431 -1.418 0 O-C-N 120.761 -1.212 . . . . 1.0 110.754 -156.651 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 4.7 mm100 -97.26 127.59 43.35 Favored 'General case' 0 N--CA 1.429 -1.512 0 N-CA-C 107.115 -1.439 . . . . 1.0 107.115 177.673 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 87.4 mt-10 -58.58 -37.62 56.32 Favored Pre-proline 0 N--CA 1.429 -1.502 0 CA-C-O 114.812 -2.518 . . . . 1.0 117.004 167.132 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 68.5 Cg_endo -79.33 155.85 25.34 Favored 'Trans proline' 0 N--CA 1.434 -2.025 0 CA-C-N 127.694 3.783 . . . . 1.0 111.793 161.379 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . 0.361 5.5 mp 67.06 134.94 0.02 OUTLIER 'General case' 0 N--CA 1.431 -1.411 0 CA-C-O 124.553 2.12 . . . . 1.0 115.95 -174.213 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 58' ' ' HIS . . . . . 0.448 ' HE2' ' N ' ' A' ' 2' ' ' ASN . 22.0 m170 -76.15 41.72 0.24 Allowed 'General case' 0 N--CA 1.429 -1.51 0 C-N-CA 126.416 1.886 . . . . 1.0 114.869 -176.23 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 2.1 pt20 -146.91 158.34 43.89 Favored 'General case' 0 N--CA 1.431 -1.379 0 O-C-N 119.402 -2.061 . . . . 1.0 110.073 -171.657 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 93.0 t -118.28 162.28 16.48 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.402 0 N-CA-C 107.03 -1.47 . . . . 1.0 107.03 -177.305 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 61' ' ' TRP . . . . . 0.487 ' HD1' ' H ' ' A' ' 52' ' ' ASN . 0.0 OUTLIER -104.17 153.24 21.19 Favored 'General case' 0 N--CA 1.43 -1.453 0 O-C-N 119.654 -1.904 . . . . 1.0 109.907 178.963 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 2.0 pt? -143.68 126.39 16.08 Favored 'General case' 0 N--CA 1.431 -1.408 0 O-C-N 120.24 -1.538 . . . . 1.0 108.564 158.897 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -120.18 146.79 45.67 Favored 'General case' 0 N--CA 1.429 -1.499 0 CA-C-O 122.46 1.124 . . . . 1.0 112.486 176.09 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 64' ' ' THR . . . . . . . . . . . . . 72.0 p -136.52 -148.99 0.3 Allowed 'General case' 0 N--CA 1.429 -1.513 0 C-N-CA 125.702 1.601 . . . . 1.0 110.503 -152.206 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 12.2 tmtt? -60.7 -67.5 0.39 Allowed 'General case' 0 N--CA 1.429 -1.498 0 C-N-CA 126.654 1.982 . . . . 1.0 112.675 173.817 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 13.1 tt0 -131.0 -22.04 2.62 Favored 'General case' 0 N--CA 1.43 -1.433 0 O-C-N 121.098 -1.001 . . . . 1.0 113.458 176.97 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . -82.98 -99.29 0.52 Allowed Glycine 0 N--CA 1.43 -1.719 0 O-C-N 119.838 -1.789 . . . . 1.0 114.033 -176.397 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 69.3 149.01 0.29 Allowed Glycine 0 N--CA 1.43 -1.72 0 N-CA-C 116.261 1.264 . . . . 1.0 116.261 -171.951 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 1.4 t80 -166.44 169.19 14.16 Favored 'General case' 0 N--CA 1.43 -1.448 0 N-CA-C 107.408 -1.33 . . . . 1.0 107.408 168.262 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 3.7 p-80 -95.23 159.29 15.08 Favored 'General case' 0 N--CA 1.429 -1.492 0 O-C-N 120.17 -1.582 . . . . 1.0 111.811 172.817 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 43.5 p90 -138.48 133.49 32.78 Favored 'General case' 0 N--CA 1.43 -1.471 0 N-CA-C 114.817 1.414 . . . . 1.0 114.817 -158.825 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 43.0 m-20 -105.43 176.28 5.22 Favored 'General case' 0 N--CA 1.431 -1.422 0 C-N-CA 126.361 1.865 . . . . 1.0 109.445 -176.403 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 45.8 tp -110.6 125.46 53.43 Favored 'General case' 0 N--CA 1.431 -1.397 0 O-C-N 119.588 -1.945 . . . . 1.0 110.551 177.974 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 94.5 mttt -73.91 -99.13 0.01 OUTLIER 'General case' 0 N--CA 1.43 -1.472 0 O-C-N 120.645 -1.285 . . . . 1.0 112.238 154.3 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -131.46 -57.51 0.09 OUTLIER Glycine 0 N--CA 1.43 -1.74 0 O-C-N 120.165 -1.584 . . . . 1.0 113.544 -174.547 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 48.6 m-20 -111.34 3.63 18.41 Favored 'General case' 0 N--CA 1.43 -1.469 0 C-N-CA 125.724 1.609 . . . . 1.0 109.99 178.535 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -147.91 120.89 8.79 Favored 'General case' 0 N--CA 1.429 -1.522 0 N-CA-C 105.484 -2.043 . . . . 1.0 105.484 -162.038 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 78' ' ' TRP . . . . . . . . . . . . . 71.5 m95 -84.41 124.39 31.27 Favored 'General case' 0 N--CA 1.431 -1.406 0 N-CA-C 104.099 -2.556 . . . . 1.0 104.099 168.435 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 79' ' ' ILE . . . . . 0.404 ' HB ' ' HB2' ' A' ' 85' ' ' GLU . 0.1 OUTLIER -126.01 139.17 52.29 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.474 0 O-C-N 119.92 -1.738 . . . . 1.0 110.304 -166.589 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 79.9 m -78.09 134.79 37.67 Favored 'General case' 0 N--CA 1.429 -1.488 0 O-C-N 119.837 -1.789 . . . . 1.0 113.306 -174.767 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 25.7 t0 -81.86 55.07 2.62 Favored 'General case' 0 N--CA 1.431 -1.413 0 O-C-N 120.145 -1.597 . . . . 1.0 113.532 -174.401 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -149.82 -152.1 0.42 Allowed 'General case' 0 N--CA 1.43 -1.466 0 O-C-N 120.126 -1.609 . . . . 1.0 108.381 -175.7 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 58.2 p -72.62 -19.74 61.4 Favored 'General case' 0 N--CA 1.43 -1.451 0 O-C-N 119.909 -1.745 . . . . 1.0 114.582 -175.216 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -132.36 78.98 0.35 Allowed Glycine 0 N--CA 1.432 -1.628 0 N-CA-C 109.189 -1.564 . . . . 1.0 109.189 -173.93 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 85' ' ' GLU . . . . . 0.404 ' HB2' ' HB ' ' A' ' 79' ' ' ILE . 11.8 pt-20 -73.42 88.38 1.59 Allowed 'General case' 0 N--CA 1.431 -1.411 0 N-CA-C 116.334 1.976 . . . . 1.0 116.334 -174.566 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 24.8 m -166.63 124.52 1.37 Allowed 'General case' 0 N--CA 1.429 -1.498 0 C-N-CA 125.245 1.418 . . . . 1.0 111.485 172.942 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 3.0 t80 -53.63 -81.97 0.01 OUTLIER 'General case' 0 N--CA 1.43 -1.449 0 C-N-CA 127.031 2.133 . . . . 1.0 116.129 176.617 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 88' ' ' TRP . . . . . . . . . . . . . 0.3 OUTLIER -64.38 -35.11 79.83 Favored 'General case' 0 N--CA 1.43 -1.458 0 O-C-N 120.343 -1.473 . . . . 1.0 114.095 -170.344 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -68.01 -33.1 73.96 Favored 'General case' 0 N--CA 1.429 -1.476 0 C-N-CA 125.136 1.374 . . . . 1.0 114.64 175.577 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 52.8 tp -71.78 -44.44 63.99 Favored 'General case' 0 N--CA 1.429 -1.478 0 O-C-N 119.387 -2.071 . . . . 1.0 110.791 173.204 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 8.1 tt -52.54 -43.12 64.98 Favored 'General case' 0 N--CA 1.43 -1.474 0 C-N-CA 126.571 1.948 . . . . 1.0 113.575 170.985 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 4.9 tt0 -53.09 -60.31 3.45 Favored 'General case' 0 N--CA 1.429 -1.488 0 C-N-CA 126.503 1.921 . . . . 1.0 112.548 168.216 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 20.1 tt0 -52.28 -48.26 65.39 Favored 'General case' 0 N--CA 1.431 -1.414 0 C-N-CA 125.032 1.333 . . . . 1.0 114.314 -177.51 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -55.92 -57.53 11.69 Favored 'General case' 0 N--CA 1.429 -1.519 0 C-N-CA 127.961 2.504 . . . . 1.0 116.16 171.246 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -73.79 -37.0 65.1 Favored 'General case' 0 N--CA 1.43 -1.44 0 O-C-N 118.945 -2.347 . . . . 1.0 112.891 -173.964 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 3.1 m -62.35 -40.12 95.36 Favored 'General case' 0 N--CA 1.43 -1.465 0 C-N-CA 125.141 1.376 . . . . 1.0 112.533 170.8 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 3.0 pt20 -67.59 -30.85 70.56 Favored 'General case' 0 N--CA 1.429 -1.502 0 O-C-N 120.424 -1.422 . . . . 1.0 113.989 178.05 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 15.9 mm-40 -74.07 -47.43 36.62 Favored 'General case' 0 N--CA 1.43 -1.469 0 N-CA-C 114.816 1.413 . . . . 1.0 114.816 168.729 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -72.19 -42.45 65.8 Favored 'General case' 0 N--CA 1.429 -1.502 0 N-CA-C 115.933 1.827 . . . . 1.0 115.933 -176.502 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . 92.31 29.07 11.7 Favored Glycine 0 N--CA 1.43 -1.766 0 C-N-CA 125.078 1.323 . . . . 1.0 113.159 -177.442 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 11.9 pt-20 -167.95 171.65 9.58 Favored 'General case' 0 N--CA 1.43 -1.432 0 O-C-N 121.514 -0.992 . . . . 1.0 110.372 -170.256 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 16.5 m -67.48 121.46 15.86 Favored 'General case' 0 N--CA 1.43 -1.433 0 O-C-N 120.827 -1.171 . . . . 1.0 111.144 176.531 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 9.8 p -98.39 160.42 3.15 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.492 0 C-N-CA 125.107 1.363 . . . . 1.0 107.984 -178.799 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 11.5 t -109.08 107.51 17.85 Favored 'General case' 0 N--CA 1.429 -1.513 0 O-C-N 121.025 -1.047 . . . . 1.0 112.875 -165.706 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 34.5 p90 -138.95 -37.54 0.52 Allowed 'General case' 0 N--CA 1.431 -1.398 0 O-C-N 120.515 -1.365 . . . . 1.0 113.056 -172.232 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 4.9 mtm180 . . . . . 0 C--O 1.259 1.595 0 C-N-CA 124.857 1.263 . . . . 1.0 110.034 177.484 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 48.8 m-80 . . . . . 0 N--CA 1.43 -1.46 0 N-CA-C 117.309 2.337 . . . . 1.0 117.309 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 30.4 t70 -56.26 -49.4 74.3 Favored 'General case' 0 N--CA 1.43 -1.433 0 C-N-CA 125.978 1.711 . . . . 1.0 113.189 -178.225 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 12.9 m -58.95 -38.15 78.38 Favored 'General case' 0 N--CA 1.43 -1.462 0 N-CA-C 114.598 1.333 . . . . 1.0 114.598 -179.812 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 29.0 tt0 -67.67 -54.44 19.52 Favored 'General case' 0 N--CA 1.431 -1.411 0 C-N-CA 125.04 1.336 . . . . 1.0 111.907 176.051 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 1.1 t80 -49.23 -47.79 46.09 Favored 'General case' 0 N--CA 1.431 -1.4 0 C-N-CA 125.93 1.692 . . . . 1.0 113.94 170.182 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 1.0 OUTLIER -57.12 -50.17 73.62 Favored 'General case' 0 N--CA 1.431 -1.392 0 O-C-N 120.239 -1.538 . . . . 1.0 114.231 173.905 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 26.3 ttm-85 -62.24 -47.67 83.38 Favored 'General case' 0 N--CA 1.431 -1.407 0 CA-C-N 119.463 1.028 . . . . 1.0 112.406 -179.376 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 90.6 mt -55.17 -57.53 11.37 Favored 'General case' 0 N--CA 1.429 -1.481 0 C-N-CA 126.534 1.933 . . . . 1.0 112.167 173.172 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -53.52 -47.36 69.99 Favored 'General case' 0 N--CA 1.429 -1.516 0 O-C-N 120.563 -1.335 . . . . 1.0 114.024 178.863 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -61.85 -40.69 96.22 Favored 'General case' 0 N--CA 1.43 -1.437 0 N-CA-C 113.942 1.089 . . . . 1.0 113.942 178.643 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . 0.25 11.6 pt20 -71.87 -38.41 70.04 Favored 'General case' 0 N--CA 1.43 -1.467 0 N-CA-C 114.833 1.42 . . . . 1.0 114.833 175.452 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 82.8 mt -62.13 -50.5 71.66 Favored 'General case' 0 N--CA 1.43 -1.452 0 O-C-N 120.186 -1.572 . . . . 1.0 111.171 174.67 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 0.1 OUTLIER -52.25 -49.97 62.99 Favored 'General case' 0 N--CA 1.43 -1.445 0 C-N-CA 126.079 1.752 . . . . 1.0 111.903 177.264 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 55.2 tp -58.79 -54.01 51.95 Favored 'General case' 0 N--CA 1.431 -1.395 0 C-N-CA 125.441 1.496 . . . . 1.0 113.554 174.413 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 75.0 m -58.68 -57.16 14.22 Favored 'General case' 0 N--CA 1.431 -1.404 0 C-N-CA 124.716 1.207 . . . . 1.0 113.296 178.442 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 29.8 mt -50.74 -52.9 15.25 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.402 0 C-N-CA 125.711 1.604 . . . . 1.0 114.32 176.072 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 29.9 tt0 -57.96 -54.09 50.9 Favored 'General case' 0 N--CA 1.43 -1.429 0 O-C-N 120.709 -1.244 . . . . 1.0 113.639 178.169 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 7.0 tp10 -75.42 -32.45 60.72 Favored 'General case' 0 N--CA 1.431 -1.415 0 N-CA-C 114.838 1.422 . . . . 1.0 114.838 -172.142 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 20.0 tpt180 -75.87 -33.48 59.99 Favored 'General case' 0 N--CA 1.43 -1.434 0 O-C-N 119.943 -1.723 . . . . 1.0 112.981 175.686 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -76.66 -31.83 57.58 Favored 'General case' 0 N--CA 1.43 -1.428 0 O-C-N 120.269 -1.519 . . . . 1.0 110.927 175.659 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 19.7 t70 -58.86 -65.39 0.67 Allowed 'General case' 0 N--CA 1.43 -1.434 0 C-N-CA 125.959 1.704 . . . . 1.0 113.976 168.38 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 32.3 t70 -84.92 112.31 20.45 Favored 'General case' 0 N--CA 1.43 -1.433 0 CA-C-O 123.11 1.433 . . . . 1.0 111.426 178.826 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 24' ' ' TRP . . . . . . . . . . . . . 51.8 t-105 -132.95 -166.1 1.71 Allowed 'General case' 0 N--CA 1.431 -1.412 0 C-N-CA 125.429 1.492 . . . . 1.0 108.108 -174.167 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 5.7 t0 -138.86 85.59 2.09 Favored 'General case' 0 N--CA 1.429 -1.481 0 N-CA-C 106.006 -1.85 . . . . 1.0 106.006 172.211 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -161.12 -159.83 10.29 Favored Glycine 0 N--CA 1.43 -1.74 0 O-C-N 120.428 -1.42 . . . . 1.0 112.916 -173.315 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 9.1 t0 -113.1 -34.59 5.65 Favored 'General case' 0 N--CA 1.431 -1.397 0 C-N-CA 125.387 1.475 . . . . 1.0 111.096 -177.705 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 49.3 m -60.28 149.82 32.26 Favored 'General case' 0 N--CA 1.43 -1.43 0 C-N-CA 125.79 1.636 . . . . 1.0 113.602 178.032 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 2.4 t70 -110.11 151.54 27.11 Favored 'General case' 0 N--CA 1.431 -1.407 0 O-C-N 120.966 -1.084 . . . . 1.0 109.356 174.277 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 50.8 mm -139.83 115.68 8.49 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.426 0 C-N-CA 126.811 2.044 . . . . 1.0 105.487 -161.245 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 41.8 m-20 -119.55 100.65 7.41 Favored 'General case' 0 N--CA 1.432 -1.373 0 CA-C-O 122.126 0.965 . . . . 1.0 109.27 167.51 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 24.7 t -73.95 137.73 43.75 Favored 'General case' 0 N--CA 1.43 -1.446 0 O-C-N 119.372 -2.08 . . . . 1.0 111.363 162.585 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -94.66 149.51 21.17 Favored 'General case' 0 N--CA 1.429 -1.507 0 C-N-CA 126.625 1.97 . . . . 1.0 108.679 179.81 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 3.3 mp -135.51 106.6 6.5 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.439 0 CA-C-O 123.787 1.756 . . . . 1.0 109.278 -171.345 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 4.7 m120 -113.09 172.34 7.0 Favored 'General case' 0 N--CA 1.431 -1.418 0 N-CA-C 106.829 -1.545 . . . . 1.0 106.829 167.109 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -69.75 85.09 0.28 Allowed Glycine 0 N--CA 1.43 -1.729 0 N-CA-C 117.019 1.568 . . . . 1.0 117.019 -168.745 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 94.87 12.47 55.42 Favored Glycine 0 N--CA 1.431 -1.698 0 C-N-CA 126.19 1.853 . . . . 1.0 112.882 -177.27 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 44.9 t -132.28 131.88 60.72 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.452 0 N-CA-C 107.083 -1.451 . . . . 1.0 107.083 -175.6 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 68.5 mt -121.77 137.94 54.56 Favored 'General case' 0 N--CA 1.43 -1.436 0 O-C-N 120.698 -1.251 . . . . 1.0 109.558 174.187 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -128.68 107.18 9.47 Favored 'General case' 0 N--CA 1.432 -1.372 0 N-CA-C 107.193 -1.41 . . . . 1.0 107.193 -174.654 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 42.6 mt -89.55 122.67 41.15 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.451 0 O-C-N 119.456 -2.027 . . . . 1.0 109.355 -167.397 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 27.2 p -123.9 135.01 53.43 Favored 'General case' 0 N--CA 1.43 -1.465 0 CA-C-O 122.114 0.959 . . . . 1.0 113.389 -179.741 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 43' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -121.41 171.74 8.55 Favored 'General case' 0 N--CA 1.43 -1.459 0 O-C-N 120.444 -1.41 . . . . 1.0 111.534 173.406 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 14.7 mm-40 -52.12 -32.69 36.51 Favored 'General case' 0 N--CA 1.43 -1.446 0 N-CA-C 118.495 2.776 . . . . 1.0 118.495 -169.694 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 31.5 t30 -66.05 -12.41 55.11 Favored 'General case' 0 N--CA 1.432 -1.367 0 N-CA-C 114.783 1.401 . . . . 1.0 114.783 175.712 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 90.04 17.27 54.18 Favored Glycine 0 N--CA 1.43 -1.718 0 O-C-N 120.14 -1.6 . . . . 1.0 111.528 -179.485 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 73.4 m -91.72 157.8 16.72 Favored 'General case' 0 N--CA 1.429 -1.486 0 C-N-CA 126.019 1.728 . . . . 1.0 110.907 -174.074 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 5.2 ptmm? -149.21 121.47 8.39 Favored 'General case' 0 N--CA 1.431 -1.381 0 N-CA-C 114.089 1.144 . . . . 1.0 114.089 -151.211 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 1.7 mm -116.1 134.91 57.98 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.491 0 N-CA-C 107.012 -1.477 . . . . 1.0 107.012 176.415 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 3.5 tp -125.13 119.67 56.3 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.504 0 CA-C-N 121.887 2.13 . . . . 1.0 110.543 -179.969 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 3.9 mt -130.57 125.83 59.61 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.394 0 CA-C-O 123.588 1.661 . . . . 1.0 113.098 -167.728 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 7.6 t-20 -161.8 175.73 11.62 Favored 'General case' 0 N--CA 1.43 -1.445 0 N-CA-C 105.661 -1.977 . . . . 1.0 105.661 -171.302 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 1.4 ptp85 -108.86 153.97 22.77 Favored 'General case' 0 N--CA 1.43 -1.471 0 O-C-N 120.04 -1.663 . . . . 1.0 111.966 -173.444 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 15.7 mm100 -103.92 86.05 2.52 Favored 'General case' 0 N--CA 1.43 -1.429 0 C-N-CA 125.0 1.32 . . . . 1.0 108.187 173.209 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . 0.281 28.6 tt0 -61.43 -39.34 61.38 Favored Pre-proline 0 N--CA 1.43 -1.46 0 N-CA-C 118.923 2.934 . . . . 1.0 118.923 -161.682 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 77.0 Cg_exo -64.62 -7.71 15.33 Favored 'Trans proline' 0 C--N 1.298 -2.086 0 CA-C-N 126.474 3.348 . . . . 1.0 117.198 -178.447 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 57' ' ' LEU . . . . . 0.503 HD12 HE22 ' A' ' 59' ' ' GLN . 61.4 mt -117.75 -113.08 0.34 Allowed 'General case' 0 N--CA 1.43 -1.437 0 CA-C-N 120.115 1.325 . . . . 1.0 110.395 173.972 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 58' ' ' HIS . . . . . 0.439 ' C ' ' CD2' ' A' ' 58' ' ' HIS . 7.8 t60 -146.53 -30.23 0.37 Allowed 'General case' 0 N--CA 1.431 -1.411 0 C-N-CA 124.784 1.234 . . . . 1.0 111.484 -168.221 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 59' ' ' GLN . . . . . 0.503 HE22 HD12 ' A' ' 57' ' ' LEU . 16.5 pm0 -80.88 152.58 28.06 Favored 'General case' 0 N--CA 1.431 -1.409 0 CA-C-O 124.977 2.323 . . . . 1.0 116.845 -169.967 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 59.5 t -91.29 147.29 5.35 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.469 0 CA-C-N 113.008 -1.905 . . . . 1.0 108.096 171.615 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 61' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -106.8 148.06 28.94 Favored 'General case' 0 N--CA 1.43 -1.462 0 O-C-N 120.139 -1.601 . . . . 1.0 107.972 175.681 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 2.4 pt? -146.49 115.93 7.11 Favored 'General case' 0 N--CA 1.428 -1.536 0 CA-C-O 123.248 1.499 . . . . 1.0 111.122 166.019 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . 0.415 ' HA ' ' HA2' ' A' ' 68' ' ' GLY . . . -100.29 140.27 34.78 Favored 'General case' 0 N--CA 1.431 -1.39 0 CA-C-O 123.255 1.502 . . . . 1.0 113.779 172.644 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 64' ' ' THR . . . . . . . . . . . . . 9.0 t -151.86 -167.15 2.7 Favored 'General case' 0 N--CA 1.431 -1.421 0 C-N-CA 126.364 1.866 . . . . 1.0 107.318 -169.137 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 33.1 tptt -69.49 -29.96 67.73 Favored 'General case' 0 N--CA 1.43 -1.466 0 N-CA-C 116.286 1.958 . . . . 1.0 116.286 -165.847 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 11.1 tt0 -77.7 -13.3 59.94 Favored 'General case' 0 N--CA 1.429 -1.485 0 O-C-N 120.208 -1.557 . . . . 1.0 113.874 176.079 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 146.67 -56.42 0.51 Allowed Glycine 0 N--CA 1.43 -1.748 0 O-C-N 119.529 -1.982 . . . . 1.0 112.133 174.123 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 68' ' ' GLY . . . . . 0.415 ' HA2' ' HA ' ' A' ' 63' ' ' ALA . . . 123.67 124.44 2.9 Favored Glycine 0 N--CA 1.43 -1.714 0 O-C-N 121.723 -0.869 . . . . 1.0 115.002 -176.704 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 19.6 m-30 -120.56 170.16 9.67 Favored 'General case' 0 N--CA 1.43 -1.442 0 C-N-CA 125.727 1.611 . . . . 1.0 107.392 -177.227 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 28.4 p80 -114.54 159.34 20.51 Favored 'General case' 0 N--CA 1.43 -1.434 0 O-C-N 119.796 -1.815 . . . . 1.0 111.905 170.221 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 71' ' ' PHE . . . . . . . . . . . . 0.259 20.0 t80 -118.48 113.27 21.08 Favored 'General case' 0 N--CA 1.432 -1.361 0 C-N-CA 127.291 2.236 . . . . 1.0 108.587 -160.607 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -128.58 166.45 18.83 Favored 'General case' 0 N--CA 1.429 -1.49 0 C-N-CA 124.713 1.205 . . . . 1.0 108.689 -170.371 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -112.35 121.31 44.5 Favored 'General case' 0 N--CA 1.43 -1.447 0 O-C-N 119.02 -2.3 . . . . 1.0 112.865 -163.633 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 12.1 mmtm -110.97 79.64 1.22 Allowed 'General case' 0 N--CA 1.431 -1.399 0 O-C-N 120.057 -1.652 . . . . 1.0 110.143 167.572 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . 72.36 -79.92 0.64 Allowed Glycine 0 N--CA 1.431 -1.675 0 C-N-CA 125.668 1.604 . . . . 1.0 115.93 173.452 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -116.75 -7.49 11.49 Favored 'General case' 0 N--CA 1.429 -1.504 0 C-N-CA 125.233 1.413 . . . . 1.0 110.862 -178.739 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 53.9 mt-10 -131.16 125.47 33.11 Favored 'General case' 0 N--CA 1.43 -1.469 0 N-CA-C 105.537 -2.023 . . . . 1.0 105.537 -171.687 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 78' ' ' TRP . . . . . 0.411 ' HB2' ' HB3' ' A' ' 87' ' ' PHE . 71.3 m95 -82.82 111.51 18.8 Favored 'General case' 0 N--CA 1.43 -1.428 0 N-CA-C 107.391 -1.337 . . . . 1.0 107.391 174.472 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 8.6 mt -90.21 124.85 43.04 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.433 0 CA-C-O 124.032 1.872 . . . . 1.0 107.437 178.373 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 80' ' ' CYS . . . . . 0.409 ' HB2' ' HB2' ' A' ' 85' ' ' GLU . 38.5 m -76.96 121.36 23.36 Favored 'General case' 0 N--CA 1.429 -1.496 0 CA-C-N 113.971 -1.468 . . . . 1.0 108.7 177.935 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 11.8 t70 -71.75 -41.62 68.23 Favored 'General case' 0 N--CA 1.429 -1.51 0 N-CA-C 114.634 1.346 . . . . 1.0 114.634 -154.223 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 24.1 mmt85 -70.94 129.63 39.52 Favored 'General case' 0 N--CA 1.43 -1.46 0 O-C-N 121.195 -0.941 . . . . 1.0 109.057 173.545 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 83' ' ' SER . . . . . . . . . . . . 0.257 29.6 t 69.8 -71.09 0.13 Allowed 'General case' 0 N--CA 1.43 -1.446 0 C-N-CA 125.91 1.684 . . . . 1.0 112.21 -159.482 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 120.85 68.09 0.27 Allowed Glycine 0 N--CA 1.431 -1.663 0 N-CA-C 108.066 -2.013 . . . . 1.0 108.066 -168.467 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 85' ' ' GLU . . . . . 0.409 ' HB2' ' HB2' ' A' ' 80' ' ' CYS . 60.1 mm-40 -113.83 -145.48 0.4 Allowed 'General case' 0 N--CA 1.429 -1.477 0 C-N-CA 124.737 1.215 . . . . 1.0 108.306 -171.252 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 93.2 m -150.57 133.99 16.38 Favored 'General case' 0 N--CA 1.43 -1.474 0 O-C-N 119.561 -1.962 . . . . 1.0 108.945 -160.685 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 87' ' ' PHE . . . . . 0.411 ' HB3' ' HB2' ' A' ' 78' ' ' TRP 0.278 0.0 OUTLIER -39.91 -85.95 0.0 OUTLIER 'General case' 0 N--CA 1.43 -1.447 0 N-CA-C 120.373 3.471 . . . . 1.0 120.373 179.923 . . . . . . . . 4 4 . 1 . 012 nuclear nobuild core ' A' A ' 88' ' ' TRP . . . . . . . . . . . . . 65.9 m95 -68.85 -29.62 67.97 Favored 'General case' 0 N--CA 1.43 -1.433 0 O-C-N 120.682 -1.261 . . . . 1.0 113.321 -172.956 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 24.0 m-20 -71.31 -38.81 71.73 Favored 'General case' 0 N--CA 1.429 -1.485 0 O-C-N 120.987 -1.071 . . . . 1.0 113.607 175.87 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 45.3 tp -69.06 -44.07 73.35 Favored 'General case' 0 N--CA 1.43 -1.447 0 O-C-N 119.817 -1.802 . . . . 1.0 110.658 175.987 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 10.2 tt -49.14 -50.55 37.0 Favored 'General case' 0 N--CA 1.43 -1.429 0 C-N-CA 126.494 1.917 . . . . 1.0 113.371 172.272 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 37.4 tt0 -54.97 -57.93 9.68 Favored 'General case' 0 N--CA 1.431 -1.41 0 C-N-CA 126.706 2.002 . . . . 1.0 113.133 171.694 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 30.4 tt0 -50.58 -48.27 57.65 Favored 'General case' 0 CA--C 1.488 -1.414 0 C-N-CA 127.337 2.255 . . . . 1.0 114.595 178.364 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -65.85 -45.96 80.25 Favored 'General case' 0 N--CA 1.431 -1.421 0 C-N-CA 127.39 2.276 . . . . 1.0 114.377 174.919 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -63.19 -43.87 96.98 Favored 'General case' 0 N--CA 1.43 -1.46 0 O-C-N 120.03 -1.669 . . . . 1.0 112.97 177.453 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 15.5 m -55.46 -43.41 75.43 Favored 'General case' 0 N--CA 1.43 -1.472 0 C-N-CA 126.17 1.788 . . . . 1.0 114.087 170.017 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 2.2 pt20 -72.41 -28.55 63.05 Favored 'General case' 0 N--CA 1.43 -1.439 0 N-CA-C 114.893 1.442 . . . . 1.0 114.893 177.154 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 14.3 mm-40 -66.91 -57.37 7.09 Favored 'General case' 0 N--CA 1.43 -1.47 0 O-C-N 120.906 -1.122 . . . . 1.0 111.992 171.235 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -80.02 -46.21 17.01 Favored 'General case' 0 N--CA 1.43 -1.448 0 N-CA-C 115.723 1.749 . . . . 1.0 115.723 -172.323 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . 87.6 49.52 3.86 Favored Glycine 0 N--CA 1.43 -1.721 0 O-C-N 120.935 -1.103 . . . . 1.0 112.048 -168.37 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 19.3 tt0 -164.81 159.53 18.59 Favored 'General case' 0 N--CA 1.429 -1.513 0 N-CA-C 106.252 -1.759 . . . . 1.0 106.252 -176.268 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 45.9 m -72.16 99.09 2.26 Favored 'General case' 0 N--CA 1.431 -1.406 0 O-C-N 119.554 -1.966 . . . . 1.0 110.681 166.227 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 46.2 t -110.51 112.7 41.71 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.433 0 N-CA-C 105.643 -1.984 . . . . 1.0 105.643 178.066 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 7.5 t -141.42 176.44 8.86 Favored 'General case' 0 N--CA 1.431 -1.413 0 O-C-N 121.328 -0.857 . . . . 1.0 109.591 -171.043 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 5.7 m-85 -111.69 -14.99 13.53 Favored 'General case' 0 N--CA 1.43 -1.439 0 C-N-CA 125.147 1.379 . . . . 1.0 110.288 174.418 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 37.1 mmt180 . . . . . 0 C--O 1.26 1.649 0 O-C-N 120.619 -1.301 . . . . 1.0 111.554 -176.87 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 1.4 t-20 . . . . . 0 N--CA 1.43 -1.426 0 N-CA-C 113.251 0.834 . . . . 1.0 113.251 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 3' ' ' ASP . . . . . . . . . . . . 0.266 1.3 p-10 -61.54 -48.9 78.93 Favored 'General case' 0 N--CA 1.431 -1.395 0 N-CA-C 116.153 1.908 . . . . 1.0 116.153 -164.752 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 63.2 p -61.97 -37.53 85.11 Favored 'General case' 0 N--CA 1.43 -1.44 0 C-N-CA 124.855 1.262 . . . . 1.0 113.04 179.146 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 28.9 mt-10 -69.85 -49.61 50.72 Favored 'General case' 0 N--CA 1.43 -1.435 0 C-N-CA 126.501 1.92 . . . . 1.0 112.102 179.725 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 2.3 m-85 -60.14 -38.6 83.6 Favored 'General case' 0 N--CA 1.431 -1.392 0 C-N-CA 124.177 0.991 . . . . 1.0 112.93 172.815 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 25.2 t60 -65.76 -48.38 72.02 Favored 'General case' 0 N--CA 1.43 -1.459 0 C-N-CA 125.744 1.618 . . . . 1.0 111.792 177.684 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 41.8 ttp-105 -56.03 -57.04 13.81 Favored 'General case' 0 N--CA 1.431 -1.425 0 C-N-CA 124.808 1.243 . . . . 1.0 112.888 177.708 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 36.9 mt -57.74 -42.06 83.12 Favored 'General case' 0 N--CA 1.431 -1.412 0 C-N-CA 124.212 1.005 . . . . 1.0 113.235 178.147 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -57.23 -57.96 10.32 Favored 'General case' 0 N--CA 1.431 -1.376 0 C-N-CA 124.3 1.04 . . . . 1.0 113.123 173.006 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 14.6 t70 -54.43 -45.75 73.07 Favored 'General case' 0 CA--C 1.489 -1.396 0 C-N-CA 125.613 1.565 . . . . 1.0 113.877 -177.005 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 18.4 mt-30 -57.23 -55.2 37.88 Favored 'General case' 0 N--CA 1.431 -1.424 0 N-CA-C 115.194 1.553 . . . . 1.0 115.194 170.694 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 3.1 pp -70.9 -37.04 72.96 Favored 'General case' 0 N--CA 1.43 -1.463 0 O-C-N 119.738 -1.851 . . . . 1.0 115.789 -178.113 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 0.8 OUTLIER -43.91 -60.15 1.96 Allowed 'General case' 0 N--CA 1.429 -1.489 0 C-N-CA 128.155 2.582 . . . . 1.0 112.425 165.859 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 50.7 tp -62.01 -42.72 99.46 Favored 'General case' 0 N--CA 1.429 -1.478 0 C-N-CA 124.299 1.04 . . . . 1.0 113.611 178.396 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 87.4 m -55.44 -52.07 64.8 Favored 'General case' 0 N--CA 1.431 -1.41 0 C-N-CA 125.609 1.564 . . . . 1.0 112.986 176.61 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 78.0 mt -58.78 -52.26 62.26 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.462 0 C-N-CA 125.825 1.65 . . . . 1.0 112.27 175.71 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 2.1 tt0 -56.2 -49.93 72.66 Favored 'General case' 0 N--CA 1.43 -1.432 0 N-CA-C 114.194 1.183 . . . . 1.0 114.194 -177.729 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 34.1 tt0 -65.32 -48.54 72.72 Favored 'General case' 0 N--CA 1.43 -1.436 0 O-C-N 120.928 -1.108 . . . . 1.0 113.637 178.361 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 7.9 tpt180 -61.8 -49.83 74.76 Favored 'General case' 0 N--CA 1.43 -1.454 0 C-N-CA 124.045 0.938 . . . . 1.0 112.647 -176.843 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 11.2 mp -72.62 -30.2 64.13 Favored 'General case' 0 N--CA 1.43 -1.45 0 C-N-CA 124.494 1.118 . . . . 1.0 113.733 -177.756 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 7.9 t70 -66.48 -51.97 51.08 Favored 'General case' 0 N--CA 1.429 -1.509 0 O-C-N 120.371 -1.455 . . . . 1.0 113.506 171.356 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 2.0 t70 -69.82 -24.35 63.45 Favored 'General case' 0 N--CA 1.429 -1.494 0 O-C-N 120.15 -1.594 . . . . 1.0 113.597 -176.525 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 24' ' ' TRP . . . . . . . . . . . . . 59.3 t-105 -45.9 -54.01 8.9 Favored 'General case' 0 N--CA 1.429 -1.492 0 C-N-CA 128.201 2.6 . . . . 1.0 116.989 178.366 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 28.6 t0 66.27 173.6 0.24 Allowed 'General case' 0 N--CA 1.429 -1.492 0 C-N-CA 127.033 2.133 . . . . 1.0 112.884 -175.406 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -168.3 -151.83 7.31 Favored Glycine 0 N--CA 1.429 -1.801 0 O-C-N 119.053 -2.279 . . . . 1.0 112.574 -172.599 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 36.7 t70 -83.45 -47.23 11.61 Favored 'General case' 0 N--CA 1.43 -1.427 0 N-CA-C 107.697 -1.223 . . . . 1.0 107.697 161.736 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 83.2 p -87.62 167.61 13.75 Favored 'General case' 0 N--CA 1.429 -1.506 0 C-N-CA 124.807 1.243 . . . . 1.0 110.988 173.566 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . 0.457 ' H ' ' HG2' ' A' ' 44' ' ' GLU . 2.9 t70 -110.09 179.21 4.17 Favored 'General case' 0 N--CA 1.43 -1.453 0 O-C-N 120.763 -1.211 . . . . 1.0 109.583 -173.016 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -157.61 129.24 0.95 Allowed 'Isoleucine or valine' 0 N--CA 1.43 -1.46 0 CA-C-O 123.117 1.437 . . . . 1.0 108.933 -161.874 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 26.7 m-20 -132.72 105.31 7.1 Favored 'General case' 0 N--CA 1.429 -1.489 0 C-N-CA 126.707 2.003 . . . . 1.0 110.343 170.041 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 10.4 t -85.23 142.44 29.41 Favored 'General case' 0 N--CA 1.43 -1.469 0 O-C-N 118.92 -2.362 . . . . 1.0 110.809 170.811 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 2.2 tp10 -113.5 137.88 50.92 Favored 'General case' 0 N--CA 1.428 -1.546 0 C-N-CA 124.13 0.972 . . . . 1.0 109.9 178.708 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 5.1 tp -117.44 121.03 66.63 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.428 0 C-N-CA 126.516 1.926 . . . . 1.0 107.079 178.759 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 32.0 m120 -124.77 -176.33 3.51 Favored 'General case' 0 N--CA 1.43 -1.45 0 C-N-CA 126.1 1.76 . . . . 1.0 108.52 168.31 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -65.52 91.08 0.13 Allowed Glycine 0 N--CA 1.43 -1.703 0 O-C-N 120.105 -1.622 . . . . 1.0 116.047 -171.0 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 85.65 2.93 86.62 Favored Glycine 0 N--CA 1.429 -1.815 0 C-N-CA 125.115 1.341 . . . . 1.0 113.898 -176.258 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 33.4 t -124.53 125.38 70.07 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.449 0 C-N-CA 124.045 0.938 . . . . 1.0 109.983 -168.88 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 27.7 mt -115.73 130.63 56.92 Favored 'General case' 0 N--CA 1.43 -1.462 0 CA-C-O 122.623 1.202 . . . . 1.0 108.239 165.242 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 5.2 p -120.87 119.44 32.67 Favored 'General case' 0 N--CA 1.429 -1.482 0 N-CA-C 106.995 -1.483 . . . . 1.0 106.995 170.773 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 33.5 mt -92.82 113.09 27.19 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.455 0 N-CA-C 106.8 -1.556 . . . . 1.0 106.8 -177.203 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -99.35 128.04 45.43 Favored 'General case' 0 N--CA 1.43 -1.464 0 N-CA-C 108.434 -0.95 . . . . 1.0 108.434 -175.979 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 43' ' ' PHE . . . . . . . . . . . . . 5.4 p90 -116.14 151.06 36.38 Favored 'General case' 0 N--CA 1.43 -1.435 0 N-CA-C 107.394 -1.336 . . . . 1.0 107.394 171.386 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . 0.457 ' HG2' ' H ' ' A' ' 29' ' ' ASP . 0.2 OUTLIER -71.18 -13.42 61.92 Favored 'General case' 0 N--CA 1.43 -1.444 0 N-CA-C 116.334 1.976 . . . . 1.0 116.334 -153.986 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 19.7 t-20 -64.95 -19.56 66.02 Favored 'General case' 0 N--CA 1.43 -1.447 0 C-N-CA 127.457 2.303 . . . . 1.0 113.219 172.909 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 102.32 13.81 29.85 Favored Glycine 0 N--CA 1.429 -1.796 0 O-C-N 120.37 -1.456 . . . . 1.0 114.186 170.145 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 3.5 m -112.3 174.02 6.08 Favored 'General case' 0 N--CA 1.43 -1.458 0 C-N-CA 124.473 1.109 . . . . 1.0 109.036 172.083 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 20.9 pttm -156.9 148.92 22.85 Favored 'General case' 0 N--CA 1.431 -1.393 0 O-C-N 120.938 -1.101 . . . . 1.0 113.378 -160.863 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 49' ' ' ILE . . . . . 0.415 HD13 HG23 ' A' ' 64' ' ' THR . 7.5 mm -97.13 138.44 22.07 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.454 0 N-CA-C 106.355 -1.72 . . . . 1.0 106.355 171.171 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 4.1 mm -122.77 115.89 47.21 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.473 0 CA-C-N 119.598 1.09 . . . . 1.0 110.233 -175.953 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 2.1 mt -129.4 126.22 63.19 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.501 0 O-C-N 120.536 -1.352 . . . . 1.0 110.61 176.868 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 52' ' ' ASN . . . . . 0.55 ' H ' ' HD1' ' A' ' 61' ' ' TRP . 15.1 p30 -151.2 165.47 33.82 Favored 'General case' 0 N--CA 1.429 -1.509 0 CA-C-O 122.971 1.367 . . . . 1.0 108.592 176.923 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 40.1 ptt85 -148.78 152.44 36.55 Favored 'General case' 0 N--CA 1.431 -1.41 0 CA-C-N 114.474 -1.239 . . . . 1.0 108.877 -172.67 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 68.8 mm-40 -116.4 107.99 15.48 Favored 'General case' 0 N--CA 1.429 -1.478 0 N-CA-C 107.026 -1.472 . . . . 1.0 107.026 171.46 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 15.5 tt0 -58.95 -41.61 89.45 Favored Pre-proline 0 N--CA 1.43 -1.435 0 N-CA-C 116.112 1.893 . . . . 1.0 116.112 -172.504 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 83.7 Cg_exo -69.25 -18.49 39.39 Favored 'Trans proline' 0 N--CA 1.433 -2.052 0 CA-C-N 126.173 3.24 . . . . 1.0 117.79 178.185 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . 0.381 3.9 pp -96.72 -14.41 22.05 Favored 'General case' 0 N--CA 1.431 -1.414 0 N-CA-C 116.744 2.127 . . . . 1.0 116.744 -170.766 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 5.9 m170 73.23 52.96 0.13 Allowed 'General case' 0 N--CA 1.43 -1.436 0 C-N-CA 125.003 1.321 . . . . 1.0 114.536 174.095 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 34.0 tt0 -162.05 158.26 24.66 Favored 'General case' 0 N--CA 1.43 -1.438 0 C-N-CA 124.515 1.126 . . . . 1.0 108.079 172.45 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 55.0 t -119.38 152.76 21.87 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.48 0 C-N-CA 126.106 1.762 . . . . 1.0 110.408 178.997 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 61' ' ' TRP . . . . . 0.55 ' HD1' ' H ' ' A' ' 52' ' ' ASN . 0.0 OUTLIER -104.84 152.59 22.42 Favored 'General case' 0 N--CA 1.43 -1.448 0 C-N-CA 125.463 1.505 . . . . 1.0 109.471 176.026 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -145.12 97.02 2.94 Favored 'General case' 0 N--CA 1.431 -1.401 0 O-C-N 120.804 -1.185 . . . . 1.0 110.548 -176.874 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -122.6 149.18 44.33 Favored 'General case' 0 N--CA 1.431 -1.416 0 O-C-N 119.708 -1.87 . . . . 1.0 115.993 179.508 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 64' ' ' THR . . . . . 0.415 HG23 HD13 ' A' ' 49' ' ' ILE . 5.9 m -151.24 -94.69 0.06 Allowed 'General case' 0 N--CA 1.429 -1.482 0 C-N-CA 125.504 1.522 . . . . 1.0 111.269 175.041 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 10.7 tmtt? -99.59 -44.26 6.2 Favored 'General case' 0 N--CA 1.43 -1.448 0 C-N-CA 125.217 1.407 . . . . 1.0 110.387 -172.555 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 33.3 mm-40 -70.33 -23.57 62.85 Favored 'General case' 0 N--CA 1.43 -1.469 0 N-CA-C 113.831 1.048 . . . . 1.0 113.831 -174.403 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 136.75 -39.62 1.62 Allowed Glycine 0 N--CA 1.43 -1.757 0 O-C-N 121.398 -0.814 . . . . 1.0 111.9 166.774 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 140.95 123.86 1.99 Allowed Glycine 0 N--CA 1.43 -1.718 0 CA-C-O 122.279 0.933 . . . . 1.0 113.434 -179.842 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 21.5 m-30 -115.55 170.09 8.68 Favored 'General case' 0 N--CA 1.431 -1.424 0 C-N-CA 126.383 1.873 . . . . 1.0 107.189 176.744 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -115.29 161.02 19.07 Favored 'General case' 0 N--CA 1.43 -1.451 0 O-C-N 120.366 -1.459 . . . . 1.0 110.032 168.2 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 71' ' ' PHE . . . . . . . . . . . . 0.279 28.7 t80 -140.1 126.16 19.75 Favored 'General case' 0 N--CA 1.431 -1.413 0 C-N-CA 123.836 0.854 . . . . 1.0 109.889 -151.437 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 35.0 m-20 -136.73 156.51 48.42 Favored 'General case' 0 N--CA 1.43 -1.453 0 CA-C-O 121.994 0.902 . . . . 1.0 111.48 179.401 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 67.9 tp -84.69 136.72 33.61 Favored 'General case' 0 N--CA 1.43 -1.454 0 O-C-N 120.411 -1.431 . . . . 1.0 111.757 173.007 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 72.4 mmtt -89.19 -86.17 0.19 Allowed 'General case' 0 N--CA 1.43 -1.455 0 C-N-CA 124.868 1.267 . . . . 1.0 110.282 161.907 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -138.09 -55.31 0.05 OUTLIER Glycine 0 N--CA 1.428 -1.856 0 O-C-N 120.723 -1.235 . . . . 1.0 112.732 175.451 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 78.7 m-20 -97.2 -20.15 18.12 Favored 'General case' 0 N--CA 1.43 -1.467 0 C-N-CA 124.663 1.185 . . . . 1.0 110.755 173.742 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 26.6 tt0 -133.98 121.33 21.47 Favored 'General case' 0 N--CA 1.43 -1.441 0 N-CA-C 107.168 -1.419 . . . . 1.0 107.168 -151.673 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 78' ' ' TRP . . . . . . . . . . . . . 48.7 m95 -83.72 107.14 15.96 Favored 'General case' 0 N--CA 1.431 -1.403 0 N-CA-C 106.626 -1.62 . . . . 1.0 106.626 167.251 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER -93.2 154.28 3.25 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.467 0 CA-C-O 123.425 1.583 . . . . 1.0 107.142 178.885 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 59.2 m -84.08 125.59 32.26 Favored 'General case' 0 N--CA 1.431 -1.422 0 O-C-N 120.65 -1.281 . . . . 1.0 108.153 173.191 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 38.5 t70 -69.57 -53.77 17.29 Favored 'General case' 0 N--CA 1.43 -1.46 0 C-N-CA 126.38 1.872 . . . . 1.0 110.621 -173.551 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -76.46 137.23 39.56 Favored 'General case' 0 N--CA 1.428 -1.535 0 C-N-CA 125.961 1.704 . . . . 1.0 108.515 177.655 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 48.9 m 73.11 -59.63 0.56 Allowed 'General case' 0 N--CA 1.429 -1.52 0 C-N-CA 125.966 1.707 . . . . 1.0 113.161 -170.846 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 112.09 92.28 2.05 Favored Glycine 0 N--CA 1.429 -1.767 0 N-CA-C 109.008 -1.637 . . . . 1.0 109.008 -177.522 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -153.22 -154.04 0.51 Allowed 'General case' 0 N--CA 1.429 -1.485 0 CA-C-N 118.67 1.235 . . . . 1.0 109.513 -170.409 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 51.7 m -150.38 131.57 14.48 Favored 'General case' 0 N--CA 1.429 -1.489 0 O-C-N 120.671 -1.268 . . . . 1.0 109.501 -157.451 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . 0.26 0.0 OUTLIER -36.53 -91.63 0.0 OUTLIER 'General case' 0 N--CA 1.43 -1.462 0 N-CA-C 121.45 3.87 . . . . 1.0 121.45 178.827 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 88' ' ' TRP . . . . . . . . . . . . . 91.6 m95 -63.68 -27.87 69.52 Favored 'General case' 0 N--CA 1.429 -1.509 0 O-C-N 120.009 -1.682 . . . . 1.0 113.146 -173.198 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 3.2 t70 -68.9 -44.25 73.59 Favored 'General case' 0 N--CA 1.431 -1.41 0 C-N-CA 126.125 1.77 . . . . 1.0 112.601 175.857 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 45.1 tp -66.05 -45.15 82.42 Favored 'General case' 0 N--CA 1.43 -1.469 0 O-C-N 120.44 -1.413 . . . . 1.0 111.037 177.57 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 26.3 tp -55.92 -43.14 77.07 Favored 'General case' 0 N--CA 1.43 -1.475 0 C-N-CA 124.528 1.131 . . . . 1.0 113.472 175.868 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 34.6 tt0 -60.53 -47.49 85.93 Favored 'General case' 0 N--CA 1.431 -1.412 0 C-N-CA 126.254 1.821 . . . . 1.0 112.889 173.036 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 24.0 tt0 -59.18 -54.32 48.23 Favored 'General case' 0 N--CA 1.429 -1.48 0 C-N-CA 126.652 1.981 . . . . 1.0 113.45 177.538 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -54.05 -41.89 68.61 Favored 'General case' 0 N--CA 1.429 -1.48 0 C-N-CA 127.972 2.509 . . . . 1.0 114.264 175.328 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -73.94 -51.72 15.17 Favored 'General case' 0 N--CA 1.43 -1.436 0 N-CA-C 114.781 1.4 . . . . 1.0 114.781 178.546 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 1.6 t -61.16 -26.35 67.64 Favored 'General case' 0 N--CA 1.43 -1.464 0 O-C-N 119.236 -2.165 . . . . 1.0 114.1 175.809 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 7.5 tp-100 -62.65 -70.0 0.23 Allowed 'General case' 0 N--CA 1.43 -1.453 0 C-N-CA 126.31 1.844 . . . . 1.0 112.431 168.139 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 18.4 mt-30 -76.98 -48.31 18.37 Favored 'General case' 0 N--CA 1.43 -1.434 0 N-CA-C 116.411 2.004 . . . . 1.0 116.411 -175.369 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -73.5 -36.5 65.77 Favored 'General case' 0 N--CA 1.431 -1.414 0 O-C-N 120.059 -1.651 . . . . 1.0 112.067 -177.464 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . 93.1 28.3 12.08 Favored Glycine 0 N--CA 1.43 -1.719 0 C-N-CA 123.927 0.775 . . . . 1.0 113.956 171.981 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 27.7 mt-10 -145.91 168.92 19.67 Favored 'General case' 0 N--CA 1.431 -1.421 0 O-C-N 121.821 -0.811 . . . . 1.0 111.401 -172.749 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 6.8 m -78.91 78.92 5.33 Favored 'General case' 0 N--CA 1.431 -1.399 0 CA-C-O 122.792 1.282 . . . . 1.0 110.61 173.554 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 47.4 t -93.05 93.36 4.13 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.436 0 C-N-CA 126.687 1.995 . . . . 1.0 106.73 174.571 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 7.9 t -140.47 166.37 24.89 Favored 'General case' 0 N--CA 1.429 -1.48 0 CA-C-N 115.324 -0.853 . . . . 1.0 110.609 -175.367 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -120.3 -12.79 8.97 Favored 'General case' 0 N--CA 1.43 -1.444 0 C-N-CA 125.061 1.345 . . . . 1.0 109.714 175.935 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 75.6 mtm180 . . . . . 0 C--O 1.26 1.617 0 O-C-N 120.519 -1.363 . . . . 1.0 111.839 -174.174 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 7.3 m120 . . . . . 0 N--CA 1.429 -1.481 0 N-CA-C 114.117 1.154 . . . . 1.0 114.117 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 3.1 m-20 -59.33 -54.42 47.0 Favored 'General case' 0 N--CA 1.431 -1.391 0 C-N-CA 125.612 1.565 . . . . 1.0 111.656 176.581 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 23.1 t -57.7 -45.21 85.99 Favored 'General case' 0 N--CA 1.431 -1.411 0 C-N-CA 126.344 1.857 . . . . 1.0 113.558 177.01 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 88.0 tt0 -54.74 -60.51 3.26 Favored 'General case' 0 N--CA 1.431 -1.402 0 C-N-CA 126.08 1.752 . . . . 1.0 113.723 176.051 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 1.1 t80 -67.31 -25.21 65.91 Favored 'General case' 0 N--CA 1.43 -1.444 0 N-CA-C 115.4 1.63 . . . . 1.0 115.4 179.934 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 16.7 t60 -64.75 -46.01 84.03 Favored 'General case' 0 N--CA 1.43 -1.444 0 C-N-CA 125.935 1.694 . . . . 1.0 113.42 171.355 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 18.4 mmm180 -61.59 -48.89 78.88 Favored 'General case' 0 N--CA 1.431 -1.425 0 C-N-CA 124.958 1.303 . . . . 1.0 112.576 174.625 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 90.6 mt -57.07 -41.02 78.0 Favored 'General case' 0 N--CA 1.43 -1.431 0 C-N-CA 124.379 1.072 . . . . 1.0 113.133 174.449 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -58.88 -53.33 59.58 Favored 'General case' 0 N--CA 1.431 -1.413 0 C-N-CA 125.948 1.699 . . . . 1.0 113.349 176.304 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -56.04 -41.81 75.57 Favored 'General case' 0 N--CA 1.431 -1.399 0 N-CA-C 114.003 1.112 . . . . 1.0 114.003 176.432 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 97.1 mm-40 -63.0 -51.07 68.25 Favored 'General case' 0 N--CA 1.431 -1.415 0 N-CA-C 114.614 1.338 . . . . 1.0 114.614 174.961 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 3.6 pp -70.57 -39.72 73.74 Favored 'General case' 0 N--CA 1.429 -1.5 0 O-C-N 120.135 -1.603 . . . . 1.0 114.517 -179.925 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 0.2 OUTLIER -50.83 -49.89 57.78 Favored 'General case' 0 N--CA 1.43 -1.472 0 C-N-CA 125.789 1.636 . . . . 1.0 113.682 168.78 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 45.2 tp -62.51 -47.45 83.89 Favored 'General case' 0 N--CA 1.43 -1.461 0 O-C-N 121.402 -0.811 . . . . 1.0 112.673 177.167 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 20.2 m -64.75 -50.31 67.36 Favored 'General case' 0 N--CA 1.43 -1.43 0 C-N-CA 124.544 1.138 . . . . 1.0 114.069 -177.376 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 79.9 mt -54.62 -49.37 67.79 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.474 0 O-C-N 119.781 -1.825 . . . . 1.0 114.593 169.447 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 22.8 tt0 -59.35 -47.28 86.02 Favored 'General case' 0 N--CA 1.429 -1.495 0 O-C-N 120.555 -1.341 . . . . 1.0 112.175 177.006 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 3.5 tt0 -56.53 -40.63 75.4 Favored 'General case' 0 N--CA 1.43 -1.453 0 C-N-CA 125.053 1.341 . . . . 1.0 113.801 175.012 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 49.8 tpt85 -57.92 -51.05 71.23 Favored 'General case' 0 N--CA 1.429 -1.476 0 O-C-N 119.309 -2.119 . . . . 1.0 113.255 172.06 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 4.6 mm? -72.71 -47.15 49.5 Favored 'General case' 0 N--CA 1.431 -1.387 0 N-CA-C 114.329 1.233 . . . . 1.0 114.329 -176.924 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 19.0 t70 -74.4 -49.15 23.73 Favored 'General case' 0 N--CA 1.43 -1.448 0 C-N-CA 125.605 1.562 . . . . 1.0 114.092 -175.012 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 13.6 t70 -84.45 -39.75 18.56 Favored 'General case' 0 N--CA 1.43 -1.452 0 O-C-N 120.446 -1.408 . . . . 1.0 113.124 -170.944 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 24' ' ' TRP . . . . . . . . . . . . . 4.5 t90 -85.67 106.48 16.98 Favored 'General case' 0 N--CA 1.43 -1.44 0 O-C-N 119.803 -1.811 . . . . 1.0 108.982 172.38 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 1.4 t70 -80.95 -172.05 3.51 Favored 'General case' 0 N--CA 1.431 -1.418 0 CA-C-O 123.179 1.466 . . . . 1.0 113.645 -165.018 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -166.39 -171.05 32.09 Favored Glycine 0 N--CA 1.43 -1.745 0 O-C-N 119.815 -1.803 . . . . 1.0 111.637 -172.191 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 1.7 t70 -83.28 -39.12 21.24 Favored 'General case' 0 N--CA 1.43 -1.461 0 O-C-N 121.429 -1.042 . . . . 1.0 110.789 178.501 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 22.6 m -81.92 160.33 23.42 Favored 'General case' 0 N--CA 1.429 -1.482 0 CA-C-O 122.279 1.038 . . . . 1.0 111.709 174.36 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 1.8 t70 -76.59 175.85 8.89 Favored 'General case' 0 N--CA 1.43 -1.434 0 C-N-CA 125.205 1.402 . . . . 1.0 111.057 176.094 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 10.2 tp -159.74 115.22 0.16 Allowed 'Isoleucine or valine' 0 N--CA 1.43 -1.44 0 CA-C-O 123.54 1.638 . . . . 1.0 111.005 -167.254 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 36.9 m-20 -125.26 102.68 7.56 Favored 'General case' 0 N--CA 1.43 -1.459 0 O-C-N 120.648 -1.282 . . . . 1.0 109.696 169.129 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 36.7 m -94.14 125.14 38.59 Favored 'General case' 0 N--CA 1.429 -1.482 0 O-C-N 119.18 -2.2 . . . . 1.0 111.093 166.289 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -90.36 131.93 35.87 Favored 'General case' 0 N--CA 1.429 -1.493 0 C-N-CA 125.074 1.35 . . . . 1.0 110.906 -176.298 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 3.3 mm -105.56 105.77 19.29 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.489 0 C-N-CA 126.479 1.912 . . . . 1.0 106.238 -178.836 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -132.89 63.81 1.63 Allowed 'General case' 0 N--CA 1.429 -1.475 0 O-C-N 121.392 -0.818 . . . . 1.0 111.613 -176.129 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . 33.46 67.4 0.22 Allowed Glycine 0 N--CA 1.43 -1.748 0 C-N-CA 128.671 3.034 . . . . 1.0 119.559 169.467 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 114.89 -22.67 12.4 Favored Glycine 0 N--CA 1.431 -1.645 0 N-CA-C 111.031 -0.827 . . . . 1.0 111.031 -173.933 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 72.8 t -109.63 137.22 42.81 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.424 0 C-N-CA 124.676 1.19 . . . . 1.0 108.269 173.889 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 42.8 mt -119.57 129.75 54.8 Favored 'General case' 0 N--CA 1.43 -1.464 0 O-C-N 120.812 -1.18 . . . . 1.0 108.923 154.557 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -122.95 118.14 27.15 Favored 'General case' 0 N--CA 1.429 -1.48 0 CA-C-O 122.91 1.338 . . . . 1.0 108.237 177.103 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 81.7 mt -97.3 128.38 48.62 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.439 0 O-C-N 120.638 -1.289 . . . . 1.0 108.398 -172.763 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 69.5 p -129.62 122.19 28.58 Favored 'General case' 0 N--CA 1.429 -1.517 0 CA-C-O 122.018 0.913 . . . . 1.0 113.205 175.271 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 43' ' ' PHE . . . . . . . . . . . . . 5.2 p90 -120.49 167.73 12.07 Favored 'General case' 0 N--CA 1.431 -1.412 0 C-N-CA 125.003 1.321 . . . . 1.0 109.544 166.138 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 40.4 mt-10 -52.4 -36.1 53.37 Favored 'General case' 0 N--CA 1.431 -1.418 0 N-CA-C 118.63 2.826 . . . . 1.0 118.63 -171.308 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 74.1 m-20 -67.47 -4.22 10.75 Favored 'General case' 0 N--CA 1.429 -1.516 0 O-C-N 120.229 -1.545 . . . . 1.0 115.095 177.495 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 75.54 22.46 75.29 Favored Glycine 0 N--CA 1.432 -1.597 0 O-C-N 120.073 -1.642 . . . . 1.0 115.536 160.881 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 53.5 m -73.65 -47.06 42.77 Favored 'General case' 0 N--CA 1.43 -1.447 0 C-N-CA 124.622 1.169 . . . . 1.0 112.956 -175.175 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 86.0 mttt 75.54 107.55 0.08 Allowed 'General case' 0 N--CA 1.429 -1.479 0 C-N-CA 126.889 2.076 . . . . 1.0 114.768 170.697 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 2.7 mm -102.18 136.23 35.35 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.429 0 N-CA-C 107.367 -1.346 . . . . 1.0 107.367 -177.095 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 9.3 mm -126.18 105.25 14.18 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.437 0 C-N-CA 124.075 0.95 . . . . 1.0 109.359 -169.587 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 3.5 mt -126.88 128.25 70.63 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.416 0 O-C-N 120.249 -1.532 . . . . 1.0 109.936 -170.823 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 51.8 t-20 -161.87 170.84 18.74 Favored 'General case' 0 N--CA 1.43 -1.469 0 N-CA-C 105.197 -2.149 . . . . 1.0 105.197 -167.856 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -156.61 138.03 13.93 Favored 'General case' 0 N--CA 1.43 -1.465 0 O-C-N 121.185 -0.947 . . . . 1.0 113.194 -163.674 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 86.9 mm-40 -99.33 105.21 17.18 Favored 'General case' 0 N--CA 1.431 -1.416 0 C-N-CA 125.71 1.604 . . . . 1.0 109.096 166.574 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . 0.272 9.7 tt0 -65.64 -52.46 43.3 Favored Pre-proline 0 N--CA 1.431 -1.379 0 N-CA-C 116.891 2.182 . . . . 1.0 116.891 -164.419 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 51.7 Cg_exo -68.57 -21.0 40.33 Favored 'Trans proline' 0 C--N 1.299 -2.071 0 CA-C-N 126.3 3.286 . . . . 1.0 115.342 -177.591 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 32.3 mt -74.96 -25.52 58.92 Favored 'General case' 0 N--CA 1.429 -1.495 0 CA-C-N 119.507 1.048 . . . . 1.0 112.019 -174.955 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 25.5 m170 79.38 30.42 0.3 Allowed 'General case' 0 N--CA 1.431 -1.423 0 C-N-CA 128.056 2.543 . . . . 1.0 113.018 -178.767 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 65.1 mt-30 -120.02 132.63 55.53 Favored 'General case' 0 N--CA 1.43 -1.427 0 O-C-N 120.271 -1.518 . . . . 1.0 110.292 176.283 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 8.0 t -90.44 151.57 3.47 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.404 0 N-CA-C 106.515 -1.661 . . . . 1.0 106.515 163.178 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 61' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -111.38 145.65 38.52 Favored 'General case' 0 N--CA 1.43 -1.439 0 O-C-N 120.28 -1.512 . . . . 1.0 107.769 168.866 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 2.6 pt? -138.12 111.25 7.86 Favored 'General case' 0 N--CA 1.432 -1.361 0 O-C-N 120.966 -1.083 . . . . 1.0 108.299 173.471 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . 0.453 ' HA ' ' HA2' ' A' ' 68' ' ' GLY . . . -101.6 144.08 30.78 Favored 'General case' 0 N--CA 1.429 -1.48 0 CA-C-O 123.626 1.679 . . . . 1.0 112.291 169.808 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 64' ' ' THR . . . . . . . . . . . . . 39.1 p -150.61 -165.82 2.37 Favored 'General case' 0 N--CA 1.43 -1.431 0 CA-C-N 113.034 -1.894 . . . . 1.0 107.991 -145.973 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 11.7 mmtt -65.13 -43.37 92.17 Favored 'General case' 0 N--CA 1.43 -1.47 0 N-CA-C 115.025 1.491 . . . . 1.0 115.025 168.583 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 29.6 mp0 -79.12 -25.56 42.94 Favored 'General case' 0 N--CA 1.43 -1.462 0 O-C-N 120.208 -1.558 . . . . 1.0 115.075 -170.208 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 159.69 -48.5 0.4 Allowed Glycine 0 N--CA 1.43 -1.735 0 O-C-N 120.37 -1.456 . . . . 1.0 114.557 176.001 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 68' ' ' GLY . . . . . 0.453 ' HA2' ' HA ' ' A' ' 63' ' ' ALA . . . 120.39 121.36 2.87 Favored Glycine 0 N--CA 1.43 -1.725 0 CA-C-O 122.569 1.094 . . . . 1.0 114.901 -179.575 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 23.0 m-30 -122.37 171.09 9.31 Favored 'General case' 0 N--CA 1.429 -1.493 0 C-N-CA 125.499 1.52 . . . . 1.0 108.879 -177.253 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 70' ' ' HIS . . . . . 0.426 ' CE1' ' OD2' ' A' ' 81' ' ' ASP . 4.5 p80 -122.57 161.73 23.15 Favored 'General case' 0 N--CA 1.43 -1.434 0 O-C-N 120.293 -1.505 . . . . 1.0 109.384 169.102 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 71' ' ' PHE . . . . . . . . . . . . 0.286 37.3 t80 -139.43 122.29 16.59 Favored 'General case' 0 N--CA 1.431 -1.398 0 C-N-CA 124.116 0.967 . . . . 1.0 111.57 -145.953 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 11.9 m-20 -129.16 148.86 51.13 Favored 'General case' 0 N--CA 1.43 -1.426 0 C-N-CA 125.329 1.452 . . . . 1.0 113.044 -177.312 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 3.0 tm? -84.42 114.64 22.05 Favored 'General case' 0 N--CA 1.43 -1.457 0 C-N-CA 127.041 2.136 . . . . 1.0 111.699 -179.592 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 76.7 tttt -89.48 -52.6 4.94 Favored 'General case' 0 N--CA 1.43 -1.47 0 O-C-N 120.959 -1.088 . . . . 1.0 110.931 174.463 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -164.65 -78.79 0.04 OUTLIER Glycine 0 N--CA 1.43 -1.76 0 O-C-N 120.688 -1.258 . . . . 1.0 114.069 177.052 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 50.9 m-20 -96.03 -5.25 41.5 Favored 'General case' 0 N--CA 1.43 -1.45 0 O-C-N 120.366 -1.667 . . . . 1.0 111.357 -176.634 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 5.0 mt-10 -159.05 161.27 36.49 Favored 'General case' 0 CA--C 1.488 -1.404 0 N-CA-C 101.428 -3.545 . . . . 1.0 101.428 -176.286 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 78' ' ' TRP . . . . . . . . . . . . . 23.6 m95 -94.44 142.15 27.76 Favored 'General case' 0 N--CA 1.43 -1.439 0 N-CA-C 104.409 -2.441 . . . . 1.0 104.409 175.066 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 0.6 OUTLIER -93.71 149.93 4.14 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.399 0 N-CA-C 105.374 -2.084 . . . . 1.0 105.374 169.844 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 80' ' ' CYS . . . . . 0.417 ' HB2' ' HB2' ' A' ' 85' ' ' GLU . 90.0 m -88.61 114.39 25.18 Favored 'General case' 0 N--CA 1.43 -1.474 0 N-CA-C 106.383 -1.71 . . . . 1.0 106.383 169.972 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 81' ' ' ASP . . . . . 0.426 ' OD2' ' CE1' ' A' ' 70' ' ' HIS . 21.1 t70 -61.54 -55.2 33.58 Favored 'General case' 0 N--CA 1.431 -1.414 0 C-N-CA 127.6 2.36 . . . . 1.0 113.949 -162.536 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -51.07 -61.34 2.29 Favored 'General case' 0 N--CA 1.43 -1.451 0 C-N-CA 126.675 1.99 . . . . 1.0 115.603 -165.878 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 68.4 m -85.01 -31.96 23.19 Favored 'General case' 0 N--CA 1.431 -1.396 0 O-C-N 120.558 -1.339 . . . . 1.0 111.95 174.934 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 97.51 79.93 1.5 Allowed Glycine 0 N--CA 1.43 -1.7 0 N-CA-C 109.699 -1.36 . . . . 1.0 109.699 -169.215 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 85' ' ' GLU . . . . . 0.417 ' HB2' ' HB2' ' A' ' 80' ' ' CYS . 36.8 mm-40 -142.32 -161.14 1.19 Allowed 'General case' 0 N--CA 1.428 -1.554 0 N-CA-C 106.967 -1.494 . . . . 1.0 106.967 -174.439 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 89.5 m -137.96 142.8 40.51 Favored 'General case' 0 N--CA 1.429 -1.495 0 O-C-N 119.727 -1.858 . . . . 1.0 109.863 -161.233 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 1.1 t80 -38.63 -94.37 0.0 OUTLIER 'General case' 0 N--CA 1.43 -1.461 0 C-N-CA 128.005 2.522 . . . . 1.0 117.807 177.055 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 88' ' ' TRP . . . . . 0.446 ' HB2' ' HG2' ' A' ' 106' ' ' ARG . 19.1 m95 -76.12 -26.53 56.45 Favored 'General case' 0 N--CA 1.43 -1.462 0 O-C-N 120.308 -1.495 . . . . 1.0 111.331 -166.968 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -59.85 -50.66 72.91 Favored 'General case' 0 N--CA 1.43 -1.461 0 C-N-CA 125.857 1.663 . . . . 1.0 113.554 172.258 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 46.3 tp -68.5 -43.67 76.36 Favored 'General case' 0 N--CA 1.43 -1.462 0 O-C-N 119.652 -1.905 . . . . 1.0 111.077 179.0 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 10.3 tt -50.53 -49.85 54.74 Favored 'General case' 0 N--CA 1.43 -1.427 0 C-N-CA 125.636 1.574 . . . . 1.0 113.449 172.749 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 16.8 tt0 -55.57 -49.08 73.67 Favored 'General case' 0 N--CA 1.43 -1.465 0 C-N-CA 127.018 2.127 . . . . 1.0 113.281 173.943 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 51.0 mt-30 -60.36 -48.3 82.34 Favored 'General case' 0 N--CA 1.431 -1.393 0 O-C-N 120.766 -1.209 . . . . 1.0 113.743 175.944 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -58.78 -49.33 78.06 Favored 'General case' 0 N--CA 1.43 -1.438 0 C-N-CA 125.378 1.471 . . . . 1.0 113.171 174.277 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -59.94 -45.91 91.1 Favored 'General case' 0 N--CA 1.429 -1.509 0 C-N-CA 126.143 1.777 . . . . 1.0 114.115 177.576 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 96.4 m -60.93 -36.47 79.41 Favored 'General case' 0 N--CA 1.431 -1.399 0 C-N-CA 125.713 1.605 . . . . 1.0 112.526 178.25 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -69.05 -59.62 2.92 Favored 'General case' 0 N--CA 1.428 -1.528 0 C-N-CA 124.388 1.075 . . . . 1.0 113.317 170.243 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 5.4 pt20 -76.54 -19.64 57.71 Favored 'General case' 0 N--CA 1.431 -1.406 0 N-CA-C 116.016 1.858 . . . . 1.0 116.016 -166.134 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -97.92 -35.98 10.31 Favored 'General case' 0 N--CA 1.431 -1.408 0 C-N-CA 124.793 1.237 . . . . 1.0 112.224 169.579 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . 106.95 10.76 27.63 Favored Glycine 0 N--CA 1.429 -1.77 0 N-CA-C 116.222 1.249 . . . . 1.0 116.222 170.048 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 6.7 pt-20 -149.34 160.98 42.95 Favored 'General case' 0 N--CA 1.43 -1.425 0 N-CA-C 105.655 -1.979 . . . . 1.0 105.655 -177.416 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 18.4 m -65.8 111.43 3.25 Favored 'General case' 0 N--CA 1.429 -1.482 0 CA-C-N 120.804 1.638 . . . . 1.0 112.177 -178.595 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 60.7 t -94.86 107.68 19.78 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.415 0 CA-C-O 122.993 1.378 . . . . 1.0 109.394 -178.005 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 70.0 m -80.2 106.15 12.0 Favored 'General case' 0 N--CA 1.43 -1.456 0 C-N-CA 124.622 1.169 . . . . 1.0 111.336 -176.516 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -140.58 -12.02 1.02 Allowed 'General case' 0 N--CA 1.43 -1.458 0 C-N-CA 123.133 0.573 . . . . 1.0 109.875 168.625 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 106' ' ' ARG . . . . . 0.446 ' HG2' ' HB2' ' A' ' 88' ' ' TRP . 0.0 OUTLIER . . . . . 0 C--O 1.261 1.69 0 C-N-CA 126.592 1.957 . . . . 1.0 110.882 179.212 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 17.9 t-20 . . . . . 0 N--CA 1.43 -1.434 0 CA-C-O 122.297 1.046 . . . . 1.0 110.238 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -64.0 -30.79 71.84 Favored 'General case' 0 CA--C 1.489 -1.402 0 C-N-CA 126.095 1.758 . . . . 1.0 114.614 -176.136 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 48.0 p -65.45 -46.87 78.17 Favored 'General case' 0 N--CA 1.43 -1.441 0 O-C-N 120.483 -1.386 . . . . 1.0 113.882 174.971 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 40.2 tt0 -68.03 -44.69 75.9 Favored 'General case' 0 N--CA 1.431 -1.422 0 O-C-N 120.606 -1.308 . . . . 1.0 112.723 176.668 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 28.3 t80 -50.4 -49.38 54.76 Favored 'General case' 0 N--CA 1.43 -1.439 0 N-CA-C 114.123 1.157 . . . . 1.0 114.123 168.856 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 1.2 t60 -61.03 -38.6 86.69 Favored 'General case' 0 N--CA 1.429 -1.498 0 O-C-N 120.649 -1.282 . . . . 1.0 114.382 175.048 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 1.2 mpt_? -56.26 -56.94 14.81 Favored 'General case' 0 N--CA 1.43 -1.426 0 CA-C-N 120.629 1.558 . . . . 1.0 112.185 172.816 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 80.4 mt -63.96 -41.57 97.54 Favored 'General case' 0 N--CA 1.429 -1.492 0 N-CA-C 114.135 1.161 . . . . 1.0 114.135 -179.161 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -67.18 -41.31 86.11 Favored 'General case' 0 N--CA 1.43 -1.474 0 C-N-CA 125.446 1.498 . . . . 1.0 114.774 -179.472 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -66.41 -38.76 88.19 Favored 'General case' 0 N--CA 1.431 -1.409 0 O-C-N 120.305 -1.497 . . . . 1.0 112.025 172.346 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 3.6 mt-30 -56.38 -54.09 49.63 Favored 'General case' 0 N--CA 1.43 -1.442 0 N-CA-C 115.829 1.788 . . . . 1.0 115.829 170.142 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 4.3 pp -63.91 -39.31 93.88 Favored 'General case' 0 N--CA 1.429 -1.479 0 N-CA-C 114.469 1.285 . . . . 1.0 114.469 179.387 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 7.3 m0 -49.71 -49.5 47.55 Favored 'General case' 0 N--CA 1.429 -1.481 0 N-CA-C 114.552 1.315 . . . . 1.0 114.552 168.759 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 41.9 tp -61.54 -51.52 68.23 Favored 'General case' 0 N--CA 1.429 -1.507 0 C-N-CA 124.21 1.004 . . . . 1.0 113.618 176.251 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 17.0 m -57.07 -43.08 81.75 Favored 'General case' 0 N--CA 1.43 -1.464 0 C-N-CA 125.613 1.565 . . . . 1.0 113.978 177.384 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 87.9 mt -59.12 -49.9 81.67 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.504 0 O-C-N 120.573 -1.33 . . . . 1.0 113.162 173.144 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 72.5 tt0 -63.02 -48.58 78.14 Favored 'General case' 0 N--CA 1.43 -1.473 0 O-C-N 120.594 -1.316 . . . . 1.0 112.715 -179.86 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 27.0 mm-40 -48.44 -59.72 3.25 Favored 'General case' 0 N--CA 1.428 -1.537 0 C-N-CA 126.569 1.948 . . . . 1.0 114.316 172.527 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 3.1 tpm_? -62.79 -37.82 88.19 Favored 'General case' 0 N--CA 1.43 -1.451 0 N-CA-C 113.8 1.037 . . . . 1.0 113.8 -176.627 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 4.3 mm? -70.65 -44.63 66.71 Favored 'General case' 0 N--CA 1.43 -1.456 0 O-C-N 120.482 -1.386 . . . . 1.0 113.7 177.084 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 25.5 t70 -68.24 -39.3 82.32 Favored 'General case' 0 N--CA 1.429 -1.475 0 O-C-N 120.775 -1.203 . . . . 1.0 113.542 -178.54 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 35.8 t70 -64.84 -26.59 68.4 Favored 'General case' 0 N--CA 1.43 -1.475 0 C-N-CA 125.841 1.656 . . . . 1.0 113.624 178.681 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 24' ' ' TRP . . . . . . . . . . . . . 0.1 OUTLIER -99.46 -145.84 0.33 Allowed 'General case' 0 N--CA 1.429 -1.48 0 N-CA-C 115.074 1.509 . . . . 1.0 115.074 -167.939 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . 0.306 0.9 OUTLIER 55.35 -157.44 0.23 Allowed 'General case' 0 N--CA 1.43 -1.449 0 C-N-CA 128.819 2.848 . . . . 1.0 116.221 -175.282 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 155.67 -44.85 0.54 Allowed Glycine 0 N--CA 1.432 -1.613 0 O-C-N 120.464 -1.397 . . . . 1.0 112.247 -179.019 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -77.68 -30.87 52.2 Favored 'General case' 0 N--CA 1.432 -1.368 0 CA-C-O 122.165 0.983 . . . . 1.0 111.595 -178.51 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 63.4 m -112.64 166.26 11.51 Favored 'General case' 0 N--CA 1.43 -1.435 0 C-N-CA 124.652 1.181 . . . . 1.0 110.136 174.742 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 29.8 t70 -93.5 141.22 28.71 Favored 'General case' 0 N--CA 1.43 -1.446 0 N-CA-C 106.904 -1.517 . . . . 1.0 106.904 167.421 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 5.8 tp -141.99 124.06 13.56 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.463 0 C-N-CA 126.376 1.871 . . . . 1.0 106.01 -169.558 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 13.7 t70 -140.48 128.55 22.16 Favored 'General case' 0 N--CA 1.43 -1.467 0 O-C-N 120.611 -1.306 . . . . 1.0 110.058 169.044 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 43.3 t -95.1 131.81 40.69 Favored 'General case' 0 N--CA 1.43 -1.43 0 O-C-N 120.018 -1.676 . . . . 1.0 108.074 173.509 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 23.3 mt-10 -107.62 140.27 40.9 Favored 'General case' 0 N--CA 1.429 -1.506 0 O-C-N 120.99 -1.069 . . . . 1.0 108.762 -170.242 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 3.1 tp -114.58 109.38 28.27 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.44 0 N-CA-C 105.617 -1.994 . . . . 1.0 105.617 167.011 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 77.5 m-20 -125.73 126.1 44.06 Favored 'General case' 0 N--CA 1.43 -1.427 0 N-CA-C 106.889 -1.523 . . . . 1.0 106.889 168.522 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . 67.42 -103.68 0.99 Allowed Glycine 0 N--CA 1.43 -1.728 0 C-N-CA 125.039 1.304 . . . . 1.0 112.607 -174.963 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -139.73 25.44 2.7 Favored Glycine 0 N--CA 1.43 -1.738 0 C-N-CA 124.186 0.898 . . . . 1.0 111.408 171.839 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 46.9 t -112.23 130.53 65.75 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.516 0 N-CA-C 106.97 -1.493 . . . . 1.0 106.97 179.063 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 23.9 mt -99.73 120.34 39.57 Favored 'General case' 0 N--CA 1.429 -1.499 0 CA-C-O 123.208 1.48 . . . . 1.0 107.883 172.141 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 1.6 p -113.76 122.33 46.77 Favored 'General case' 0 N--CA 1.43 -1.454 0 N-CA-C 106.995 -1.483 . . . . 1.0 106.995 179.63 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 61.7 mt -93.89 112.62 27.09 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.431 0 N-CA-C 105.787 -1.931 . . . . 1.0 105.787 -177.794 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 27.2 p -121.77 126.41 48.8 Favored 'General case' 0 N--CA 1.43 -1.448 0 CA-C-O 122.441 1.115 . . . . 1.0 113.221 -167.919 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 43' ' ' PHE . . . . . . . . . . . . . 3.0 p90 -120.77 167.76 12.14 Favored 'General case' 0 N--CA 1.43 -1.443 0 CA-C-O 122.749 1.261 . . . . 1.0 111.59 178.675 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -56.61 -33.01 65.85 Favored 'General case' 0 N--CA 1.43 -1.435 0 C-N-CA 127.953 2.501 . . . . 1.0 117.037 -170.077 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 70.9 m-80 -67.09 -15.8 63.94 Favored 'General case' 0 N--CA 1.431 -1.425 0 N-CA-C 115.037 1.495 . . . . 1.0 115.037 175.427 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 88.2 13.13 64.43 Favored Glycine 0 N--CA 1.431 -1.64 0 O-C-N 119.676 -1.89 . . . . 1.0 115.475 167.447 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 56.8 m -98.65 149.89 22.33 Favored 'General case' 0 N--CA 1.429 -1.504 0 N-CA-C 107.336 -1.357 . . . . 1.0 107.336 167.693 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -128.49 150.88 49.97 Favored 'General case' 0 N--CA 1.429 -1.5 0 O-C-N 121.378 -0.826 . . . . 1.0 110.063 -168.236 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 3.1 mm -105.17 133.31 49.77 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.508 0 N-CA-C 105.527 -2.027 . . . . 1.0 105.527 166.546 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 50' ' ' ILE . . . . . 0.478 ' HB ' ' HB3' ' A' ' 63' ' ' ALA . 5.7 mm -116.64 117.74 56.47 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.484 0 CA-C-N 119.733 1.151 . . . . 1.0 109.617 -173.158 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 3.2 mt -126.93 116.27 44.13 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.432 0 CA-C-O 124.047 1.88 . . . . 1.0 112.179 -175.469 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 52' ' ' ASN . . . . . 0.636 ' H ' ' HD1' ' A' ' 61' ' ' TRP . 56.2 t30 -141.82 170.63 15.35 Favored 'General case' 0 N--CA 1.43 -1.449 0 C-N-CA 128.354 2.662 . . . . 1.0 106.27 -179.274 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -154.29 130.89 10.66 Favored 'General case' 0 N--CA 1.431 -1.408 0 CA-C-O 122.834 1.302 . . . . 1.0 109.289 -170.365 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 28.9 mm-40 -89.73 129.87 36.08 Favored 'General case' 0 N--CA 1.429 -1.477 0 N-CA-C 106.531 -1.655 . . . . 1.0 106.531 175.921 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 67.6 mt-10 -63.75 -47.99 80.56 Favored Pre-proline 0 N--CA 1.431 -1.42 0 N-CA-C 116.687 2.106 . . . . 1.0 116.687 -179.606 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 97.3 Cg_endo -74.52 153.39 44.26 Favored 'Trans proline' 0 C--N 1.299 -2.036 0 CA-C-N 126.531 3.368 . . . . 1.0 111.388 163.403 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . 0.388 5.4 mp 72.57 143.05 0.06 Allowed 'General case' 0 N--CA 1.43 -1.457 0 CA-C-O 124.754 2.216 . . . . 1.0 113.445 -168.203 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 21.2 m170 -88.93 44.32 1.2 Allowed 'General case' 0 N--CA 1.43 -1.446 0 C-N-CA 125.318 1.447 . . . . 1.0 112.904 -175.899 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 11.7 pt20 -140.0 145.44 37.81 Favored 'General case' 0 N--CA 1.43 -1.456 0 O-C-N 120.045 -1.66 . . . . 1.0 110.53 -172.077 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 86.7 t -111.88 156.08 13.05 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.457 0 N-CA-C 107.023 -1.473 . . . . 1.0 107.023 -178.679 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 61' ' ' TRP . . . . . 0.636 ' HD1' ' H ' ' A' ' 52' ' ' ASN . 0.0 OUTLIER -102.06 152.35 21.08 Favored 'General case' 0 N--CA 1.43 -1.455 0 O-C-N 120.054 -1.653 . . . . 1.0 113.011 174.784 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 75.6 mt -127.91 107.54 9.94 Favored 'General case' 0 CA--C 1.488 -1.409 0 N-CA-C 106.994 -1.484 . . . . 1.0 106.994 166.175 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . 0.478 ' HB3' ' HB ' ' A' ' 50' ' ' ILE . . . -95.19 145.14 25.25 Favored 'General case' 0 N--CA 1.429 -1.476 0 CA-C-O 122.801 1.286 . . . . 1.0 111.16 163.288 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 64' ' ' THR . . . . . . . . . . . . . 69.2 p -150.3 -168.1 3.01 Favored 'General case' 0 N--CA 1.43 -1.462 0 C-N-CA 126.182 1.793 . . . . 1.0 108.617 -150.583 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 7.1 tmtm? -62.12 -46.82 87.33 Favored 'General case' 0 N--CA 1.431 -1.411 0 C-N-CA 125.889 1.676 . . . . 1.0 112.435 174.693 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 48.9 tt0 -78.04 -24.51 47.75 Favored 'General case' 0 N--CA 1.429 -1.519 0 N-CA-C 114.516 1.302 . . . . 1.0 114.516 -170.718 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 151.06 -53.14 0.49 Allowed Glycine 0 N--CA 1.43 -1.725 0 O-C-N 120.893 -1.129 . . . . 1.0 110.89 176.963 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 134.83 162.06 9.67 Favored Glycine 0 N--CA 1.43 -1.736 0 CA-C-O 122.818 1.232 . . . . 1.0 115.839 174.448 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 4.7 m-85 -135.32 161.99 33.85 Favored 'General case' 0 N--CA 1.43 -1.442 0 C-N-CA 126.415 1.886 . . . . 1.0 107.148 -173.318 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 25.0 p80 -114.98 159.72 20.43 Favored 'General case' 0 N--CA 1.43 -1.433 0 O-C-N 119.797 -1.815 . . . . 1.0 108.586 156.025 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 37.3 p90 -136.96 141.47 42.61 Favored 'General case' 0 N--CA 1.43 -1.471 0 N-CA-C 114.694 1.368 . . . . 1.0 114.694 -168.755 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 8.9 m-20 -121.63 175.81 6.03 Favored 'General case' 0 N--CA 1.429 -1.491 0 C-N-CA 126.448 1.899 . . . . 1.0 110.391 -170.495 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 27.1 tp -113.82 110.25 19.84 Favored 'General case' 0 N--CA 1.429 -1.521 0 O-C-N 119.718 -1.864 . . . . 1.0 113.072 -174.616 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 12.2 mmmt -68.41 -42.46 78.96 Favored 'General case' 0 N--CA 1.431 -1.379 0 O-C-N 120.497 -1.377 . . . . 1.0 112.641 168.45 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . 165.08 -86.9 0.1 Allowed Glycine 0 N--CA 1.43 -1.764 0 N-CA-C 110.074 -1.211 . . . . 1.0 110.074 176.997 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 11.6 t0 -91.82 29.65 1.52 Allowed 'General case' 0 N--CA 1.43 -1.46 0 O-C-N 120.988 -1.301 . . . . 1.0 111.96 176.659 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 2.1 pt-20 -169.07 124.61 0.89 Allowed 'General case' 0 N--CA 1.429 -1.484 0 C-N-CA 126.33 1.852 . . . . 1.0 106.523 -173.772 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 78' ' ' TRP . . . . . . . . . . . . . 89.9 m95 -80.46 130.67 35.3 Favored 'General case' 0 N--CA 1.43 -1.462 0 N-CA-C 106.339 -1.726 . . . . 1.0 106.339 162.627 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -124.55 141.12 45.73 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.436 0 O-C-N 119.313 -2.117 . . . . 1.0 109.866 -173.777 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 21.2 m -81.64 121.17 26.01 Favored 'General case' 0 N--CA 1.429 -1.492 0 O-C-N 120.243 -1.535 . . . . 1.0 113.21 -172.572 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 30.0 t70 -83.11 58.33 4.38 Favored 'General case' 0 N--CA 1.43 -1.465 0 O-C-N 119.769 -1.832 . . . . 1.0 112.467 -173.172 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 15.6 tpt85 -170.45 101.29 0.26 Allowed 'General case' 0 N--CA 1.43 -1.437 0 O-C-N 120.433 -1.417 . . . . 1.0 110.053 178.039 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 4.3 t 79.48 -50.28 0.4 Allowed 'General case' 0 N--CA 1.43 -1.463 0 C-N-CA 126.695 1.998 . . . . 1.0 116.121 169.039 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -153.79 96.15 0.16 Allowed Glycine 0 N--CA 1.43 -1.732 0 O-C-N 120.214 -1.554 . . . . 1.0 110.015 -172.593 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 5.5 pt-20 -82.43 102.71 11.48 Favored 'General case' 0 N--CA 1.428 -1.539 0 N-CA-C 117.99 2.589 . . . . 1.0 117.99 -162.834 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 10.4 m -165.66 126.71 1.89 Allowed 'General case' 0 N--CA 1.43 -1.458 0 O-C-N 119.543 -1.973 . . . . 1.0 113.339 172.333 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 3.0 t80 -57.09 -84.34 0.01 OUTLIER 'General case' 0 N--CA 1.43 -1.438 0 N-CA-C 118.018 2.599 . . . . 1.0 118.018 177.192 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 88' ' ' TRP . . . . . . . . . . . . . 46.7 m95 -61.38 -27.81 68.79 Favored 'General case' 0 N--CA 1.431 -1.424 0 C-N-CA 125.876 1.67 . . . . 1.0 113.324 -167.295 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -77.27 -45.03 27.69 Favored 'General case' 0 N--CA 1.429 -1.492 0 C-N-CA 126.685 1.994 . . . . 1.0 112.896 179.558 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 25.6 tp -71.36 -38.89 71.56 Favored 'General case' 0 N--CA 1.429 -1.489 0 O-C-N 118.875 -2.391 . . . . 1.0 112.734 176.951 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 17.7 tp -51.58 -44.98 62.96 Favored 'General case' 0 N--CA 1.431 -1.391 0 C-N-CA 126.608 1.963 . . . . 1.0 114.483 168.027 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 38.5 tt0 -56.66 -47.18 80.37 Favored 'General case' 0 N--CA 1.431 -1.407 0 C-N-CA 126.318 1.847 . . . . 1.0 113.93 170.168 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 38.1 tt0 -57.05 -50.77 71.73 Favored 'General case' 0 N--CA 1.43 -1.448 0 C-N-CA 125.63 1.572 . . . . 1.0 114.427 176.938 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -56.56 -48.49 77.21 Favored 'General case' 0 N--CA 1.429 -1.478 0 C-N-CA 126.148 1.779 . . . . 1.0 114.121 173.969 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -65.69 -48.77 70.91 Favored 'General case' 0 N--CA 1.431 -1.415 0 O-C-N 120.339 -1.476 . . . . 1.0 113.682 179.45 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 94.0 m -47.13 -51.45 18.05 Favored 'General case' 0 N--CA 1.43 -1.465 0 C-N-CA 127.38 2.272 . . . . 1.0 113.97 173.986 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 8.4 pt20 -72.98 -37.02 67.19 Favored 'General case' 0 N--CA 1.431 -1.421 0 N-CA-C 114.692 1.368 . . . . 1.0 114.692 -179.173 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 41.7 mt-30 -71.22 -42.08 69.37 Favored 'General case' 0 N--CA 1.431 -1.411 0 N-CA-C 115.655 1.724 . . . . 1.0 115.655 178.741 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -82.82 -41.21 19.36 Favored 'General case' 0 N--CA 1.431 -1.421 0 N-CA-C 113.622 0.971 . . . . 1.0 113.622 -179.604 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . 89.59 42.69 5.39 Favored Glycine 0 N--CA 1.431 -1.669 0 O-C-N 120.667 -1.271 . . . . 1.0 112.984 -177.991 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 4.3 tp10 -158.92 164.85 35.27 Favored 'General case' 0 N--CA 1.43 -1.468 0 N-CA-C 103.252 -2.869 . . . . 1.0 103.252 -177.291 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 90.4 m -76.88 87.21 3.45 Favored 'General case' 0 N--CA 1.431 -1.383 0 CA-C-N 120.533 1.515 . . . . 1.0 109.339 169.666 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 18.0 t -95.45 84.01 1.53 Allowed 'Isoleucine or valine' 0 N--CA 1.43 -1.426 0 CA-C-O 124.297 1.999 . . . . 1.0 108.73 -179.265 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 71.5 p -96.72 168.07 10.73 Favored 'General case' 0 N--CA 1.431 -1.403 0 C-N-CA 126.783 2.033 . . . . 1.0 111.114 -177.6 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 20.2 m-85 -104.57 -27.05 12.1 Favored 'General case' 0 N--CA 1.429 -1.479 0 O-C-N 120.768 -1.207 . . . . 1.0 109.278 162.134 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 16.5 mmm-85 . . . . . 0 C--O 1.259 1.602 0 C-N-CA 124.354 1.061 . . . . 1.0 111.409 -170.957 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 29.2 m-80 . . . . . 0 N--CA 1.43 -1.468 0 CA-C-O 121.815 0.817 . . . . 1.0 109.782 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 28.3 p-10 -69.71 -56.23 7.77 Favored 'General case' 0 CA--C 1.488 -1.408 0 C-N-CA 125.586 1.554 . . . . 1.0 113.777 -176.357 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 33.4 m -59.46 -45.07 92.67 Favored 'General case' 0 N--CA 1.431 -1.403 0 C-N-CA 124.698 1.199 . . . . 1.0 112.417 174.146 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 8.4 mm-40 -52.5 -63.29 1.19 Allowed 'General case' 0 N--CA 1.429 -1.482 0 C-N-CA 126.491 1.916 . . . . 1.0 113.137 178.297 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 7.6 m-85 -62.12 -27.59 69.04 Favored 'General case' 0 N--CA 1.43 -1.462 0 N-CA-C 115.838 1.792 . . . . 1.0 115.838 177.089 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 1.9 t-80 -61.52 -52.6 63.8 Favored 'General case' 0 N--CA 1.429 -1.475 0 N-CA-C 114.441 1.274 . . . . 1.0 114.441 171.792 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 35.4 mtm180 -69.63 -39.14 77.33 Favored 'General case' 0 N--CA 1.431 -1.375 0 O-C-N 120.474 -1.391 . . . . 1.0 113.973 -179.793 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 66.7 mt -58.55 -41.7 86.19 Favored 'General case' 0 N--CA 1.431 -1.42 0 C-N-CA 125.05 1.34 . . . . 1.0 113.223 173.648 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -62.99 -45.91 90.17 Favored 'General case' 0 N--CA 1.429 -1.483 0 C-N-CA 125.312 1.445 . . . . 1.0 112.668 176.293 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 8.2 t70 -53.69 -57.53 10.48 Favored 'General case' 0 N--CA 1.43 -1.463 0 C-N-CA 124.42 1.088 . . . . 1.0 113.242 174.846 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 16.7 pt20 -64.1 -37.49 87.64 Favored 'General case' 0 N--CA 1.429 -1.478 0 N-CA-C 116.267 1.951 . . . . 1.0 116.267 -177.907 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 3.3 pp -65.06 -43.54 91.89 Favored 'General case' 0 N--CA 1.43 -1.44 0 O-C-N 120.174 -1.578 . . . . 1.0 113.376 174.928 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 23.1 m0 -52.62 -50.67 62.65 Favored 'General case' 0 N--CA 1.431 -1.413 0 N-CA-C 115.329 1.603 . . . . 1.0 115.329 173.222 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 25.3 mt -59.06 -48.4 81.75 Favored 'General case' 0 N--CA 1.429 -1.483 0 CA-C-O 121.944 0.878 . . . . 1.0 112.854 176.456 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 47.7 m -66.6 -45.82 77.94 Favored 'General case' 0 N--CA 1.43 -1.436 0 N-CA-C 114.456 1.28 . . . . 1.0 114.456 -175.748 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 96.7 mt -58.03 -45.9 88.07 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.462 0 O-C-N 119.988 -1.695 . . . . 1.0 112.143 172.677 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 8.0 tt0 -58.91 -48.3 81.94 Favored 'General case' 0 N--CA 1.43 -1.442 0 O-C-N 121.626 -0.671 . . . . 1.0 112.59 176.705 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 33.7 tt0 -58.47 -44.87 89.48 Favored 'General case' 0 N--CA 1.431 -1.41 0 C-N-CA 125.161 1.384 . . . . 1.0 114.107 177.92 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -53.52 -52.52 59.37 Favored 'General case' 0 N--CA 1.43 -1.453 0 C-N-CA 124.184 0.994 . . . . 1.0 112.344 174.656 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 35.4 mt -69.99 -51.04 35.71 Favored 'General case' 0 N--CA 1.431 -1.412 0 N-CA-C 113.658 0.985 . . . . 1.0 113.658 -176.429 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 23.0 t70 -62.9 -41.92 99.61 Favored 'General case' 0 N--CA 1.429 -1.495 0 N-CA-C 115.146 1.536 . . . . 1.0 115.146 -178.174 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 23.6 t70 -74.01 -26.1 60.26 Favored 'General case' 0 N--CA 1.43 -1.438 0 O-C-N 120.182 -1.574 . . . . 1.0 113.066 -179.04 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 24' ' ' TRP . . . . . . . . . . . . . 67.7 t-105 -72.26 136.64 46.37 Favored 'General case' 0 N--CA 1.43 -1.471 0 O-C-N 119.742 -1.849 . . . . 1.0 112.63 177.569 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 34.3 t70 -138.95 150.26 45.69 Favored 'General case' 0 N--CA 1.43 -1.445 0 N-CA-C 106.926 -1.509 . . . . 1.0 106.926 179.273 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -163.91 -121.88 0.58 Allowed Glycine 0 N--CA 1.43 -1.757 0 O-C-N 121.29 -0.881 . . . . 1.0 111.599 -174.822 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 4.2 t0 -92.0 -32.25 15.29 Favored 'General case' 0 N--CA 1.43 -1.471 0 C-N-CA 125.357 1.463 . . . . 1.0 108.614 172.293 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 18.3 p -95.14 166.94 11.67 Favored 'General case' 0 N--CA 1.429 -1.482 0 C-N-CA 126.499 1.92 . . . . 1.0 111.591 179.335 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 2.6 t70 -132.03 178.91 6.42 Favored 'General case' 0 N--CA 1.43 -1.453 0 C-N-CA 124.677 1.191 . . . . 1.0 109.272 177.018 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 9.3 tp -157.21 134.02 2.2 Favored 'Isoleucine or valine' 0 N--CA 1.428 -1.542 0 C-N-CA 125.43 1.492 . . . . 1.0 107.072 -154.632 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 2.1 t70 -143.81 106.67 4.48 Favored 'General case' 0 N--CA 1.429 -1.495 0 O-C-N 120.241 -1.537 . . . . 1.0 109.445 162.783 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 71.2 m -90.68 132.62 35.68 Favored 'General case' 0 N--CA 1.431 -1.42 0 O-C-N 120.513 -1.367 . . . . 1.0 111.171 175.571 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 35.2 tt0 -107.27 132.01 53.57 Favored 'General case' 0 N--CA 1.43 -1.474 0 C-N-CA 126.365 1.866 . . . . 1.0 109.769 -168.138 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 2.8 tp -117.2 109.03 26.37 Favored 'Isoleucine or valine' 0 N--CA 1.428 -1.535 0 CA-C-O 124.547 2.118 . . . . 1.0 108.236 -172.314 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 3.5 t-20 -108.29 79.35 1.25 Allowed 'General case' 0 N--CA 1.429 -1.483 0 C-N-CA 125.575 1.55 . . . . 1.0 108.288 173.98 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . 75.52 -80.17 1.04 Allowed Glycine 0 N--CA 1.429 -1.771 0 O-C-N 120.326 -1.484 . . . . 1.0 114.998 173.291 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -142.66 37.35 1.54 Allowed Glycine 0 N--CA 1.43 -1.766 0 N-CA-C 108.987 -1.645 . . . . 1.0 108.987 173.384 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 69.7 t -133.67 117.77 28.02 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.404 0 N-CA-C 104.519 -2.4 . . . . 1.0 104.519 176.383 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -110.08 137.32 48.0 Favored 'General case' 0 N--CA 1.431 -1.42 0 CA-C-O 123.728 1.728 . . . . 1.0 111.781 177.042 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -133.06 125.2 29.1 Favored 'General case' 0 N--CA 1.429 -1.479 0 N-CA-C 106.142 -1.799 . . . . 1.0 106.142 -170.174 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 86.1 mt -99.89 134.07 40.6 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.481 0 N-CA-C 107.534 -1.284 . . . . 1.0 107.534 -169.192 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -131.7 126.67 35.13 Favored 'General case' 0 N--CA 1.431 -1.414 0 N-CA-C 112.643 0.609 . . . . 1.0 112.643 174.944 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 43' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -108.15 167.51 9.95 Favored 'General case' 0 N--CA 1.431 -1.405 0 C-N-CA 125.482 1.513 . . . . 1.0 109.437 174.278 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 70.3 mt-10 -55.86 -26.19 45.79 Favored 'General case' 0 N--CA 1.429 -1.484 0 N-CA-C 117.059 2.244 . . . . 1.0 117.059 179.644 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 27.7 t-20 -63.87 -18.15 63.88 Favored 'General case' 0 N--CA 1.43 -1.442 0 C-N-CA 126.374 1.869 . . . . 1.0 112.828 176.363 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 96.32 -6.32 65.82 Favored Glycine 0 N--CA 1.431 -1.652 0 O-C-N 120.311 -1.493 . . . . 1.0 111.313 176.345 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -79.18 166.36 22.29 Favored 'General case' 0 N--CA 1.431 -1.424 0 C-N-CA 128.033 2.533 . . . . 1.0 111.265 -177.914 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 10.5 ptpt -157.17 148.14 21.67 Favored 'General case' 0 N--CA 1.431 -1.417 0 O-C-N 120.672 -1.267 . . . . 1.0 113.599 -162.434 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 9.2 mm -123.6 142.83 38.89 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.445 0 N-CA-C 105.703 -1.962 . . . . 1.0 105.703 175.672 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 50' ' ' ILE . . . . . 0.551 HG23 ' HB3' ' A' ' 63' ' ' ALA . 4.1 tp -126.5 129.06 71.77 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.509 0 CA-C-N 120.753 1.615 . . . . 1.0 110.076 175.606 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 3.3 mt -124.99 124.84 68.52 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.464 0 C-N-CA 127.689 2.396 . . . . 1.0 111.139 -177.263 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 52' ' ' ASN . . . . . 0.526 ' H ' ' HD1' ' A' ' 61' ' ' TRP . 40.9 t30 -160.04 173.14 16.29 Favored 'General case' 0 N--CA 1.43 -1.456 0 C-N-CA 128.802 2.841 . . . . 1.0 104.564 -173.901 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -153.35 147.99 26.23 Favored 'General case' 0 N--CA 1.429 -1.48 0 O-C-N 119.629 -1.92 . . . . 1.0 113.333 -154.455 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 34.1 mm-40 -121.13 97.63 5.61 Favored 'General case' 0 N--CA 1.43 -1.453 0 C-N-CA 125.361 1.465 . . . . 1.0 112.002 -172.51 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 18.9 tt0 -69.6 -39.89 12.83 Favored Pre-proline 0 N--CA 1.431 -1.416 0 N-CA-C 116.574 2.064 . . . . 1.0 116.574 -174.988 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 52.7 Cg_exo -71.16 -22.62 25.59 Favored 'Trans proline' 0 N--CA 1.433 -2.072 0 CA-C-N 126.228 3.26 . . . . 1.0 114.844 174.794 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 33.2 mt -94.04 -30.92 14.44 Favored 'General case' 0 N--CA 1.431 -1.412 0 C-N-CA 122.895 0.478 . . . . 1.0 111.312 -168.581 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 3.4 m170 85.67 56.5 0.01 OUTLIER 'General case' 0 N--CA 1.43 -1.425 0 C-N-CA 127.581 2.352 . . . . 1.0 110.102 176.826 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 6.5 pt20 -156.23 157.66 36.22 Favored 'General case' 0 N--CA 1.43 -1.449 0 O-C-N 120.409 -1.432 . . . . 1.0 109.71 -178.468 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 79.2 t -121.06 151.43 24.12 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.511 0 N-CA-C 105.63 -1.989 . . . . 1.0 105.63 173.045 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 61' ' ' TRP . . . . . 0.526 ' HD1' ' H ' ' A' ' 52' ' ' ASN . 0.0 OUTLIER -102.21 151.76 21.83 Favored 'General case' 0 N--CA 1.43 -1.467 0 CA-C-N 121.122 1.783 . . . . 1.0 114.275 177.291 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 61.5 mt -123.28 101.72 7.53 Favored 'General case' 0 N--CA 1.43 -1.428 0 N-CA-C 107.03 -1.47 . . . . 1.0 107.03 166.503 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . 0.551 ' HB3' HG23 ' A' ' 50' ' ' ILE . . . -102.05 112.91 25.73 Favored 'General case' 0 N--CA 1.43 -1.435 0 O-C-N 121.05 -1.032 . . . . 1.0 110.517 170.889 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 64' ' ' THR . . . . . . . . . . . . . 77.1 p -119.62 -122.44 0.29 Allowed 'General case' 0 N--CA 1.43 -1.472 0 C-N-CA 126.749 2.02 . . . . 1.0 113.652 -156.782 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 13.7 tmtt? -96.69 -66.33 0.91 Allowed 'General case' 0 N--CA 1.43 -1.426 0 C-N-CA 126.047 1.739 . . . . 1.0 110.726 -170.678 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 20.0 tt0 -77.62 -24.0 49.69 Favored 'General case' 0 N--CA 1.429 -1.487 0 O-C-N 121.26 -0.9 . . . . 1.0 112.694 -176.773 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 172.08 -60.39 0.16 Allowed Glycine 0 N--CA 1.431 -1.68 0 O-C-N 120.398 -1.439 . . . . 1.0 110.18 178.855 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 88.1 170.18 45.74 Favored Glycine 0 N--CA 1.431 -1.678 0 C-N-CA 123.766 0.698 . . . . 1.0 112.521 -177.893 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -166.23 171.79 11.85 Favored 'General case' 0 N--CA 1.429 -1.475 0 C-N-CA 125.986 1.715 . . . . 1.0 110.065 179.398 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 70' ' ' HIS . . . . . 0.445 ' HA ' ' HA ' ' A' ' 61' ' ' TRP . 10.7 p80 -75.68 159.33 31.26 Favored 'General case' 0 N--CA 1.431 -1.393 0 N-CA-C 115.736 1.754 . . . . 1.0 115.736 -178.161 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 47.2 p90 -121.01 137.02 54.85 Favored 'General case' 0 N--CA 1.429 -1.48 0 N-CA-C 114.427 1.269 . . . . 1.0 114.427 -179.912 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 3.3 m-20 -127.56 172.58 10.6 Favored 'General case' 0 N--CA 1.43 -1.462 0 C-N-CA 126.642 1.977 . . . . 1.0 108.364 -174.246 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 19.2 mt -101.01 116.24 32.37 Favored 'General case' 0 N--CA 1.43 -1.442 0 O-C-N 119.837 -1.789 . . . . 1.0 111.893 178.228 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 39.7 mmtm -67.74 -47.71 68.51 Favored 'General case' 0 N--CA 1.429 -1.495 0 O-C-N 120.743 -1.223 . . . . 1.0 111.491 151.889 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . 179.69 -81.81 0.06 OUTLIER Glycine 0 N--CA 1.431 -1.696 0 O-C-N 120.176 -1.578 . . . . 1.0 114.159 176.502 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -89.7 -8.3 52.66 Favored 'General case' 0 N--CA 1.43 -1.474 0 C-N-CA 125.386 1.474 . . . . 1.0 109.173 170.383 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 16.0 mt-10 -124.39 123.01 39.24 Favored 'General case' 0 N--CA 1.429 -1.485 0 N-CA-C 103.797 -2.668 . . . . 1.0 103.797 -172.227 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 78' ' ' TRP . . . . . . . . . . . . . 81.4 m95 -86.31 135.35 33.57 Favored 'General case' 0 N--CA 1.43 -1.464 0 N-CA-C 105.508 -2.034 . . . . 1.0 105.508 164.317 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -129.7 153.17 38.42 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.472 0 O-C-N 119.98 -1.7 . . . . 1.0 107.936 -171.551 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 64.3 m -85.91 147.24 26.35 Favored 'General case' 0 N--CA 1.43 -1.43 0 O-C-N 120.46 -1.4 . . . . 1.0 112.591 -177.48 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 28.3 t70 -63.77 -39.94 95.49 Favored 'General case' 0 N--CA 1.431 -1.404 0 O-C-N 119.7 -1.875 . . . . 1.0 115.679 -174.242 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 12.3 ptm180 -130.5 177.22 7.52 Favored 'General case' 0 N--CA 1.43 -1.436 0 O-C-N 120.699 -1.251 . . . . 1.0 112.016 174.839 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 83' ' ' SER . . . . . . . . . . . . 0.408 9.5 p 72.3 -55.96 0.66 Allowed 'General case' 0 N--CA 1.43 -1.444 0 C-N-CA 128.554 2.742 . . . . 1.0 117.418 171.145 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -168.48 93.95 0.11 Allowed Glycine 0 N--CA 1.431 -1.684 0 N-CA-C 109.712 -1.355 . . . . 1.0 109.712 178.73 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 10.5 pt-20 -72.33 96.69 1.9 Allowed 'General case' 0 N--CA 1.431 -1.407 0 N-CA-C 118.064 2.616 . . . . 1.0 118.064 -166.053 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 57.4 m -167.33 125.92 1.32 Allowed 'General case' 0 N--CA 1.429 -1.49 0 O-C-N 119.347 -2.096 . . . . 1.0 110.836 171.6 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . 0.294 0.1 OUTLIER -51.03 -86.14 0.0 OUTLIER 'General case' 0 N--CA 1.429 -1.475 0 N-CA-C 117.195 2.294 . . . . 1.0 117.195 173.539 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 88' ' ' TRP . . . . . . . . . . . . . 22.3 m95 -58.96 -39.95 83.23 Favored 'General case' 0 N--CA 1.431 -1.422 0 CA-C-N 121.2 1.818 . . . . 1.0 113.584 -173.27 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 9.3 t70 -67.69 -39.96 84.41 Favored 'General case' 0 N--CA 1.43 -1.455 0 N-CA-C 114.388 1.255 . . . . 1.0 114.388 -176.82 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 30.3 tp -76.03 -41.61 50.38 Favored 'General case' 0 N--CA 1.43 -1.438 0 O-C-N 119.098 -2.251 . . . . 1.0 112.483 177.363 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -48.01 -47.38 33.35 Favored 'General case' 0 CA--C 1.489 -1.394 0 C-N-CA 127.495 2.318 . . . . 1.0 113.376 166.835 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 1.3 tp10 -56.52 -51.9 66.77 Favored 'General case' 0 N--CA 1.43 -1.426 0 C-N-CA 127.105 2.162 . . . . 1.0 113.29 170.387 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 7.2 tt0 -52.47 -51.06 61.27 Favored 'General case' 0 N--CA 1.43 -1.464 0 O-C-N 120.668 -1.27 . . . . 1.0 112.866 174.539 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -53.19 -48.73 67.83 Favored 'General case' 0 N--CA 1.43 -1.432 0 N-CA-C 115.034 1.494 . . . . 1.0 115.034 172.706 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -64.45 -53.5 47.3 Favored 'General case' 0 N--CA 1.429 -1.495 0 O-C-N 120.135 -1.603 . . . . 1.0 113.255 178.989 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 96' ' ' THR . . . . . 0.602 HG22 ' H ' ' A' ' 103' ' ' VAL . 47.5 p -59.4 -38.04 79.56 Favored 'General case' 0 CA--C 1.488 -1.431 0 C-N-CA 126.543 1.937 . . . . 1.0 114.051 179.439 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 5.8 pt20 -78.65 -27.19 45.23 Favored 'General case' 0 N--CA 1.429 -1.476 0 N-CA-C 114.871 1.434 . . . . 1.0 114.871 177.944 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 12.4 mm100 -74.67 -38.74 62.35 Favored 'General case' 0 N--CA 1.431 -1.421 0 O-C-N 120.22 -1.55 . . . . 1.0 112.129 170.718 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -79.86 -46.31 17.08 Favored 'General case' 0 N--CA 1.43 -1.45 0 N-CA-C 114.928 1.455 . . . . 1.0 114.928 179.669 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . 122.5 0.1 10.25 Favored Glycine 0 N--CA 1.431 -1.659 0 N-CA-C 116.475 1.35 . . . . 1.0 116.475 174.433 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 11.2 pt-20 -153.56 174.33 14.58 Favored 'General case' 0 N--CA 1.429 -1.499 0 CA-C-N 119.355 1.577 . . . . 1.0 110.223 -178.813 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 16.9 m -74.2 121.62 21.52 Favored 'General case' 0 N--CA 1.43 -1.452 0 O-C-N 120.736 -1.228 . . . . 1.0 112.738 177.928 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 103' ' ' VAL . . . . . 0.602 ' H ' HG22 ' A' ' 96' ' ' THR . 40.5 t -120.87 134.92 62.71 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.458 0 N-CA-C 102.284 -3.228 . . . . 1.0 102.284 -175.195 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 43.7 p -106.73 129.02 54.68 Favored 'General case' 0 N--CA 1.43 -1.457 0 N-CA-C 115.218 1.562 . . . . 1.0 115.218 -166.336 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -139.69 -35.8 0.52 Allowed 'General case' 0 N--CA 1.43 -1.434 0 C-N-CA 127.155 2.182 . . . . 1.0 108.938 167.959 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 2.9 tmm_? . . . . . 0 C--O 1.26 1.609 0 C-N-CA 125.737 1.615 . . . . 1.0 112.859 -167.59 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 43.1 m-80 . . . . . 0 N--CA 1.43 -1.453 0 CA-C-O 121.69 0.757 . . . . 1.0 112.34 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -57.04 -48.97 77.25 Favored 'General case' 0 N--CA 1.43 -1.432 0 C-N-CA 126.806 2.042 . . . . 1.0 113.857 172.93 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 27.8 t -50.88 -52.9 37.23 Favored 'General case' 0 N--CA 1.431 -1.401 0 C-N-CA 125.722 1.609 . . . . 1.0 114.099 172.579 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 49.7 tt0 -62.86 -52.42 63.17 Favored 'General case' 0 N--CA 1.431 -1.395 0 C-N-CA 124.765 1.226 . . . . 1.0 113.976 -178.452 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -63.46 -35.31 80.03 Favored 'General case' 0 N--CA 1.43 -1.441 0 O-C-N 120.673 -1.267 . . . . 1.0 114.362 178.626 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 9.0 t-160 -66.49 -37.79 85.86 Favored 'General case' 0 N--CA 1.43 -1.432 0 O-C-N 120.198 -1.564 . . . . 1.0 113.791 172.755 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 1.5 mmm180 -68.56 -43.93 75.56 Favored 'General case' 0 N--CA 1.43 -1.432 0 O-C-N 120.055 -1.653 . . . . 1.0 113.687 175.73 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 67.1 mt -56.52 -46.26 80.67 Favored 'General case' 0 N--CA 1.43 -1.45 0 C-N-CA 124.666 1.186 . . . . 1.0 112.558 172.251 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -54.51 -55.69 26.47 Favored 'General case' 0 N--CA 1.43 -1.442 0 C-N-CA 124.477 1.111 . . . . 1.0 113.498 171.6 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 18.7 t70 -46.16 -48.15 17.51 Favored 'General case' 0 N--CA 1.43 -1.45 0 C-N-CA 126.491 1.917 . . . . 1.0 114.093 178.284 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 12.5 mm100 -55.72 -60.6 3.21 Favored 'General case' 0 N--CA 1.43 -1.456 0 N-CA-C 114.522 1.305 . . . . 1.0 114.522 172.944 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 2.5 pp -74.49 -37.68 63.09 Favored 'General case' 0 N--CA 1.43 -1.459 0 N-CA-C 116.585 2.068 . . . . 1.0 116.585 -175.497 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 11.9 m0 -55.6 -47.06 77.11 Favored 'General case' 0 N--CA 1.431 -1.411 0 C-N-CA 127.753 2.421 . . . . 1.0 112.109 171.663 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 47.8 tp -59.73 -45.25 92.75 Favored 'General case' 0 N--CA 1.43 -1.451 0 O-C-N 121.057 -1.027 . . . . 1.0 113.468 172.142 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 25.5 m -56.28 -46.34 79.78 Favored 'General case' 0 N--CA 1.431 -1.383 0 N-CA-C 114.853 1.427 . . . . 1.0 114.853 175.387 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 67.6 mt -64.75 -46.21 92.82 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.437 0 O-C-N 120.431 -1.418 . . . . 1.0 112.206 178.263 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 58.1 tt0 -53.41 -58.41 7.22 Favored 'General case' 0 N--CA 1.43 -1.443 0 C-N-CA 125.047 1.339 . . . . 1.0 111.939 174.765 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 23.7 mt-10 -55.68 -55.43 32.26 Favored 'General case' 0 N--CA 1.43 -1.446 0 C-N-CA 125.789 1.635 . . . . 1.0 115.138 176.748 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 7.2 tpm_? -52.31 -49.18 64.74 Favored 'General case' 0 N--CA 1.43 -1.445 0 C-N-CA 124.578 1.151 . . . . 1.0 113.056 -177.456 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . 0.422 HD23 HG21 ' A' ' 41' ' ' ILE . 12.8 tp -81.51 -36.51 29.15 Favored 'General case' 0 N--CA 1.43 -1.432 0 N-CA-C 113.991 1.108 . . . . 1.0 113.991 -176.335 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 27.4 t70 -64.17 -34.36 77.9 Favored 'General case' 0 N--CA 1.431 -1.42 0 O-C-N 119.994 -1.691 . . . . 1.0 114.51 176.567 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 10.1 t70 -67.87 -26.81 66.21 Favored 'General case' 0 N--CA 1.43 -1.431 0 O-C-N 120.185 -1.572 . . . . 1.0 113.388 172.752 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 24' ' ' TRP . . . . . . . . . . . . . 0.2 OUTLIER -75.92 148.84 37.93 Favored 'General case' 0 N--CA 1.43 -1.426 0 O-C-N 120.154 -1.591 . . . . 1.0 114.003 -167.512 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 2.3 t70 -129.1 133.78 47.8 Favored 'General case' 0 N--CA 1.429 -1.491 0 O-C-N 120.528 -1.358 . . . . 1.0 108.972 -175.099 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -166.64 -149.16 5.85 Favored Glycine 0 N--CA 1.431 -1.652 0 O-C-N 120.536 -1.352 . . . . 1.0 112.521 -171.439 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 10.9 t70 -77.03 -41.65 41.72 Favored 'General case' 0 N--CA 1.431 -1.421 0 N-CA-C 107.88 -1.156 . . . . 1.0 107.88 168.439 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 47.1 m -65.2 141.62 58.6 Favored 'General case' 0 N--CA 1.43 -1.471 0 C-N-CA 125.275 1.43 . . . . 1.0 114.236 174.083 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 20.0 t70 -110.97 147.3 35.0 Favored 'General case' 0 N--CA 1.429 -1.517 0 N-CA-C 105.993 -1.854 . . . . 1.0 105.993 171.5 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 48.6 mm -135.02 115.7 19.07 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.457 0 C-N-CA 125.555 1.542 . . . . 1.0 108.528 -160.895 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -121.83 110.22 15.63 Favored 'General case' 0 N--CA 1.43 -1.472 0 C-N-CA 124.461 1.104 . . . . 1.0 109.188 158.718 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 10.3 t -77.13 143.73 38.94 Favored 'General case' 0 N--CA 1.429 -1.507 0 O-C-N 118.625 -2.547 . . . . 1.0 110.204 164.952 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 52.2 mt-10 -101.74 140.07 36.53 Favored 'General case' 0 N--CA 1.431 -1.415 0 C-N-CA 124.37 1.068 . . . . 1.0 109.302 172.211 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 2.5 tp -122.1 107.33 19.56 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.488 0 CA-C-O 124.327 2.013 . . . . 1.0 108.372 177.293 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 35.1 m120 -117.79 68.57 0.76 Allowed 'General case' 0 N--CA 1.43 -1.434 0 CA-C-N 114.425 -1.261 . . . . 1.0 109.651 176.499 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . 73.17 -86.55 0.58 Allowed Glycine 0 N--CA 1.43 -1.713 0 C-N-CA 125.363 1.459 . . . . 1.0 114.334 173.088 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -120.34 27.31 6.7 Favored Glycine 0 N--CA 1.429 -1.79 0 C-N-CA 125.332 1.444 . . . . 1.0 111.866 175.019 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 66.4 t -128.34 129.11 69.03 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.449 0 N-CA-C 107.661 -1.237 . . . . 1.0 107.661 169.628 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 46.3 mt -113.02 123.97 51.56 Favored 'General case' 0 N--CA 1.429 -1.481 0 CA-C-O 122.846 1.307 . . . . 1.0 108.655 166.754 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -121.84 116.33 24.24 Favored 'General case' 0 N--CA 1.43 -1.455 0 N-CA-C 106.348 -1.723 . . . . 1.0 106.348 179.385 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 41' ' ' ILE . . . . . 0.422 HG21 HD23 ' A' ' 21' ' ' LEU . 49.3 mt -94.04 116.1 34.45 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.411 0 O-C-N 119.625 -1.922 . . . . 1.0 108.644 -172.985 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 47.0 p -109.76 120.06 41.29 Favored 'General case' 0 N--CA 1.43 -1.438 0 N-CA-C 113.237 0.828 . . . . 1.0 113.237 -173.656 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 43' ' ' PHE . . . . . . . . . . . . 0.25 1.2 p90 -118.23 166.34 12.72 Favored 'General case' 0 N--CA 1.429 -1.492 0 CA-C-O 123.322 1.534 . . . . 1.0 114.093 179.487 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 1.1 pp20? -63.13 -31.4 72.54 Favored 'General case' 0 N--CA 1.43 -1.45 0 N-CA-C 117.517 2.414 . . . . 1.0 117.517 -159.179 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 59.5 m-80 -74.81 -0.36 18.08 Favored 'General case' 0 N--CA 1.431 -1.411 0 N-CA-C 114.905 1.446 . . . . 1.0 114.905 176.67 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 99.41 -1.3 57.19 Favored Glycine 0 N--CA 1.432 -1.613 0 O-C-N 120.673 -1.267 . . . . 1.0 113.255 166.849 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 3.4 p -96.52 164.47 12.6 Favored 'General case' 0 N--CA 1.428 -1.548 0 C-N-CA 127.028 2.131 . . . . 1.0 110.255 178.439 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 54.3 pttt -162.35 158.93 24.74 Favored 'General case' 0 N--CA 1.429 -1.479 0 CA-C-O 122.468 1.128 . . . . 1.0 113.655 -171.108 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 17.9 mm -103.7 140.14 22.71 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.412 0 C-N-CA 125.258 1.423 . . . . 1.0 107.232 179.073 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 50' ' ' ILE . . . . . 0.433 ' HB ' ' HB3' ' A' ' 63' ' ' ALA . 1.2 mm -122.39 108.04 20.89 Favored 'Isoleucine or valine' 0 N--CA 1.428 -1.53 0 CA-C-N 119.649 1.113 . . . . 1.0 110.299 -175.34 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 2.7 mt -122.82 98.6 5.82 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.463 0 CA-C-O 123.357 1.551 . . . . 1.0 111.828 179.117 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 2.3 m120 -108.81 148.0 31.23 Favored 'General case' 0 N--CA 1.429 -1.51 0 C-N-CA 127.896 2.478 . . . . 1.0 108.727 174.796 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 39.1 ttp180 -154.29 134.29 13.1 Favored 'General case' 0 N--CA 1.429 -1.496 0 CA-C-N 113.729 -1.578 . . . . 1.0 108.305 -167.055 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -89.55 129.47 36.01 Favored 'General case' 0 N--CA 1.431 -1.391 0 N-CA-C 106.687 -1.598 . . . . 1.0 106.687 163.617 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 37.8 tt0 -63.7 -51.25 67.05 Favored Pre-proline 0 N--CA 1.431 -1.393 0 CA-C-O 116.573 -1.68 . . . . 1.0 113.431 172.581 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 52.6 Cg_exo -67.29 -175.69 0.71 Allowed 'Trans proline' 0 N--CA 1.433 -2.055 0 CA-C-N 125.307 2.931 . . . . 1.0 114.707 162.707 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 15.0 mt 82.38 -30.07 0.1 Allowed 'General case' 0 N--CA 1.43 -1.452 0 C-N-CA 127.657 2.383 . . . . 1.0 114.934 169.439 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER 76.87 47.38 0.07 Allowed 'General case' 0 N--CA 1.432 -1.364 0 C-N-CA 126.247 1.819 . . . . 1.0 114.204 170.433 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 38.2 tt0 -160.36 152.12 19.92 Favored 'General case' 0 N--CA 1.429 -1.48 0 O-C-N 120.693 -1.254 . . . . 1.0 108.27 179.031 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 15.6 t -120.73 156.91 23.91 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.486 0 C-N-CA 124.819 1.248 . . . . 1.0 109.83 179.634 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 61' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -99.35 153.49 18.93 Favored 'General case' 0 N--CA 1.43 -1.427 0 O-C-N 120.567 -1.333 . . . . 1.0 111.419 170.198 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -137.45 90.9 2.55 Favored 'General case' 0 N--CA 1.43 -1.457 0 O-C-N 120.103 -1.623 . . . . 1.0 109.862 179.116 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . 0.433 ' HB3' ' HB ' ' A' ' 50' ' ' ILE . . . -104.37 139.92 38.65 Favored 'General case' 0 N--CA 1.429 -1.492 0 O-C-N 119.943 -1.723 . . . . 1.0 111.858 175.647 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 64' ' ' THR . . . . . . . . . . . . . 80.8 p -150.44 -130.28 0.05 OUTLIER 'General case' 0 N--CA 1.43 -1.468 0 C-N-CA 126.633 1.973 . . . . 1.0 105.783 -163.082 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 4.7 tmtt? -84.82 -39.64 18.11 Favored 'General case' 0 N--CA 1.43 -1.434 0 O-C-N 120.254 -1.529 . . . . 1.0 110.913 166.076 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 1.7 tp-100 -78.62 -25.14 45.05 Favored 'General case' 0 N--CA 1.43 -1.453 0 N-CA-C 114.937 1.458 . . . . 1.0 114.937 -150.785 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 169.76 -52.04 0.2 Allowed Glycine 0 N--CA 1.43 -1.729 0 O-C-N 121.076 -1.015 . . . . 1.0 113.16 174.632 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 116.48 93.53 1.79 Allowed Glycine 0 N--CA 1.43 -1.7 0 C-N-CA 125.255 1.407 . . . . 1.0 110.843 -173.691 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 69' ' ' TYR . . . . . 0.486 ' CD1' ' HG2' ' A' ' 82' ' ' ARG . 13.5 m-85 -122.07 143.26 49.63 Favored 'General case' 0 N--CA 1.43 -1.464 0 N-CA-C 107.962 -1.125 . . . . 1.0 107.962 -166.406 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 70' ' ' HIS . . . . . . . . . . . . 0.275 1.3 p80 -89.47 160.92 16.52 Favored 'General case' 0 N--CA 1.429 -1.482 0 O-C-N 119.376 -2.078 . . . . 1.0 113.746 178.636 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 71' ' ' PHE . . . . . . . . . . . . 0.27 11.9 t80 -139.34 125.0 19.45 Favored 'General case' 0 N--CA 1.429 -1.48 0 CA-C-N 115.333 -0.849 . . . . 1.0 111.076 -149.589 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -126.25 161.4 27.83 Favored 'General case' 0 N--CA 1.431 -1.402 0 C-N-CA 123.746 0.818 . . . . 1.0 109.974 178.089 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 57.3 tp -96.11 121.83 38.29 Favored 'General case' 0 N--CA 1.43 -1.434 0 O-C-N 119.599 -1.938 . . . . 1.0 110.403 176.391 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 20.0 mmmt -84.89 -48.56 9.2 Favored 'General case' 0 N--CA 1.43 -1.461 0 O-C-N 120.989 -1.069 . . . . 1.0 112.815 175.74 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -171.85 -69.77 0.04 OUTLIER Glycine 0 N--CA 1.429 -1.77 0 N-CA-C 110.843 -0.903 . . . . 1.0 110.843 179.007 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 20.2 p-10 -90.06 -26.92 20.03 Favored 'General case' 0 N--CA 1.43 -1.469 0 O-C-N 121.07 -1.253 . . . . 1.0 111.09 179.089 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 5.8 mt-10 -152.58 155.75 37.97 Favored 'General case' 0 N--CA 1.429 -1.492 0 N-CA-C 104.161 -2.533 . . . . 1.0 104.161 -164.417 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 78' ' ' TRP . . . . . . . . . . . . . 31.0 m95 -86.69 123.59 32.03 Favored 'General case' 0 N--CA 1.43 -1.456 0 N-CA-C 107.084 -1.45 . . . . 1.0 107.084 -178.311 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 3.3 mt -101.47 137.12 30.26 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.484 0 CA-C-O 123.893 1.806 . . . . 1.0 106.332 176.804 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 74.8 m -77.17 145.95 37.37 Favored 'General case' 0 N--CA 1.428 -1.527 0 CA-C-N 114.411 -1.268 . . . . 1.0 109.977 -175.593 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 37.6 t0 -73.44 -43.51 60.2 Favored 'General case' 0 N--CA 1.431 -1.416 0 O-C-N 120.469 -1.394 . . . . 1.0 111.953 -174.007 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 82' ' ' ARG . . . . . 0.486 ' HG2' ' CD1' ' A' ' 69' ' ' TYR . 0.1 OUTLIER -79.11 134.55 36.72 Favored 'General case' 0 N--CA 1.43 -1.463 0 O-C-N 119.977 -1.702 . . . . 1.0 110.378 176.911 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 8.0 t 65.58 -66.24 0.15 Allowed 'General case' 0 N--CA 1.43 -1.437 0 N-CA-C 116.215 1.932 . . . . 1.0 116.215 -179.951 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 130.48 89.49 0.52 Allowed Glycine 0 N--CA 1.43 -1.711 0 N-CA-C 107.474 -2.25 . . . . 1.0 107.474 -167.417 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 52.3 mt-10 -137.97 -168.33 2.33 Favored 'General case' 0 N--CA 1.431 -1.413 0 N-CA-C 105.162 -2.162 . . . . 1.0 105.162 -178.755 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 32.0 m -154.99 130.71 9.96 Favored 'General case' 0 N--CA 1.43 -1.471 0 O-C-N 119.346 -2.096 . . . . 1.0 111.102 -150.661 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 1.1 t80 -25.79 -92.56 0.0 OUTLIER 'General case' 0 N--CA 1.429 -1.492 0 N-CA-C 119.674 3.213 . . . . 1.0 119.674 174.7 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 88' ' ' TRP . . . . . . . . . . . . . 78.8 m95 -72.12 -26.8 62.26 Favored 'General case' 0 N--CA 1.429 -1.483 0 O-C-N 120.392 -1.442 . . . . 1.0 110.379 -169.819 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -68.42 -49.97 56.14 Favored 'General case' 0 N--CA 1.43 -1.454 0 C-N-CA 125.409 1.483 . . . . 1.0 113.139 178.413 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -70.14 -42.74 72.16 Favored 'General case' 0 N--CA 1.429 -1.48 0 CA-C-O 122.969 1.366 . . . . 1.0 111.73 -177.565 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 24.6 tp -53.76 -49.86 67.29 Favored 'General case' 0 N--CA 1.43 -1.459 0 C-N-CA 126.371 1.868 . . . . 1.0 112.946 173.996 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 1.9 tm-20 -58.21 -55.76 30.81 Favored 'General case' 0 N--CA 1.43 -1.443 0 C-N-CA 126.742 2.017 . . . . 1.0 114.816 173.71 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 3.6 pt20 -63.96 -43.42 95.83 Favored 'General case' 0 N--CA 1.43 -1.437 0 O-C-N 120.577 -1.327 . . . . 1.0 114.068 -177.452 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -62.79 -47.97 81.15 Favored 'General case' 0 N--CA 1.43 -1.442 0 O-C-N 120.635 -1.29 . . . . 1.0 113.057 175.098 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -63.43 -35.99 82.24 Favored 'General case' 0 N--CA 1.428 -1.536 0 O-C-N 120.312 -1.493 . . . . 1.0 113.399 176.98 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 91.5 m -57.75 -51.96 67.41 Favored 'General case' 0 N--CA 1.43 -1.456 0 C-N-CA 125.526 1.53 . . . . 1.0 112.474 173.149 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 5.0 pt20 -70.18 -31.34 68.77 Favored 'General case' 0 N--CA 1.43 -1.45 0 N-CA-C 114.75 1.389 . . . . 1.0 114.75 -179.847 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 51.0 mt-30 -66.26 -46.71 76.12 Favored 'General case' 0 N--CA 1.43 -1.468 0 O-C-N 119.741 -1.849 . . . . 1.0 114.806 169.876 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -77.98 -46.88 19.85 Favored 'General case' 0 N--CA 1.428 -1.534 0 N-CA-C 113.912 1.078 . . . . 1.0 113.912 -176.335 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . 99.58 24.7 9.84 Favored Glycine 0 N--CA 1.431 -1.691 0 C-N-CA 124.502 1.048 . . . . 1.0 113.422 -175.499 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 13.7 pt-20 -161.63 160.69 29.08 Favored 'General case' 0 N--CA 1.429 -1.482 0 N-CA-C 106.495 -1.669 . . . . 1.0 106.495 174.672 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 70.2 m -66.63 112.18 4.03 Favored 'General case' 0 N--CA 1.429 -1.5 0 CA-C-N 120.087 1.312 . . . . 1.0 112.43 -178.522 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 39.9 t -100.49 108.43 23.03 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.453 0 N-CA-C 107.302 -1.37 . . . . 1.0 107.302 173.867 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 44.0 p -141.31 127.72 19.95 Favored 'General case' 0 N--CA 1.43 -1.442 0 N-CA-C 113.792 1.034 . . . . 1.0 113.792 -169.483 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 5.2 t80 -93.85 -24.31 17.79 Favored 'General case' 0 N--CA 1.43 -1.458 0 C-N-CA 124.059 0.944 . . . . 1.0 109.759 167.366 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 18.3 mmm-85 . . . . . 0 C--O 1.261 1.661 0 O-C-N 120.971 -1.081 . . . . 1.0 110.385 -175.56 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 23.6 t-20 . . . . . 0 N--CA 1.431 -1.397 0 CA-C-O 121.772 0.796 . . . . 1.0 112.892 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 16.2 m-20 -61.69 -54.16 46.33 Favored 'General case' 0 N--CA 1.43 -1.447 0 C-N-CA 125.96 1.704 . . . . 1.0 113.924 176.451 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 53.9 m -65.56 -33.57 76.22 Favored 'General case' 0 N--CA 1.429 -1.496 0 O-C-N 120.462 -1.399 . . . . 1.0 113.247 -177.705 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 37.0 tt0 -60.33 -55.09 37.92 Favored 'General case' 0 N--CA 1.43 -1.448 0 C-N-CA 124.306 1.042 . . . . 1.0 112.488 170.471 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 19.8 t80 -50.56 -48.11 57.58 Favored 'General case' 0 N--CA 1.431 -1.425 0 N-CA-C 114.651 1.352 . . . . 1.0 114.651 170.829 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 7.5 t-80 -55.62 -55.72 28.75 Favored 'General case' 0 N--CA 1.43 -1.435 0 C-N-CA 125.979 1.712 . . . . 1.0 114.939 177.344 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 42.6 mtm105 -61.12 -54.37 45.38 Favored 'General case' 0 CA--C 1.49 -1.357 0 C-N-CA 124.86 1.264 . . . . 1.0 113.017 179.92 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 95.9 mt -59.9 -46.45 89.31 Favored 'General case' 0 N--CA 1.431 -1.393 0 O-C-N 121.249 -0.907 . . . . 1.0 113.299 -179.221 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -57.53 -43.46 84.36 Favored 'General case' 0 N--CA 1.43 -1.448 0 N-CA-C 113.779 1.029 . . . . 1.0 113.779 177.355 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 15.9 t0 -63.27 -46.96 84.4 Favored 'General case' 0 N--CA 1.43 -1.45 0 N-CA-C 113.297 0.851 . . . . 1.0 113.297 177.307 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 59.7 mt-30 -61.04 -48.61 80.97 Favored 'General case' 0 N--CA 1.432 -1.35 0 N-CA-C 116.357 1.984 . . . . 1.0 116.357 174.92 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 3.9 pp -67.39 -39.11 85.59 Favored 'General case' 0 N--CA 1.43 -1.474 0 O-C-N 119.917 -1.739 . . . . 1.0 113.996 179.626 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 5.6 m0 -48.69 -57.52 6.15 Favored 'General case' 0 N--CA 1.43 -1.459 0 C-N-CA 126.039 1.736 . . . . 1.0 114.195 166.983 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 51.6 tp -58.7 -41.82 87.17 Favored 'General case' 0 N--CA 1.431 -1.41 0 N-CA-C 113.819 1.044 . . . . 1.0 113.819 177.741 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 90.3 m -57.74 -55.44 34.83 Favored 'General case' 0 N--CA 1.43 -1.444 0 C-N-CA 125.819 1.647 . . . . 1.0 113.496 175.915 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 86.1 mt -59.76 -48.9 85.85 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.419 0 C-N-CA 125.557 1.543 . . . . 1.0 112.397 176.768 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 69.6 tt0 -54.92 -53.3 57.29 Favored 'General case' 0 N--CA 1.428 -1.525 0 C-N-CA 125.226 1.41 . . . . 1.0 113.776 178.666 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 34.8 tt0 -63.88 -43.78 95.02 Favored 'General case' 0 N--CA 1.429 -1.523 0 N-CA-C 114.484 1.29 . . . . 1.0 114.484 179.287 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 6.8 tpt180 -67.19 -35.31 79.38 Favored 'General case' 0 N--CA 1.43 -1.438 0 N-CA-C 114.562 1.319 . . . . 1.0 114.562 -179.559 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 94.6 mt -78.23 -35.87 47.76 Favored 'General case' 0 N--CA 1.43 -1.466 0 O-C-N 120.627 -1.295 . . . . 1.0 113.409 174.314 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 37.2 t70 -57.87 -33.12 68.35 Favored 'General case' 0 N--CA 1.43 -1.465 0 C-N-CA 125.155 1.382 . . . . 1.0 113.026 171.036 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 33.6 t70 -69.79 -18.66 63.49 Favored 'General case' 0 N--CA 1.431 -1.41 0 N-CA-C 114.382 1.253 . . . . 1.0 114.382 174.359 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 24' ' ' TRP . . . . . . . . . . . . . 28.8 t-105 -75.99 152.44 36.98 Favored 'General case' 0 N--CA 1.429 -1.488 0 O-C-N 119.225 -2.172 . . . . 1.0 114.184 -171.557 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 1.8 t0 -154.33 175.79 13.11 Favored 'General case' 0 N--CA 1.431 -1.419 0 N-CA-C 108.635 -0.876 . . . . 1.0 108.635 -174.059 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 160.03 -131.43 2.68 Favored Glycine 0 N--CA 1.43 -1.733 0 N-CA-C 110.911 -0.875 . . . . 1.0 110.911 -178.655 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -86.52 -34.47 19.97 Favored 'General case' 0 N--CA 1.429 -1.489 0 C-N-CA 125.523 1.529 . . . . 1.0 108.697 170.566 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 39.3 m -85.5 172.29 11.1 Favored 'General case' 0 N--CA 1.43 -1.434 0 C-N-CA 124.795 1.238 . . . . 1.0 112.918 -176.589 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 43.1 t0 -121.41 151.43 40.19 Favored 'General case' 0 N--CA 1.431 -1.408 0 C-N-CA 125.874 1.67 . . . . 1.0 106.92 176.116 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -159.84 117.72 0.2 Allowed 'Isoleucine or valine' 0 N--CA 1.43 -1.46 0 CA-C-O 122.355 1.074 . . . . 1.0 108.265 -167.863 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 23.8 t0 -136.21 134.82 38.55 Favored 'General case' 0 N--CA 1.428 -1.546 0 O-C-N 120.83 -1.169 . . . . 1.0 109.066 175.451 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 73.4 m -100.66 138.82 37.21 Favored 'General case' 0 N--CA 1.43 -1.47 0 O-C-N 119.531 -1.981 . . . . 1.0 111.423 179.793 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 52.6 mt-10 -109.81 134.44 52.03 Favored 'General case' 0 N--CA 1.43 -1.459 0 O-C-N 121.102 -0.999 . . . . 1.0 109.929 -172.09 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 2.3 tp -105.29 106.41 20.46 Favored 'Isoleucine or valine' 0 CA--C 1.488 -1.413 0 N-CA-C 105.25 -2.13 . . . . 1.0 105.25 169.304 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 55.2 t30 -135.55 107.5 7.11 Favored 'General case' 0 N--CA 1.43 -1.457 0 CA-C-N 114.777 -1.101 . . . . 1.0 109.899 -173.242 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . 67.11 31.44 77.7 Favored Glycine 0 N--CA 1.43 -1.756 0 O-C-N 120.413 -1.43 . . . . 1.0 114.944 174.179 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 81.64 4.54 90.34 Favored Glycine 0 N--CA 1.429 -1.794 0 O-C-N 121.231 -1.158 . . . . 1.0 114.775 -174.581 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 24.2 t -103.51 127.36 57.57 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.471 0 N-CA-C 107.963 -1.125 . . . . 1.0 107.963 175.353 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 12.3 mt -88.64 127.14 35.56 Favored 'General case' 0 N--CA 1.431 -1.385 0 CA-C-O 123.626 1.679 . . . . 1.0 107.084 161.601 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -130.09 115.04 16.51 Favored 'General case' 0 N--CA 1.429 -1.492 0 N-CA-C 105.759 -1.941 . . . . 1.0 105.759 -169.605 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 82.9 mt -94.14 110.78 24.1 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.485 0 N-CA-C 107.867 -1.16 . . . . 1.0 107.867 -168.625 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 9.8 p -112.65 126.6 55.55 Favored 'General case' 0 N--CA 1.431 -1.423 0 CA-C-O 121.662 0.744 . . . . 1.0 112.508 -170.319 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 43' ' ' PHE . . . . . . . . . . . . . 1.6 p90 -119.97 159.83 23.94 Favored 'General case' 0 N--CA 1.429 -1.489 0 O-C-N 120.558 -1.339 . . . . 1.0 110.405 174.048 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -66.03 -15.08 62.73 Favored 'General case' 0 N--CA 1.43 -1.475 0 N-CA-C 117.762 2.505 . . . . 1.0 117.762 -163.454 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 45.1 m-80 -71.8 -7.74 50.1 Favored 'General case' 0 N--CA 1.43 -1.429 0 C-N-CA 125.935 1.694 . . . . 1.0 113.845 173.472 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 88.76 41.42 6.0 Favored Glycine 0 N--CA 1.429 -1.819 0 O-C-N 120.942 -1.098 . . . . 1.0 114.668 165.888 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 17.0 m -150.99 168.92 23.08 Favored 'General case' 0 N--CA 1.43 -1.45 0 N-CA-C 106.058 -1.831 . . . . 1.0 106.058 179.597 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -156.96 153.27 27.78 Favored 'General case' 0 N--CA 1.43 -1.442 0 N-CA-C 114.295 1.22 . . . . 1.0 114.295 -168.202 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 5.0 mm -97.61 140.62 17.43 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.478 0 C-N-CA 125.825 1.65 . . . . 1.0 106.963 177.598 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 4.7 mm -115.85 118.16 57.9 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.468 0 C-N-CA 124.616 1.166 . . . . 1.0 110.176 -171.935 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 3.4 mt -128.68 120.87 53.55 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.479 0 CA-C-O 122.806 1.288 . . . . 1.0 112.476 -176.876 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 52' ' ' ASN . . . . . 0.461 ' H ' ' HD1' ' A' ' 61' ' ' TRP . 47.2 t30 -156.46 169.17 25.24 Favored 'General case' 0 N--CA 1.429 -1.488 0 N-CA-C 105.374 -2.084 . . . . 1.0 105.374 -178.739 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 29.6 ptt180 -140.57 127.22 20.3 Favored 'General case' 0 N--CA 1.431 -1.409 0 C-N-CA 124.777 1.231 . . . . 1.0 113.004 -159.315 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -110.46 108.2 18.13 Favored 'General case' 0 N--CA 1.43 -1.469 0 C-N-CA 125.212 1.405 . . . . 1.0 110.935 -174.641 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 86.8 mt-10 -64.82 -52.76 48.2 Favored Pre-proline 0 N--CA 1.43 -1.462 0 N-CA-C 118.363 2.727 . . . . 1.0 118.363 -169.497 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 31.9 Cg_exo -73.52 -10.62 23.89 Favored 'Trans proline' 0 N--CA 1.433 -2.033 0 CA-C-N 128.01 3.896 . . . . 1.0 114.01 -168.971 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 35.0 mt -94.1 -22.37 18.53 Favored 'General case' 0 N--CA 1.431 -1.425 0 C-N-CA 126.282 1.833 . . . . 1.0 109.159 177.535 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 32.3 m80 65.91 47.92 1.92 Allowed 'General case' 0 N--CA 1.429 -1.494 0 C-N-CA 126.614 1.965 . . . . 1.0 111.193 175.145 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 13.9 pt20 -144.01 149.33 36.55 Favored 'General case' 0 N--CA 1.429 -1.49 0 C-N-CA 124.31 1.044 . . . . 1.0 110.733 -178.769 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 4.2 t -100.2 153.23 4.6 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.5 0 N-CA-C 108.372 -0.973 . . . . 1.0 108.372 172.043 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 61' ' ' TRP . . . . . 0.461 ' HD1' ' H ' ' A' ' 52' ' ' ASN . 0.0 OUTLIER -102.73 155.3 18.41 Favored 'General case' 0 N--CA 1.43 -1.443 0 O-C-N 119.856 -1.777 . . . . 1.0 113.784 173.337 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 18.2 mt -125.52 94.93 4.28 Favored 'General case' 0 N--CA 1.432 -1.36 0 N-CA-C 106.16 -1.793 . . . . 1.0 106.16 164.207 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . 0.406 ' HA ' ' HA2' ' A' ' 68' ' ' GLY . . . -98.56 140.7 32.4 Favored 'General case' 0 N--CA 1.429 -1.49 0 CA-C-O 122.712 1.244 . . . . 1.0 110.113 171.812 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 64' ' ' THR . . . . . . . . . . . . . 6.3 t -153.47 -130.04 0.04 OUTLIER 'General case' 0 N--CA 1.431 -1.414 0 O-C-N 120.767 -1.208 . . . . 1.0 109.011 -169.883 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 3.4 tmtp? -72.01 -64.96 0.83 Allowed 'General case' 0 N--CA 1.429 -1.498 0 O-C-N 119.969 -1.707 . . . . 1.0 111.537 -179.871 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -128.24 -26.69 2.79 Favored 'General case' 0 N--CA 1.429 -1.507 0 O-C-N 121.41 -0.806 . . . . 1.0 112.011 179.139 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . -94.84 61.96 1.62 Allowed Glycine 0 N--CA 1.431 -1.668 0 O-C-N 121.062 -1.024 . . . . 1.0 113.486 -168.62 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 68' ' ' GLY . . . . . 0.406 ' HA2' ' HA ' ' A' ' 63' ' ' ALA . . . -75.17 83.81 0.84 Allowed Glycine 0 N--CA 1.43 -1.705 0 CA-C-O 122.609 1.116 . . . . 1.0 115.663 174.412 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 20.0 m-30 -113.96 148.28 37.16 Favored 'General case' 0 N--CA 1.43 -1.432 0 N-CA-C 107.454 -1.313 . . . . 1.0 107.454 -169.634 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 18.1 p-80 -86.52 157.77 19.69 Favored 'General case' 0 N--CA 1.43 -1.428 0 O-C-N 120.288 -1.507 . . . . 1.0 111.272 174.593 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 71' ' ' PHE . . . . . . . . . . . . 0.294 86.9 t80 -121.41 113.18 19.51 Favored 'General case' 0 N--CA 1.43 -1.447 0 C-N-CA 125.671 1.588 . . . . 1.0 107.951 -157.147 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 12.1 m-20 -146.99 157.57 43.66 Favored 'General case' 0 N--CA 1.428 -1.56 0 CA-C-N 119.501 1.046 . . . . 1.0 111.323 -175.532 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 27.5 tp -84.78 137.09 33.4 Favored 'General case' 0 N--CA 1.432 -1.366 0 O-C-N 120.465 -1.397 . . . . 1.0 113.711 -172.302 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 38.9 mmtm -106.14 -96.63 0.35 Allowed 'General case' 0 N--CA 1.429 -1.475 0 C-N-CA 125.143 1.377 . . . . 1.0 108.926 166.971 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -100.7 -96.28 2.22 Favored Glycine 0 N--CA 1.429 -1.774 0 O-C-N 120.946 -1.096 . . . . 1.0 112.989 178.637 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 44.2 t0 -98.19 17.02 19.55 Favored 'General case' 0 N--CA 1.431 -1.394 0 C-N-CA 125.409 1.484 . . . . 1.0 108.182 173.587 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 5.3 mm-40 -135.78 124.58 23.97 Favored 'General case' 0 N--CA 1.43 -1.472 0 N-CA-C 106.162 -1.792 . . . . 1.0 106.162 -167.834 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 78' ' ' TRP . . . . . . . . . . . . . 46.8 m95 -80.56 102.22 9.63 Favored 'General case' 0 N--CA 1.43 -1.472 0 N-CA-C 104.639 -2.356 . . . . 1.0 104.639 161.536 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 1.7 pt -89.22 158.04 2.99 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.474 0 O-C-N 119.184 -2.197 . . . . 1.0 108.122 179.313 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 89.6 m -81.63 116.04 21.18 Favored 'General case' 0 N--CA 1.432 -1.359 0 N-CA-C 106.409 -1.7 . . . . 1.0 106.409 170.974 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 6.1 t70 -69.91 -41.58 74.47 Favored 'General case' 0 N--CA 1.431 -1.412 0 C-N-CA 126.147 1.779 . . . . 1.0 112.538 -161.744 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 27.3 ttt180 -73.24 125.23 27.29 Favored 'General case' 0 N--CA 1.431 -1.389 0 C-N-CA 125.8 1.64 . . . . 1.0 109.514 172.345 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 83' ' ' SER . . . . . . . . . . . . 0.341 56.8 m 73.17 -42.44 0.53 Allowed 'General case' 0 N--CA 1.43 -1.462 0 C-N-CA 126.511 1.924 . . . . 1.0 115.717 -174.947 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 107.18 70.16 0.72 Allowed Glycine 0 N--CA 1.43 -1.752 0 O-C-N 120.629 -1.294 . . . . 1.0 114.38 166.564 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 64.1 mm-40 -120.27 -126.62 0.27 Allowed 'General case' 0 N--CA 1.429 -1.481 0 CA-C-N 117.953 0.877 . . . . 1.0 112.519 -169.383 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 92.7 m -158.59 140.22 13.54 Favored 'General case' 0 N--CA 1.43 -1.467 0 O-C-N 119.806 -1.808 . . . . 1.0 108.851 -168.527 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 0.8 OUTLIER -42.94 -92.46 0.0 OUTLIER 'General case' 0 N--CA 1.43 -1.47 0 C-N-CA 127.699 2.399 . . . . 1.0 115.704 172.366 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 88' ' ' TRP . . . . . . . . . . . . . 1.1 t-105 -75.57 -26.61 58.08 Favored 'General case' 0 N--CA 1.428 -1.535 0 O-C-N 120.517 -1.365 . . . . 1.0 111.01 -164.739 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 60.2 m-20 -63.8 -42.53 97.69 Favored 'General case' 0 N--CA 1.43 -1.442 0 O-C-N 120.175 -1.578 . . . . 1.0 114.586 173.531 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 33.3 tp -74.66 -41.74 59.76 Favored 'General case' 0 N--CA 1.428 -1.526 0 O-C-N 119.457 -2.027 . . . . 1.0 111.733 178.589 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 37.0 tp -55.06 -35.4 64.47 Favored 'General case' 0 N--CA 1.431 -1.415 0 C-N-CA 126.617 1.967 . . . . 1.0 114.371 169.947 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 3.0 tm-20 -61.9 -53.51 54.81 Favored 'General case' 0 N--CA 1.43 -1.428 0 C-N-CA 126.189 1.796 . . . . 1.0 111.222 167.466 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 6.5 tt0 -56.01 -46.33 78.82 Favored 'General case' 0 N--CA 1.43 -1.435 0 CA-C-N 120.808 1.64 . . . . 1.0 115.151 176.514 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -51.67 -58.19 7.07 Favored 'General case' 0 N--CA 1.43 -1.438 0 C-N-CA 127.104 2.162 . . . . 1.0 114.584 171.859 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -64.63 -42.61 95.36 Favored 'General case' 0 N--CA 1.429 -1.487 0 O-C-N 120.5 -1.375 . . . . 1.0 113.604 178.366 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 44.5 m -57.87 -48.35 80.07 Favored 'General case' 0 N--CA 1.43 -1.431 0 C-N-CA 126.561 1.945 . . . . 1.0 112.56 175.403 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 2.0 pt20 -70.3 -28.36 65.13 Favored 'General case' 0 N--CA 1.429 -1.485 0 O-C-N 120.185 -1.572 . . . . 1.0 114.043 -179.953 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 3.6 mm-40 -81.84 -36.65 28.04 Favored 'General case' 0 N--CA 1.429 -1.477 0 O-C-N 120.033 -1.667 . . . . 1.0 114.263 175.656 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -86.14 -34.57 20.54 Favored 'General case' 0 N--CA 1.43 -1.435 0 O-C-N 120.518 -1.364 . . . . 1.0 114.186 -179.817 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . 92.67 22.06 29.69 Favored Glycine 0 N--CA 1.429 -1.794 0 O-C-N 120.514 -1.366 . . . . 1.0 114.073 178.156 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 12.0 pt-20 -158.17 158.46 34.64 Favored 'General case' 0 N--CA 1.43 -1.436 0 N-CA-C 104.707 -2.331 . . . . 1.0 104.707 -172.631 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 39.7 m -74.02 112.68 10.38 Favored 'General case' 0 N--CA 1.43 -1.444 0 CA-C-N 121.318 1.872 . . . . 1.0 111.848 178.205 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 44.7 t -107.24 101.59 12.72 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.444 0 CA-C-O 122.623 1.201 . . . . 1.0 108.315 177.071 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 66.1 p -139.76 149.91 44.14 Favored 'General case' 0 N--CA 1.429 -1.494 0 O-C-N 120.939 -1.101 . . . . 1.0 113.823 -168.057 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 105' ' ' PHE . . . . . . . . . . . . 0.262 0.0 OUTLIER -106.74 -21.94 12.88 Favored 'General case' 0 N--CA 1.429 -1.49 0 C-N-CA 124.679 1.192 . . . . 1.0 110.602 158.76 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 5.2 mmm180 . . . . . 0 C--O 1.26 1.628 0 CA-C-O 117.659 -1.162 . . . . 1.0 111.118 -178.855 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 1.8 p30 . . . . . 0 N--CA 1.43 -1.435 0 N-CA-C 112.278 0.473 . . . . 1.0 112.278 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 3.8 m-20 -55.71 -48.67 74.75 Favored 'General case' 0 N--CA 1.431 -1.424 0 C-N-CA 126.605 1.962 . . . . 1.0 114.784 -173.079 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 19.2 m -52.36 -53.93 38.3 Favored 'General case' 0 N--CA 1.43 -1.456 0 C-N-CA 125.186 1.394 . . . . 1.0 113.905 178.418 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 45.0 mt-10 -57.48 -58.59 7.62 Favored 'General case' 0 N--CA 1.431 -1.425 0 C-N-CA 125.49 1.516 . . . . 1.0 112.082 176.414 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 6' ' ' PHE . . . . . 0.425 ' HB2' ' CD2' ' A' ' 58' ' ' HIS . 2.7 t80 -56.56 -39.44 73.45 Favored 'General case' 0 N--CA 1.43 -1.459 0 N-CA-C 116.481 2.03 . . . . 1.0 116.481 178.967 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 29.7 m170 -67.82 -44.16 77.92 Favored 'General case' 0 CA--C 1.489 -1.372 0 O-C-N 121.061 -1.024 . . . . 1.0 113.454 179.418 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -70.89 -41.6 71.11 Favored 'General case' 0 N--CA 1.431 -1.392 0 O-C-N 121.091 -1.006 . . . . 1.0 112.295 178.53 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 89.9 mt -62.49 -39.07 92.28 Favored 'General case' 0 N--CA 1.431 -1.421 0 O-C-N 119.682 -1.886 . . . . 1.0 113.554 174.157 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -59.74 -53.2 60.75 Favored 'General case' 0 N--CA 1.43 -1.473 0 C-N-CA 125.047 1.339 . . . . 1.0 112.776 172.53 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 40.1 t0 -47.44 -54.97 9.94 Favored 'General case' 0 N--CA 1.43 -1.473 0 C-N-CA 127.609 2.364 . . . . 1.0 112.965 177.098 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 42.4 mt-30 -55.23 -50.73 68.69 Favored 'General case' 0 N--CA 1.43 -1.46 0 N-CA-C 116.375 1.991 . . . . 1.0 116.375 173.705 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 1.8 pp -71.27 -38.35 71.85 Favored 'General case' 0 N--CA 1.429 -1.497 0 O-C-N 119.942 -1.724 . . . . 1.0 115.386 178.888 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 0.5 OUTLIER -45.78 -57.19 4.49 Favored 'General case' 0 N--CA 1.429 -1.489 0 C-N-CA 128.231 2.612 . . . . 1.0 113.45 168.195 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 3.0 pp -70.55 -30.34 67.04 Favored 'General case' 0 N--CA 1.43 -1.431 0 O-C-N 120.764 -1.21 . . . . 1.0 112.926 -179.193 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 97.3 m -64.27 -50.19 68.91 Favored 'General case' 0 N--CA 1.43 -1.45 0 C-N-CA 124.419 1.088 . . . . 1.0 112.815 174.516 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 82.7 mt -60.49 -47.53 92.29 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.477 0 O-C-N 120.621 -1.3 . . . . 1.0 111.706 175.422 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 3.8 tt0 -52.45 -57.23 10.52 Favored 'General case' 0 N--CA 1.43 -1.432 0 N-CA-C 114.611 1.337 . . . . 1.0 114.611 175.115 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 21.9 tt0 -75.64 -33.36 60.47 Favored 'General case' 0 N--CA 1.429 -1.504 0 N-CA-C 114.719 1.377 . . . . 1.0 114.719 -174.488 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 2.0 tpm_? -64.81 -44.28 90.39 Favored 'General case' 0 N--CA 1.43 -1.426 0 O-C-N 119.668 -1.895 . . . . 1.0 112.433 174.133 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 4.6 mm? -74.13 -31.41 62.74 Favored 'General case' 0 N--CA 1.431 -1.424 0 N-CA-C 113.18 0.807 . . . . 1.0 113.18 178.435 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 20.1 t70 -54.55 -53.57 52.71 Favored 'General case' 0 N--CA 1.431 -1.423 0 O-C-N 120.432 -1.418 . . . . 1.0 113.171 167.909 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 6.0 t70 -96.52 29.64 2.86 Favored 'General case' 0 N--CA 1.43 -1.435 0 CA-C-O 122.175 0.988 . . . . 1.0 112.721 -174.27 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 24' ' ' TRP . . . . . . . . . . . . . 54.6 t-105 -80.27 -177.71 6.25 Favored 'General case' 0 N--CA 1.43 -1.449 0 O-C-N 120.037 -1.664 . . . . 1.0 111.379 177.083 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 40.1 t0 -81.16 65.82 6.44 Favored 'General case' 0 N--CA 1.429 -1.499 0 O-C-N 119.857 -1.777 . . . . 1.0 111.199 179.525 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -179.84 138.74 3.52 Favored Glycine 0 N--CA 1.429 -1.789 0 N-CA-C 107.056 -2.418 . . . . 1.0 107.056 -179.844 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 3.9 t70 -108.74 -43.68 4.2 Favored 'General case' 0 N--CA 1.43 -1.474 0 N-CA-C 108.446 -0.946 . . . . 1.0 108.446 -179.705 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 67.8 m -85.57 159.92 19.76 Favored 'General case' 0 N--CA 1.43 -1.472 0 C-N-CA 126.041 1.737 . . . . 1.0 109.953 171.876 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . 0.683 ' HA ' ' H ' ' A' ' 44' ' ' GLU 0.3 15.9 t70 61.26 20.53 11.12 Favored 'General case' 0 N--CA 1.429 -1.497 0 C-N-CA 128.156 2.582 . . . . 1.0 116.572 176.854 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 10.0 tp -147.21 111.36 0.8 Allowed 'Isoleucine or valine' 0 N--CA 1.43 -1.458 0 O-C-N 120.148 -1.595 . . . . 1.0 107.814 173.219 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 38.2 t0 -153.31 108.68 3.23 Favored 'General case' 0 N--CA 1.43 -1.462 0 O-C-N 120.544 -1.347 . . . . 1.0 108.421 -175.514 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 11.8 t -86.31 143.86 27.67 Favored 'General case' 0 N--CA 1.429 -1.477 0 O-C-N 118.055 -2.903 . . . . 1.0 113.099 -174.855 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 91.7 mt-10 -92.77 136.94 32.8 Favored 'General case' 0 N--CA 1.431 -1.417 0 C-N-CA 125.735 1.614 . . . . 1.0 108.481 167.164 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 4.3 mp -129.66 105.94 12.91 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.444 0 N-CA-C 106.421 -1.696 . . . . 1.0 106.421 177.451 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 35.1 m120 -128.48 77.63 1.79 Allowed 'General case' 0 N--CA 1.43 -1.475 0 CA-C-N 114.768 -1.105 . . . . 1.0 111.045 -178.647 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . 62.49 26.77 68.57 Favored Glycine 0 N--CA 1.429 -1.806 0 N-CA-C 118.587 2.195 . . . . 1.0 118.587 161.255 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 130.92 -32.8 2.94 Favored Glycine 0 N--CA 1.431 -1.685 0 N-CA-C 109.785 -1.326 . . . . 1.0 109.785 -173.82 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 44.9 t -88.41 128.17 40.86 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.434 0 O-C-N 121.639 -0.918 . . . . 1.0 109.212 175.562 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 80.2 mt -114.9 130.26 56.87 Favored 'General case' 0 N--CA 1.43 -1.445 0 N-CA-C 108.089 -1.078 . . . . 1.0 108.089 169.12 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -122.98 114.98 21.14 Favored 'General case' 0 N--CA 1.43 -1.426 0 N-CA-C 106.188 -1.782 . . . . 1.0 106.188 174.926 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 58.7 mt -88.05 112.13 23.21 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.482 0 N-CA-C 105.25 -2.13 . . . . 1.0 105.25 -178.788 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 33.3 m -108.7 143.04 38.32 Favored 'General case' 0 N--CA 1.43 -1.446 0 CA-C-O 122.237 1.017 . . . . 1.0 109.916 -166.024 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 43' ' ' PHE . . . . . . . . . . . . . 53.0 m-85 -115.31 155.96 26.34 Favored 'General case' 0 N--CA 1.43 -1.433 0 C-N-CA 124.874 1.27 . . . . 1.0 108.127 -172.806 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . 0.683 ' H ' ' HA ' ' A' ' 29' ' ' ASP . 5.3 mm-40 -66.12 -23.16 66.44 Favored 'General case' 0 N--CA 1.429 -1.501 0 O-C-N 119.291 -2.131 . . . . 1.0 115.299 164.268 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 49.4 m-80 -65.92 -7.26 15.66 Favored 'General case' 0 N--CA 1.429 -1.48 0 C-N-CA 124.989 1.316 . . . . 1.0 114.128 164.963 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 94.99 -8.49 70.25 Favored Glycine 0 N--CA 1.431 -1.694 0 O-C-N 119.962 -1.711 . . . . 1.0 113.925 169.219 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 1.5 m -80.71 -170.33 2.59 Favored 'General case' 0 N--CA 1.43 -1.45 0 C-N-CA 126.626 1.971 . . . . 1.0 113.001 -171.635 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 44.7 pttt -168.6 126.49 1.07 Allowed 'General case' 0 N--CA 1.43 -1.439 0 O-C-N 119.922 -1.736 . . . . 1.0 114.497 -162.819 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 49' ' ' ILE . . . . . 0.45 HD13 HG23 ' A' ' 64' ' ' THR . 5.9 mm -100.23 107.41 20.92 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.45 0 N-CA-C 106.737 -1.579 . . . . 1.0 106.737 166.298 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 4.5 tp -106.18 117.6 52.24 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.506 0 O-C-N 120.036 -1.665 . . . . 1.0 110.886 -173.942 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 3.7 mt -128.55 131.65 68.58 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.408 0 C-N-CA 125.864 1.666 . . . . 1.0 109.943 -171.444 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 16.8 t30 -161.26 175.03 12.74 Favored 'General case' 0 N--CA 1.432 -1.374 0 N-CA-C 104.628 -2.36 . . . . 1.0 104.628 -172.267 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 60.7 ttp85 -151.22 138.4 19.27 Favored 'General case' 0 N--CA 1.43 -1.46 0 O-C-N 120.033 -1.667 . . . . 1.0 108.238 -162.27 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 1.6 tt0 -149.03 -45.35 0.14 Allowed 'General case' 0 CA--C 1.489 -1.394 0 O-C-N 121.154 -0.966 . . . . 1.0 109.339 -168.647 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 55.5 mt-10 -76.05 147.77 80.64 Favored Pre-proline 0 N--CA 1.43 -1.468 0 N-CA-C 114.277 1.214 . . . . 1.0 114.277 -164.553 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 47.8 Cg_endo -77.6 -174.61 2.29 Favored 'Trans proline' 0 C--N 1.299 -2.06 0 C-N-CA 122.811 2.341 . . . . 1.0 111.478 166.221 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 57' ' ' LEU . . . . . 0.505 ' O ' ' CD2' ' A' ' 58' ' ' HIS . 22.8 mt 79.34 -48.66 0.4 Allowed 'General case' 0 N--CA 1.431 -1.402 0 C-N-CA 128.89 2.876 . . . . 1.0 112.122 178.305 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 58' ' ' HIS . . . . . 0.505 ' CD2' ' O ' ' A' ' 57' ' ' LEU . 20.8 m170 143.82 88.33 0.0 OUTLIER 'General case' 0 N--CA 1.43 -1.452 1 C-N-CA 132.382 4.273 . . . . 1.0 108.014 172.382 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 8.1 tt0 -154.25 145.27 22.7 Favored 'General case' 0 N--CA 1.43 -1.458 0 CA-C-N 123.06 2.664 . . . . 1.0 111.922 168.302 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 2.2 t -127.93 160.16 37.97 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.466 0 C-N-CA 127.478 2.311 . . . . 1.0 111.723 -175.395 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 61' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -109.48 152.44 25.41 Favored 'General case' 0 N--CA 1.431 -1.424 0 C-N-CA 124.564 1.146 . . . . 1.0 110.987 177.222 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 2.3 pt? -154.24 124.08 6.73 Favored 'General case' 0 N--CA 1.43 -1.45 0 CA-C-O 122.655 1.216 . . . . 1.0 109.935 168.781 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . 0.454 ' HA ' ' HA2' ' A' ' 68' ' ' GLY . . . -124.24 130.48 52.59 Favored 'General case' 0 N--CA 1.429 -1.487 0 N-CA-C 115.042 1.497 . . . . 1.0 115.042 -178.813 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 64' ' ' THR . . . . . 0.45 HG23 HD13 ' A' ' 49' ' ' ILE . 8.6 m -123.97 -102.44 0.38 Allowed 'General case' 0 N--CA 1.432 -1.352 0 C-N-CA 124.467 1.107 . . . . 1.0 110.983 177.553 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 9.1 tmtm? -125.92 -40.63 2.01 Favored 'General case' 0 N--CA 1.429 -1.483 0 O-C-N 120.369 -1.457 . . . . 1.0 111.814 -163.648 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 5.2 tm0? -79.42 -23.96 42.84 Favored 'General case' 0 N--CA 1.428 -1.537 0 O-C-N 120.662 -1.274 . . . . 1.0 112.576 -172.872 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . -176.18 -62.58 0.06 OUTLIER Glycine 0 N--CA 1.43 -1.761 0 O-C-N 120.36 -1.462 . . . . 1.0 112.501 171.229 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 68' ' ' GLY . . . . . 0.454 ' HA2' ' HA ' ' A' ' 63' ' ' ALA . . . 107.61 109.59 3.37 Favored Glycine 0 N--CA 1.43 -1.703 0 C-N-CA 124.894 1.235 . . . . 1.0 110.732 -171.322 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 23.1 m-85 -121.64 170.83 9.33 Favored 'General case' 0 N--CA 1.431 -1.404 0 C-N-CA 125.027 1.331 . . . . 1.0 108.665 -169.096 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 5.6 p80 -115.85 161.08 19.29 Favored 'General case' 0 N--CA 1.43 -1.463 0 O-C-N 120.278 -1.514 . . . . 1.0 110.025 171.606 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 71' ' ' PHE . . . . . . . . . . . . 0.273 65.6 t80 -135.27 120.77 19.27 Favored 'General case' 0 N--CA 1.43 -1.431 0 C-N-CA 124.721 1.208 . . . . 1.0 109.829 -144.418 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 51.4 t0 -139.54 165.82 26.23 Favored 'General case' 0 N--CA 1.43 -1.436 0 CA-C-O 121.884 0.85 . . . . 1.0 110.424 -176.96 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 55.9 tp -103.03 121.59 42.88 Favored 'General case' 0 N--CA 1.43 -1.435 0 O-C-N 120.268 -1.52 . . . . 1.0 113.209 -167.48 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 29.6 mmtm -112.65 84.98 2.07 Favored 'General case' 0 N--CA 1.43 -1.439 0 O-C-N 120.9 -1.125 . . . . 1.0 109.305 170.926 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . 73.38 -95.52 0.77 Allowed Glycine 0 N--CA 1.43 -1.736 0 O-C-N 120.573 -1.33 . . . . 1.0 114.823 174.365 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 55.9 m-20 -104.31 -3.83 23.71 Favored 'General case' 0 N--CA 1.43 -1.425 0 C-N-CA 125.645 1.578 . . . . 1.0 112.975 -176.639 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 33.3 tt0 -150.24 132.39 15.37 Favored 'General case' 0 N--CA 1.429 -1.501 0 N-CA-C 106.317 -1.734 . . . . 1.0 106.317 -169.59 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 78' ' ' TRP . . . . . . . . . . . . . 33.7 m95 -79.93 127.29 32.08 Favored 'General case' 0 N--CA 1.43 -1.441 0 O-C-N 120.666 -1.271 . . . . 1.0 108.878 177.224 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 9.5 mt -103.14 135.86 38.56 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.513 0 C-N-CA 125.766 1.626 . . . . 1.0 107.016 177.565 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -81.39 134.63 35.58 Favored 'General case' 0 N--CA 1.43 -1.456 0 O-C-N 121.009 -1.057 . . . . 1.0 109.168 178.36 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 25.7 t70 -77.6 -20.74 53.47 Favored 'General case' 0 N--CA 1.431 -1.411 0 N-CA-C 115.359 1.615 . . . . 1.0 115.359 -162.684 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 4.3 mmp_? -82.71 -90.03 0.08 Allowed 'General case' 0 N--CA 1.43 -1.432 0 O-C-N 120.349 -1.469 . . . . 1.0 113.462 -174.868 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 31.7 p -72.06 -29.64 64.35 Favored 'General case' 0 N--CA 1.431 -1.39 0 O-C-N 120.069 -1.644 . . . . 1.0 114.16 -176.854 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 106.24 83.37 1.62 Allowed Glycine 0 N--CA 1.43 -1.747 0 N-CA-C 109.716 -1.354 . . . . 1.0 109.716 -171.851 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 5.0 mm-40 -140.66 -172.27 3.41 Favored 'General case' 0 N--CA 1.431 -1.422 0 N-CA-C 105.693 -1.966 . . . . 1.0 105.693 -170.854 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 30.1 m -145.84 131.99 19.4 Favored 'General case' 0 N--CA 1.43 -1.444 0 O-C-N 120.578 -1.326 . . . . 1.0 111.435 -155.077 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 1.1 t80 -21.83 -97.08 0.0 OUTLIER 'General case' 0 N--CA 1.43 -1.433 0 N-CA-C 120.418 3.488 . . . . 1.0 120.418 175.523 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 88' ' ' TRP . . . . . . . . . . . . . 29.9 m95 -71.69 -26.83 62.67 Favored 'General case' 0 N--CA 1.431 -1.419 0 O-C-N 120.247 -1.533 . . . . 1.0 110.889 -167.445 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 16.2 m-20 -79.25 -42.21 26.41 Favored 'General case' 0 N--CA 1.43 -1.456 0 C-N-CA 126.432 1.893 . . . . 1.0 112.747 -176.879 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -70.3 -39.94 74.55 Favored 'General case' 0 N--CA 1.43 -1.452 0 O-C-N 119.716 -1.865 . . . . 1.0 111.54 176.007 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 41.0 tp -53.74 -47.28 70.78 Favored 'General case' 0 N--CA 1.429 -1.484 0 C-N-CA 126.252 1.821 . . . . 1.0 113.589 170.345 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 30.2 tt0 -56.73 -56.19 24.68 Favored 'General case' 0 N--CA 1.43 -1.448 0 C-N-CA 125.08 1.352 . . . . 1.0 113.917 169.832 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 38.6 mt-30 -55.34 -42.91 74.48 Favored 'General case' 0 N--CA 1.43 -1.442 0 C-N-CA 125.168 1.387 . . . . 1.0 113.678 179.248 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -59.21 -55.34 36.2 Favored 'General case' 0 N--CA 1.428 -1.526 0 C-N-CA 127.055 2.142 . . . . 1.0 114.395 173.538 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -65.68 -40.64 92.58 Favored 'General case' 0 N--CA 1.429 -1.498 0 O-C-N 120.222 -1.549 . . . . 1.0 113.314 -179.377 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 31.8 m -56.23 -45.81 79.81 Favored 'General case' 0 N--CA 1.43 -1.426 0 C-N-CA 125.215 1.406 . . . . 1.0 114.335 168.257 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 9.0 pt20 -71.8 -22.27 61.59 Favored 'General case' 0 N--CA 1.431 -1.397 0 O-C-N 120.589 -1.319 . . . . 1.0 114.129 -178.465 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 2.4 mm-40 -72.79 -57.64 3.94 Favored 'General case' 0 N--CA 1.431 -1.381 0 O-C-N 121.441 -0.787 . . . . 1.0 112.83 166.549 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -77.09 -41.95 40.13 Favored 'General case' 0 N--CA 1.43 -1.461 0 N-CA-C 117.089 2.255 . . . . 1.0 117.089 -170.563 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . 83.99 43.27 7.22 Favored Glycine 0 N--CA 1.43 -1.704 0 O-C-N 120.86 -1.15 . . . . 1.0 111.907 -165.868 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 4.9 tp10 -161.28 154.53 21.36 Favored 'General case' 0 N--CA 1.431 -1.419 0 N-CA-C 107.409 -1.33 . . . . 1.0 107.409 -169.69 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 93.2 m -78.47 93.68 4.8 Favored 'General case' 0 N--CA 1.43 -1.449 0 O-C-N 118.953 -2.342 . . . . 1.0 110.594 168.821 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 47.9 t -105.48 90.29 1.53 Allowed 'Isoleucine or valine' 0 N--CA 1.43 -1.437 0 C-N-CA 125.844 1.658 . . . . 1.0 106.931 -179.398 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 59.5 p -143.07 178.23 7.83 Favored 'General case' 0 N--CA 1.43 -1.444 0 O-C-N 120.709 -1.245 . . . . 1.0 113.754 -172.678 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -108.93 -40.41 5.03 Favored 'General case' 0 N--CA 1.43 -1.452 0 O-C-N 120.633 -1.292 . . . . 1.0 110.646 177.577 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 24.9 ttp180 . . . . . 0 C--O 1.259 1.581 0 O-C-N 120.766 -1.209 . . . . 1.0 111.824 -165.549 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 4.3 p30 . . . . . 0 N--CA 1.43 -1.435 0 CA-C-O 121.296 0.57 . . . . 1.0 110.145 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 1.1 p-10 -66.58 -30.49 70.8 Favored 'General case' 0 N--CA 1.43 -1.447 0 N-CA-C 114.978 1.473 . . . . 1.0 114.978 -176.67 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 8.5 t -63.52 -54.3 38.45 Favored 'General case' 0 N--CA 1.43 -1.47 0 O-C-N 120.492 -1.38 . . . . 1.0 113.368 174.019 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 53.9 mt-10 -63.38 -42.2 98.81 Favored 'General case' 0 N--CA 1.431 -1.385 0 O-C-N 120.615 -1.303 . . . . 1.0 113.624 176.625 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 6' ' ' PHE . . . . . 0.401 ' CD1' ' HA ' ' A' ' 58' ' ' HIS . 11.6 t80 -44.89 -55.37 5.5 Favored 'General case' 0 N--CA 1.429 -1.479 0 C-N-CA 125.666 1.586 . . . . 1.0 114.5 167.309 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 0.7 OUTLIER -70.08 -30.41 67.63 Favored 'General case' 0 N--CA 1.431 -1.402 0 N-CA-C 114.514 1.302 . . . . 1.0 114.514 -179.61 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 31.1 ttt85 -68.88 -48.78 62.55 Favored 'General case' 0 N--CA 1.43 -1.45 0 C-N-CA 125.816 1.646 . . . . 1.0 113.182 179.152 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 92.1 mt -64.7 -36.77 85.36 Favored 'General case' 0 N--CA 1.429 -1.516 0 C-N-CA 126.193 1.797 . . . . 1.0 112.366 173.589 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -57.78 -47.44 82.53 Favored 'General case' 0 N--CA 1.43 -1.464 0 C-N-CA 124.293 1.037 . . . . 1.0 113.107 171.914 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -56.57 -43.95 80.52 Favored 'General case' 0 N--CA 1.429 -1.522 0 C-N-CA 126.703 2.001 . . . . 1.0 113.4 175.131 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 19.1 mm-40 -54.99 -63.25 1.21 Allowed 'General case' 0 N--CA 1.431 -1.401 0 C-N-CA 124.879 1.272 . . . . 1.0 113.524 172.855 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 3.7 pp -69.86 -39.85 76.12 Favored 'General case' 0 N--CA 1.43 -1.435 0 O-C-N 120.23 -1.543 . . . . 1.0 114.969 -173.621 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 14' ' ' TRP . . . . . 0.432 ' HE1' ' CG2' ' A' ' 51' ' ' ILE . 9.3 m0 -55.02 -48.66 73.07 Favored 'General case' 0 N--CA 1.43 -1.428 0 N-CA-C 114.179 1.178 . . . . 1.0 114.179 172.032 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 41.1 tp -63.71 -39.41 94.24 Favored 'General case' 0 N--CA 1.43 -1.442 0 N-CA-C 113.05 0.759 . . . . 1.0 113.05 175.876 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 25.6 m -52.36 -50.81 61.61 Favored 'General case' 0 N--CA 1.429 -1.497 0 C-N-CA 125.377 1.471 . . . . 1.0 114.709 172.921 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 20.6 mt -66.71 -48.61 79.57 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.483 0 O-C-N 120.174 -1.579 . . . . 1.0 112.206 178.078 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 41.1 tt0 -53.85 -54.56 36.82 Favored 'General case' 0 N--CA 1.43 -1.461 0 C-N-CA 124.638 1.175 . . . . 1.0 112.294 178.114 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 33.9 tt0 -58.32 -49.71 76.23 Favored 'General case' 0 N--CA 1.431 -1.403 0 C-N-CA 126.45 1.9 . . . . 1.0 114.241 178.414 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 8.7 tpm_? -60.49 -44.76 95.61 Favored 'General case' 0 N--CA 1.43 -1.469 0 CA-C-N 119.817 1.19 . . . . 1.0 112.913 -178.964 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 98.1 mt -72.29 -41.14 66.97 Favored 'General case' 0 N--CA 1.43 -1.443 0 N-CA-C 114.594 1.331 . . . . 1.0 114.594 175.769 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 38.0 t70 -59.48 -36.75 76.63 Favored 'General case' 0 N--CA 1.429 -1.483 0 O-C-N 119.365 -2.084 . . . . 1.0 113.566 174.967 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 24.6 t0 -105.17 33.83 3.49 Favored 'General case' 0 N--CA 1.43 -1.475 0 O-C-N 120.181 -1.575 . . . . 1.0 111.261 174.225 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 24' ' ' TRP . . . . . . . . . . . . . 22.6 t-105 -83.41 -61.76 1.76 Allowed 'General case' 0 N--CA 1.429 -1.494 0 O-C-N 119.872 -1.768 . . . . 1.0 109.896 168.515 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 28.1 t70 70.07 -111.66 0.08 Allowed 'General case' 0 N--CA 1.43 -1.438 0 C-N-CA 125.051 1.34 . . . . 1.0 111.501 174.344 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 76.35 -115.7 4.51 Favored Glycine 0 N--CA 1.43 -1.761 0 O-C-N 120.025 -1.672 . . . . 1.0 114.147 172.921 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -101.89 -19.45 15.27 Favored 'General case' 0 N--CA 1.431 -1.419 0 C-N-CA 124.962 1.305 . . . . 1.0 109.788 172.159 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 54.0 p -80.71 173.63 12.41 Favored 'General case' 0 N--CA 1.429 -1.476 0 N-CA-C 115.949 1.833 . . . . 1.0 115.949 -170.262 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 4.7 t70 -130.53 150.77 51.59 Favored 'General case' 0 N--CA 1.431 -1.416 0 N-CA-C 106.31 -1.737 . . . . 1.0 106.31 161.952 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER -155.16 114.27 0.32 Allowed 'Isoleucine or valine' 0 N--CA 1.431 -1.404 0 C-N-CA 125.047 1.339 . . . . 1.0 108.45 -159.923 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 21.1 m-20 -120.35 107.2 12.65 Favored 'General case' 0 N--CA 1.43 -1.441 0 C-N-CA 125.39 1.476 . . . . 1.0 110.645 174.12 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 27.6 t -86.34 136.22 33.22 Favored 'General case' 0 N--CA 1.431 -1.382 0 O-C-N 119.762 -1.836 . . . . 1.0 109.85 165.904 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 79.1 mt-10 -112.22 135.53 52.78 Favored 'General case' 0 N--CA 1.429 -1.478 0 O-C-N 120.904 -1.122 . . . . 1.0 109.342 179.292 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 3.2 tp -111.03 105.48 18.89 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.419 0 CA-C-O 125.1 2.381 . . . . 1.0 107.766 176.297 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 76.6 m-20 -115.63 74.68 0.9 Allowed 'General case' 0 N--CA 1.431 -1.408 0 CA-C-N 113.102 -1.863 . . . . 1.0 109.11 -179.382 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . 76.34 -92.16 0.96 Allowed Glycine 0 N--CA 1.43 -1.733 0 O-C-N 120.663 -1.273 . . . . 1.0 114.588 174.42 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -120.75 20.51 8.7 Favored Glycine 0 N--CA 1.431 -1.695 0 C-N-CA 124.308 0.956 . . . . 1.0 111.054 174.156 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 40.8 t -121.43 123.96 70.8 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.459 0 N-CA-C 107.543 -1.28 . . . . 1.0 107.543 178.257 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 12.6 mt -111.93 130.1 55.96 Favored 'General case' 0 N--CA 1.43 -1.448 0 CA-C-O 122.865 1.317 . . . . 1.0 107.973 167.308 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 17.9 p -126.33 125.8 42.86 Favored 'General case' 0 N--CA 1.431 -1.425 0 N-CA-C 107.387 -1.338 . . . . 1.0 107.387 177.868 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 22.8 mt -106.11 122.77 60.21 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.416 0 N-CA-C 108.846 -0.798 . . . . 1.0 108.846 -177.166 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 39.6 p -116.69 128.21 55.13 Favored 'General case' 0 N--CA 1.43 -1.449 0 CA-C-O 121.177 0.513 . . . . 1.0 112.055 -173.229 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 43' ' ' PHE . . . . . . . . . . . . . 26.1 p90 -119.66 171.85 8.09 Favored 'General case' 0 N--CA 1.431 -1.415 0 C-N-CA 124.447 1.099 . . . . 1.0 111.333 175.504 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 37.3 mm-40 -51.21 -30.88 18.57 Favored 'General case' 0 N--CA 1.43 -1.431 0 N-CA-C 118.88 2.918 . . . . 1.0 118.88 -173.154 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 6.6 m120 -66.95 -17.88 65.12 Favored 'General case' 0 N--CA 1.431 -1.424 0 O-C-N 119.761 -1.837 . . . . 1.0 114.0 179.007 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 86.95 -0.26 86.14 Favored Glycine 0 N--CA 1.429 -1.776 0 O-C-N 120.505 -1.372 . . . . 1.0 113.463 179.449 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 48.2 m -88.48 158.08 18.45 Favored 'General case' 0 N--CA 1.429 -1.502 0 C-N-CA 125.428 1.491 . . . . 1.0 107.66 167.702 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 6.8 ptpt -154.76 159.58 40.74 Favored 'General case' 0 N--CA 1.43 -1.431 0 O-C-N 120.933 -1.104 . . . . 1.0 112.878 -167.294 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 8.9 mm -100.37 137.64 27.23 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.477 0 N-CA-C 106.587 -1.635 . . . . 1.0 106.587 177.107 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 50' ' ' ILE . . . . . 0.405 ' HB ' ' HB3' ' A' ' 63' ' ' ALA . 4.7 mm -126.21 116.7 46.44 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.472 0 C-N-CA 124.518 1.127 . . . . 1.0 109.692 -178.516 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 51' ' ' ILE . . . . . 0.432 ' CG2' ' HE1' ' A' ' 14' ' ' TRP . 3.3 mt -128.47 128.11 67.78 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.428 0 CA-C-O 122.424 1.107 . . . . 1.0 112.378 -179.629 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 52' ' ' ASN . . . . . 0.611 ' H ' ' HD1' ' A' ' 61' ' ' TRP . 20.4 t-20 -151.35 162.47 40.87 Favored 'General case' 0 N--CA 1.43 -1.471 0 C-N-CA 126.452 1.901 . . . . 1.0 105.995 174.379 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -129.09 145.87 51.18 Favored 'General case' 0 N--CA 1.43 -1.432 0 C-N-CA 125.829 1.651 . . . . 1.0 109.897 -174.498 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 2.2 tt0 -151.25 -38.9 0.12 Allowed 'General case' 0 N--CA 1.431 -1.419 0 O-C-N 120.878 -1.139 . . . . 1.0 111.323 -168.993 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 28.8 mm-40 -70.99 156.55 91.9 Favored Pre-proline 0 N--CA 1.43 -1.47 0 N-CA-C 114.417 1.265 . . . . 1.0 114.417 -168.83 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 39.1 Cg_endo -75.88 -25.86 10.13 Favored 'Trans proline' 0 C--N 1.3 -1.987 0 C-N-CA 121.916 1.744 . . . . 1.0 114.126 -165.626 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 49.4 mt -93.51 -112.87 0.1 Allowed 'General case' 0 N--CA 1.429 -1.496 0 CA-C-O 122.726 1.251 . . . . 1.0 111.018 -173.804 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 58' ' ' HIS . . . . . 0.401 ' HA ' ' CD1' ' A' ' 6' ' ' PHE . 39.3 m170 -125.85 70.1 1.2 Allowed 'General case' 0 N--CA 1.431 -1.394 0 C-N-CA 124.619 1.168 . . . . 1.0 109.171 174.827 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 9.6 mt-30 -141.06 125.44 17.59 Favored 'General case' 0 N--CA 1.431 -1.42 0 O-C-N 120.362 -1.461 . . . . 1.0 109.93 -175.683 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 88.6 t -124.32 156.41 32.0 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.509 0 O-C-N 120.942 -1.099 . . . . 1.0 108.825 -174.77 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 61' ' ' TRP . . . . . 0.611 ' HD1' ' H ' ' A' ' 52' ' ' ASN . 0.0 OUTLIER -92.6 152.22 19.7 Favored 'General case' 0 N--CA 1.43 -1.426 0 O-C-N 120.142 -1.599 . . . . 1.0 110.553 -178.201 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 2.2 tm? -137.27 98.26 3.68 Favored 'General case' 0 N--CA 1.429 -1.5 0 O-C-N 120.41 -1.432 . . . . 1.0 110.465 176.107 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . 0.405 ' HB3' ' HB ' ' A' ' 50' ' ' ILE . . . -103.95 139.61 38.86 Favored 'General case' 0 N--CA 1.431 -1.422 0 CA-C-O 123.314 1.531 . . . . 1.0 111.812 172.378 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 64' ' ' THR . . . . . 0.478 HG23 ' H ' ' A' ' 65' ' ' LYS . 0.0 OUTLIER -153.98 -80.16 0.09 Allowed 'General case' 0 N--CA 1.43 -1.436 0 C-N-CA 126.301 1.84 . . . . 1.0 107.066 -174.304 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 65' ' ' LYS . . . . . 0.478 ' H ' HG23 ' A' ' 64' ' ' THR . 3.6 tmtt? -116.65 -53.74 2.49 Favored 'General case' 0 N--CA 1.429 -1.494 0 C-N-CA 125.182 1.393 . . . . 1.0 113.376 176.831 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 50.7 mt-30 -72.43 -24.35 61.21 Favored 'General case' 0 N--CA 1.429 -1.499 0 N-CA-C 117.99 2.589 . . . . 1.0 117.99 -160.803 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 151.49 -9.93 0.7 Allowed Glycine 0 N--CA 1.43 -1.711 0 N-CA-C 116.714 1.446 . . . . 1.0 116.714 174.593 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 98.85 77.01 1.29 Allowed Glycine 0 N--CA 1.43 -1.731 0 CA-C-N 118.902 1.351 . . . . 1.0 110.77 -176.066 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 14.5 m-30 -102.22 122.14 43.61 Favored 'General case' 0 N--CA 1.43 -1.468 0 C-N-CA 124.345 1.058 . . . . 1.0 108.547 -175.589 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -86.5 157.25 19.82 Favored 'General case' 0 N--CA 1.431 -1.411 0 O-C-N 119.974 -1.704 . . . . 1.0 114.288 -179.271 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 49.6 p90 -129.37 138.45 51.53 Favored 'General case' 0 N--CA 1.429 -1.499 0 N-CA-C 113.296 0.85 . . . . 1.0 113.296 -165.558 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 23.5 t0 -126.99 159.54 33.77 Favored 'General case' 0 N--CA 1.43 -1.443 0 C-N-CA 126.34 1.856 . . . . 1.0 110.183 -176.779 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 7.0 tt -91.78 122.44 34.33 Favored 'General case' 0 N--CA 1.429 -1.495 0 O-C-N 120.471 -1.393 . . . . 1.0 112.664 -170.764 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 28.9 tptp -83.56 -56.59 3.65 Favored 'General case' 0 N--CA 1.43 -1.47 0 O-C-N 120.441 -1.412 . . . . 1.0 110.782 167.826 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -170.84 -79.65 0.05 OUTLIER Glycine 0 CA--C 1.487 -1.663 0 O-C-N 120.91 -1.119 . . . . 1.0 111.411 -179.805 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 7.6 m-20 -93.79 5.59 51.15 Favored 'General case' 0 N--CA 1.43 -1.451 0 C-N-CA 124.936 1.294 . . . . 1.0 111.139 178.93 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 7.7 pt-20 -165.59 145.33 6.57 Favored 'General case' 0 N--CA 1.431 -1.414 0 N-CA-C 104.383 -2.451 . . . . 1.0 104.383 -153.716 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 78' ' ' TRP . . . . . . . . . . . . . 27.4 m95 -111.79 139.1 47.54 Favored 'General case' 0 N--CA 1.431 -1.39 0 N-CA-C 107.633 -1.247 . . . . 1.0 107.633 178.254 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 40.4 mt -96.32 135.73 29.48 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.483 0 C-N-CA 127.247 2.219 . . . . 1.0 107.977 -179.379 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 75.8 m -82.5 122.19 27.73 Favored 'General case' 0 N--CA 1.431 -1.41 0 N-CA-C 108.154 -1.054 . . . . 1.0 108.154 171.684 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 16.3 t70 -66.68 -47.87 71.1 Favored 'General case' 0 N--CA 1.429 -1.485 0 N-CA-C 114.224 1.194 . . . . 1.0 114.224 -167.227 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 17.1 mmt180 -72.25 129.24 37.97 Favored 'General case' 0 N--CA 1.43 -1.455 0 O-C-N 120.899 -1.126 . . . . 1.0 109.55 177.804 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 83' ' ' SER . . . . . . . . . . . . 0.27 5.6 t 76.45 -47.64 0.55 Allowed 'General case' 0 N--CA 1.428 -1.532 0 C-N-CA 126.869 2.068 . . . . 1.0 114.124 -168.473 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 99.33 70.91 0.97 Allowed Glycine 0 N--CA 1.429 -1.773 0 O-C-N 120.69 -1.256 . . . . 1.0 111.024 176.68 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 5.5 mm-40 -128.97 -131.89 0.22 Allowed 'General case' 0 N--CA 1.431 -1.418 0 C-N-CA 124.156 0.983 . . . . 1.0 110.752 -166.35 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 93.9 m -153.76 133.61 13.1 Favored 'General case' 0 N--CA 1.431 -1.383 0 O-C-N 120.551 -1.343 . . . . 1.0 109.46 -157.34 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 87' ' ' PHE . . . . . . . . . . . . 0.309 0.0 OUTLIER -49.3 -83.11 0.01 OUTLIER 'General case' 0 N--CA 1.43 -1.446 0 N-CA-C 119.939 3.311 . . . . 1.0 119.939 -175.911 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 88' ' ' TRP . . . . . . . . . . . . . 7.9 m95 -65.83 -34.37 78.01 Favored 'General case' 0 N--CA 1.43 -1.443 0 O-C-N 119.84 -1.788 . . . . 1.0 113.367 -175.106 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -61.64 -41.97 98.25 Favored 'General case' 0 N--CA 1.431 -1.408 0 N-CA-C 114.409 1.263 . . . . 1.0 114.409 176.148 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 17.9 tp -67.82 -48.93 64.86 Favored 'General case' 0 N--CA 1.43 -1.454 0 O-C-N 120.647 -1.283 . . . . 1.0 111.054 175.808 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 58.0 tp -51.96 -46.33 64.76 Favored 'General case' 0 N--CA 1.429 -1.492 0 C-N-CA 126.268 1.827 . . . . 1.0 113.752 174.017 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 18.6 tt0 -53.32 -54.39 37.17 Favored 'General case' 0 N--CA 1.429 -1.501 0 C-N-CA 125.983 1.713 . . . . 1.0 111.873 171.639 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -59.23 -53.25 60.4 Favored 'General case' 0 N--CA 1.43 -1.429 0 N-CA-C 113.418 0.896 . . . . 1.0 113.418 -178.188 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -59.7 -43.92 93.88 Favored 'General case' 0 N--CA 1.43 -1.436 0 C-N-CA 125.841 1.656 . . . . 1.0 115.381 178.455 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -71.31 -40.31 70.87 Favored 'General case' 0 N--CA 1.429 -1.517 0 O-C-N 120.497 -1.377 . . . . 1.0 112.988 178.53 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 95.1 m -63.65 -37.02 85.76 Favored 'General case' 0 N--CA 1.43 -1.44 0 C-N-CA 126.415 1.886 . . . . 1.0 112.06 174.304 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -57.35 -54.54 45.67 Favored 'General case' 0 CA--C 1.489 -1.395 0 C-N-CA 127.108 2.163 . . . . 1.0 112.205 173.382 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 2.3 pt20 -73.57 -33.73 64.79 Favored 'General case' 0 N--CA 1.43 -1.454 0 N-CA-C 115.217 1.562 . . . . 1.0 115.217 179.165 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -75.36 -41.24 56.94 Favored 'General case' 0 N--CA 1.43 -1.47 0 O-C-N 120.111 -1.618 . . . . 1.0 115.206 177.863 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . 85.87 24.41 41.84 Favored Glycine 0 N--CA 1.429 -1.791 0 C-N-CA 124.692 1.139 . . . . 1.0 112.763 -175.198 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 9.3 pt-20 -175.44 159.19 2.39 Favored 'General case' 0 N--CA 1.43 -1.462 0 C-N-CA 126.495 1.918 . . . . 1.0 106.117 -176.24 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 44.0 m -69.79 130.77 43.22 Favored 'General case' 0 N--CA 1.43 -1.456 0 O-C-N 120.792 -1.193 . . . . 1.0 113.271 -169.041 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 69.3 t -102.1 120.96 52.52 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.416 0 N-CA-C 107.771 -1.196 . . . . 1.0 107.771 173.768 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 19.7 m -107.03 141.94 37.46 Favored 'General case' 0 N--CA 1.429 -1.493 0 N-CA-C 115.103 1.52 . . . . 1.0 115.103 -160.285 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 2.6 p90 -127.28 -43.36 1.63 Allowed 'General case' 0 N--CA 1.43 -1.467 0 C-N-CA 125.509 1.524 . . . . 1.0 110.783 179.191 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 30.2 mtt-85 . . . . . 0 C--O 1.261 1.671 0 C-N-CA 124.465 1.106 . . . . 1.0 111.05 -179.907 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 26.5 mmt . . . . . 0 CA--C 1.49 -1.361 0 CA-C-O 121.369 0.604 . . . . 1.0 110.964 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 7.1 p30 -93.27 -51.21 5.11 Favored 'General case' 0 N--CA 1.43 -1.458 0 O-C-N 120.185 -1.572 . . . . 1.0 113.842 -170.172 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 35.3 t70 -55.92 -40.08 72.59 Favored 'General case' 0 N--CA 1.429 -1.479 0 C-N-CA 127.125 2.17 . . . . 1.0 113.46 -178.543 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 5.2 p -68.49 -37.94 80.55 Favored 'General case' 0 N--CA 1.43 -1.467 0 C-N-CA 126.274 1.83 . . . . 1.0 114.359 174.972 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 14.2 tp10 -67.74 -53.06 30.44 Favored 'General case' 0 N--CA 1.43 -1.435 0 C-N-CA 125.226 1.41 . . . . 1.0 110.115 177.925 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 16.3 t80 -47.25 -50.94 20.17 Favored 'General case' 0 N--CA 1.431 -1.425 0 C-N-CA 127.425 2.29 . . . . 1.0 114.821 169.657 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 35.2 m-70 -63.97 -41.43 97.56 Favored 'General case' 0 N--CA 1.43 -1.452 0 N-CA-C 114.907 1.447 . . . . 1.0 114.907 177.989 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -70.76 -37.19 73.38 Favored 'General case' 0 N--CA 1.43 -1.435 0 O-C-N 120.366 -1.459 . . . . 1.0 114.074 178.887 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 79.7 mt -59.58 -51.55 69.37 Favored 'General case' 0 N--CA 1.43 -1.444 0 C-N-CA 124.99 1.316 . . . . 1.0 111.747 168.239 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -54.06 -50.34 66.95 Favored 'General case' 0 N--CA 1.431 -1.416 0 C-N-CA 125.011 1.324 . . . . 1.0 113.458 176.991 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -51.58 -49.71 61.57 Favored 'General case' 0 N--CA 1.43 -1.425 0 N-CA-C 114.783 1.401 . . . . 1.0 114.783 173.136 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 12.2 pt20 -68.9 -33.27 73.49 Favored 'General case' 0 N--CA 1.43 -1.433 0 N-CA-C 115.583 1.697 . . . . 1.0 115.583 179.764 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 84.8 mt -66.74 -59.07 3.89 Favored 'General case' 0 N--CA 1.431 -1.419 0 O-C-N 120.087 -1.633 . . . . 1.0 111.02 174.753 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 1.2 m-90 -50.3 -50.11 51.58 Favored 'General case' 0 N--CA 1.429 -1.487 0 C-N-CA 125.65 1.58 . . . . 1.0 113.27 -179.565 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 41.0 tp -61.85 -59.05 5.71 Favored 'General case' 0 N--CA 1.43 -1.447 0 N-CA-C 113.626 0.973 . . . . 1.0 113.626 175.775 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 59.6 m -64.88 -37.42 87.58 Favored 'General case' 0 N--CA 1.431 -1.4 0 N-CA-C 114.252 1.204 . . . . 1.0 114.252 -173.621 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 93.5 mt -64.63 -54.24 32.7 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.458 0 C-N-CA 124.923 1.289 . . . . 1.0 111.686 174.83 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 1.7 tt0 -55.48 -49.66 71.94 Favored 'General case' 0 N--CA 1.43 -1.473 0 C-N-CA 123.984 0.914 . . . . 1.0 113.386 178.565 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 44.4 tt0 -54.65 -49.1 71.38 Favored 'General case' 0 N--CA 1.429 -1.493 0 C-N-CA 125.966 1.706 . . . . 1.0 114.025 174.173 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 7.4 tpm_? -58.95 -45.92 89.29 Favored 'General case' 0 N--CA 1.431 -1.406 0 O-C-N 120.726 -1.234 . . . . 1.0 114.291 179.818 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 3.8 pp -83.51 -26.97 29.71 Favored 'General case' 0 N--CA 1.431 -1.384 0 N-CA-C 115.097 1.517 . . . . 1.0 115.097 -177.387 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 8.7 t70 -62.71 -34.09 76.44 Favored 'General case' 0 CA--C 1.488 -1.405 0 O-C-N 120.336 -1.478 . . . . 1.0 113.342 163.591 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 19.2 t70 -70.59 -55.08 9.65 Favored 'General case' 0 N--CA 1.43 -1.472 0 C-N-CA 126.201 1.8 . . . . 1.0 114.559 178.405 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' TRP . . . . . . . . . . . . . 32.4 t-105 -73.03 138.68 46.11 Favored 'General case' 0 N--CA 1.43 -1.456 0 O-C-N 120.703 -1.248 . . . . 1.0 113.104 -172.643 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 63.3 m-20 -84.16 -141.33 0.07 Allowed 'General case' 0 N--CA 1.431 -1.408 0 O-C-N 120.327 -1.483 . . . . 1.0 112.054 177.519 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 164.3 -164.8 36.9 Favored Glycine 0 N--CA 1.431 -1.664 0 O-C-N 118.592 -2.568 . . . . 1.0 114.181 -175.221 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 37.4 t70 -86.84 -53.43 4.92 Favored 'General case' 0 N--CA 1.43 -1.463 0 C-N-CA 125.238 1.415 . . . . 1.0 107.911 169.242 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 4.5 t -82.7 -176.48 6.3 Favored 'General case' 0 N--CA 1.431 -1.414 0 C-N-CA 125.728 1.611 . . . . 1.0 109.691 178.94 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 32.9 t0 -99.85 178.63 4.76 Favored 'General case' 0 N--CA 1.43 -1.449 0 O-C-N 120.26 -1.525 . . . . 1.0 108.142 175.218 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 9.3 tp -152.26 126.58 1.41 Allowed 'Isoleucine or valine' 0 N--CA 1.43 -1.431 0 N-CA-C 106.936 -1.505 . . . . 1.0 106.936 -173.974 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 28.4 t70 -131.73 119.07 20.82 Favored 'General case' 0 N--CA 1.43 -1.439 0 CA-C-O 122.956 1.36 . . . . 1.0 109.13 163.299 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 17.3 p -86.21 131.17 34.3 Favored 'General case' 0 N--CA 1.43 -1.445 0 O-C-N 120.088 -1.632 . . . . 1.0 111.228 174.349 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 41.0 mm-40 -100.06 137.5 38.42 Favored 'General case' 0 N--CA 1.429 -1.488 0 C-N-CA 124.708 1.203 . . . . 1.0 108.916 174.651 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 3.5 tp -127.42 114.1 34.79 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.407 0 CA-C-O 124.046 1.879 . . . . 1.0 106.245 178.81 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 1.6 t-20 -125.81 179.98 4.93 Favored 'General case' 0 N--CA 1.43 -1.427 0 C-N-CA 124.805 1.242 . . . . 1.0 107.828 176.663 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -71.36 87.36 0.41 Allowed Glycine 0 N--CA 1.431 -1.653 0 O-C-N 120.566 -1.334 . . . . 1.0 115.898 -168.657 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 82.2 23.57 56.67 Favored Glycine 0 N--CA 1.429 -1.792 0 C-N-CA 125.379 1.466 . . . . 1.0 112.526 -171.889 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 61.8 t -138.84 135.05 42.92 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.475 0 CA-C-N 118.307 1.053 . . . . 1.0 109.109 -173.253 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 31.1 mt -118.07 142.01 47.86 Favored 'General case' 0 N--CA 1.43 -1.427 0 CA-C-O 122.919 1.343 . . . . 1.0 108.799 166.273 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -138.49 111.3 7.71 Favored 'General case' 0 N--CA 1.43 -1.426 0 O-C-N 120.422 -1.424 . . . . 1.0 108.436 178.032 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 70.3 mt -96.83 105.41 17.07 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.467 0 N-CA-C 107.362 -1.347 . . . . 1.0 107.362 -165.859 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 14.0 m -118.44 131.2 56.28 Favored 'General case' 0 N--CA 1.43 -1.457 0 CA-C-N 118.896 0.771 . . . . 1.0 112.994 -163.053 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 43' ' ' PHE . . . . . . . . . . . . . 1.4 m-85 -99.56 173.68 6.61 Favored 'General case' 0 N--CA 1.43 -1.431 0 O-C-N 120.608 -1.308 . . . . 1.0 111.193 -179.381 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -71.77 -19.03 62.08 Favored 'General case' 0 N--CA 1.429 -1.481 0 O-C-N 119.219 -2.175 . . . . 1.0 113.476 -179.466 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 29.0 t-20 -67.21 -17.97 65.05 Favored 'General case' 0 N--CA 1.429 -1.502 0 C-N-CA 126.811 2.044 . . . . 1.0 113.512 170.731 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 92.34 -14.9 63.5 Favored Glycine 0 N--CA 1.43 -1.74 0 O-C-N 119.962 -1.712 . . . . 1.0 113.683 179.666 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 13.8 m -77.8 167.86 20.86 Favored 'General case' 0 N--CA 1.431 -1.425 0 O-C-N 121.082 -1.246 . . . . 1.0 111.077 172.943 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 12.9 ptpt -169.93 157.68 6.82 Favored 'General case' 0 N--CA 1.43 -1.439 0 O-C-N 121.156 -0.965 . . . . 1.0 113.07 -162.668 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 5.3 mm -101.54 137.11 30.39 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.438 0 C-N-CA 125.791 1.636 . . . . 1.0 107.389 171.823 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 16.1 mm -111.17 116.85 53.61 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.437 0 C-N-CA 125.032 1.333 . . . . 1.0 109.382 -178.013 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 3.0 mt -125.43 124.76 67.68 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.506 0 O-C-N 120.717 -1.239 . . . . 1.0 110.695 179.297 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 52' ' ' ASN . . . . . 0.481 ' H ' ' HD1' ' A' ' 61' ' ' TRP . 26.6 t30 -162.52 172.93 14.7 Favored 'General case' 0 N--CA 1.43 -1.471 0 N-CA-C 103.142 -2.91 . . . . 1.0 103.142 -172.815 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 1.9 ptm180 -139.76 150.57 44.93 Favored 'General case' 0 N--CA 1.429 -1.524 0 CA-C-O 122.546 1.165 . . . . 1.0 112.337 -158.913 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 15.8 mm-40 -107.16 -108.42 0.31 Allowed 'General case' 0 N--CA 1.43 -1.448 0 C-N-CA 124.653 1.181 . . . . 1.0 109.562 -167.173 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 33.2 mm-40 -79.23 135.75 57.6 Favored Pre-proline 0 N--CA 1.43 -1.446 0 CA-C-O 117.718 -1.134 . . . . 1.0 112.799 -172.041 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 98.5 Cg_endo -73.45 62.69 4.46 Favored 'Trans proline' 0 N--CA 1.434 -1.999 0 C-N-CA 123.277 2.651 . . . . 1.0 112.319 162.997 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . 0.432 ' O ' ' HD2' ' A' ' 58' ' ' HIS . 73.1 mt -120.32 -103.0 0.41 Allowed 'General case' 0 N--CA 1.429 -1.493 0 N-CA-C 102.841 -3.022 . . . . 1.0 102.841 164.483 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 58' ' ' HIS . . . . . 0.432 ' HD2' ' O ' ' A' ' 57' ' ' LEU . 42.0 m170 -132.47 92.02 3.01 Favored 'General case' 0 N--CA 1.429 -1.489 0 N-CA-C 106.622 -1.622 . . . . 1.0 106.622 159.412 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 22.1 tt0 -158.68 122.05 3.84 Favored 'General case' 0 N--CA 1.429 -1.516 0 CA-C-N 121.687 2.04 . . . . 1.0 114.161 173.005 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 86.4 t -133.36 157.57 42.63 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.451 0 C-N-CA 127.031 2.132 . . . . 1.0 109.437 -179.013 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 61' ' ' TRP . . . . . 0.481 ' HD1' ' H ' ' A' ' 52' ' ' ASN . 0.0 OUTLIER -111.36 156.06 22.16 Favored 'General case' 0 N--CA 1.429 -1.505 0 C-N-CA 127.867 2.467 . . . . 1.0 109.755 -174.169 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . 0.277 2.3 pt? -150.91 134.01 16.03 Favored 'General case' 0 N--CA 1.432 -1.364 0 CA-C-N 120.686 1.584 . . . . 1.0 113.916 150.939 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -120.08 147.29 45.03 Favored 'General case' 0 N--CA 1.429 -1.514 0 C-N-CA 125.367 1.467 . . . . 1.0 114.429 -179.557 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 64' ' ' THR . . . . . . . . . . . . . 12.5 t -153.96 -149.52 0.29 Allowed 'General case' 0 N--CA 1.429 -1.509 0 C-N-CA 126.745 2.018 . . . . 1.0 112.388 -172.694 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 5.6 tmtm? -63.56 -53.57 49.64 Favored 'General case' 0 N--CA 1.43 -1.456 0 C-N-CA 130.116 3.366 . . . . 1.0 114.362 -174.404 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 31.3 tt0 -82.24 2.19 33.02 Favored 'General case' 0 N--CA 1.429 -1.492 0 CA-C-O 122.581 1.181 . . . . 1.0 111.602 -177.008 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 117.5 -72.92 0.29 Allowed Glycine 0 N--CA 1.43 -1.732 0 N-CA-C 107.343 -2.303 . . . . 1.0 107.343 -177.4 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 106.06 -173.43 19.85 Favored Glycine 0 N--CA 1.43 -1.733 0 C-N-CA 124.229 0.918 . . . . 1.0 112.486 -176.382 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -162.05 169.83 20.29 Favored 'General case' 0 N--CA 1.431 -1.423 0 N-CA-C 107.284 -1.376 . . . . 1.0 107.284 -173.008 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 19.8 p80 -79.87 159.9 26.25 Favored 'General case' 0 N--CA 1.431 -1.422 0 O-C-N 119.775 -1.828 . . . . 1.0 114.653 174.504 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 71' ' ' PHE . . . . . . . . . . . . 0.3 72.3 t80 -112.21 113.77 26.2 Favored 'General case' 0 N--CA 1.431 -1.402 0 C-N-CA 127.744 2.418 . . . . 1.0 107.019 -158.565 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 5.7 m-20 -134.12 155.1 50.66 Favored 'General case' 0 N--CA 1.43 -1.459 0 CA-C-O 121.851 0.834 . . . . 1.0 110.546 -173.99 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 8.0 tt -97.37 133.53 41.84 Favored 'General case' 0 N--CA 1.431 -1.42 0 O-C-N 119.68 -1.888 . . . . 1.0 111.869 -166.677 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 53.5 tttm -101.81 -56.39 2.29 Favored 'General case' 0 N--CA 1.43 -1.471 0 O-C-N 120.823 -1.173 . . . . 1.0 109.556 174.539 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -157.03 -96.91 0.12 Allowed Glycine 0 N--CA 1.431 -1.677 0 O-C-N 121.035 -1.041 . . . . 1.0 111.346 175.863 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 27.9 m-20 -89.72 16.31 8.17 Favored 'General case' 0 N--CA 1.429 -1.479 0 O-C-N 121.047 -1.266 . . . . 1.0 111.405 179.94 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 32.9 tt0 -166.02 132.83 2.66 Favored 'General case' 0 N--CA 1.43 -1.427 0 N-CA-C 102.046 -3.316 . . . . 1.0 102.046 -161.484 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 78' ' ' TRP . . . . . . . . . . . . . 50.2 m95 -87.75 144.88 26.39 Favored 'General case' 0 N--CA 1.432 -1.37 0 N-CA-C 106.322 -1.732 . . . . 1.0 106.322 175.186 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 9.4 pt -102.35 167.54 2.33 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.485 0 N-CA-C 106.618 -1.623 . . . . 1.0 106.618 174.083 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 1.4 m -89.79 135.65 33.5 Favored 'General case' 0 N--CA 1.429 -1.484 0 O-C-N 120.195 -1.565 . . . . 1.0 107.193 155.29 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 36.8 t70 -59.94 -38.87 83.66 Favored 'General case' 0 N--CA 1.43 -1.447 0 CA-C-N 120.689 1.586 . . . . 1.0 115.069 -174.238 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -9.85 -84.34 0.0 OUTLIER 'General case' 0 N--CA 1.43 -1.467 0 C-N-CA 131.628 3.971 . . . . 1.0 118.457 176.634 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 58.8 m -111.19 -12.79 14.09 Favored 'General case' 0 CA--C 1.489 -1.371 0 O-C-N 120.485 -1.384 . . . . 1.0 109.588 158.126 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 115.85 76.41 0.63 Allowed Glycine 0 N--CA 1.43 -1.763 0 N-CA-C 108.041 -2.023 . . . . 1.0 108.041 -173.509 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 5.2 mm-40 -100.74 -136.4 0.31 Allowed 'General case' 0 N--CA 1.431 -1.419 0 N-CA-C 109.141 -0.688 . . . . 1.0 109.141 -175.583 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 95.5 m -154.2 133.95 12.94 Favored 'General case' 0 N--CA 1.43 -1.445 0 O-C-N 120.156 -1.59 . . . . 1.0 110.402 -171.317 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 1.1 t80 -38.02 -92.13 0.0 OUTLIER 'General case' 0 CA--C 1.489 -1.375 0 C-N-CA 128.432 2.693 . . . . 1.0 115.842 168.895 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 88' ' ' TRP . . . . . . . . . . . . . 50.7 m95 -63.16 -32.69 74.14 Favored 'General case' 0 N--CA 1.431 -1.419 0 C-N-CA 125.649 1.58 . . . . 1.0 113.454 -167.195 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 35.7 t70 -77.96 -42.94 31.24 Favored 'General case' 0 N--CA 1.43 -1.456 0 C-N-CA 125.088 1.355 . . . . 1.0 113.027 -175.898 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 35.0 tp -75.3 -38.9 60.08 Favored 'General case' 0 N--CA 1.43 -1.46 0 O-C-N 119.427 -2.045 . . . . 1.0 111.332 179.335 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 41.9 tp -54.78 -38.64 67.51 Favored 'General case' 0 N--CA 1.43 -1.427 0 C-N-CA 126.33 1.852 . . . . 1.0 113.626 168.106 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 3.4 tm-20 -56.85 -59.9 4.35 Favored 'General case' 0 N--CA 1.429 -1.506 0 C-N-CA 124.611 1.164 . . . . 1.0 112.043 165.875 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 35.9 mt-30 -51.92 -41.81 62.29 Favored 'General case' 0 N--CA 1.43 -1.425 0 N-CA-C 116.28 1.956 . . . . 1.0 116.28 177.394 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -59.19 -58.39 8.84 Favored 'General case' 0 N--CA 1.43 -1.473 0 C-N-CA 126.523 1.929 . . . . 1.0 113.906 172.424 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -62.77 -49.11 76.3 Favored 'General case' 0 N--CA 1.429 -1.507 0 O-C-N 120.41 -1.431 . . . . 1.0 113.446 179.783 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 66.1 m -48.18 -47.55 35.11 Favored 'General case' 0 N--CA 1.43 -1.437 0 C-N-CA 127.859 2.464 . . . . 1.0 114.913 170.501 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 6.6 pt20 -73.4 -30.93 63.59 Favored 'General case' 0 N--CA 1.43 -1.441 0 O-C-N 120.306 -1.496 . . . . 1.0 114.428 -179.222 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 49.7 mt-30 -81.03 -37.93 28.3 Favored 'General case' 0 N--CA 1.431 -1.379 0 O-C-N 120.323 -1.486 . . . . 1.0 113.868 174.715 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -79.42 -42.76 24.73 Favored 'General case' 0 N--CA 1.43 -1.456 0 O-C-N 120.32 -1.488 . . . . 1.0 114.98 -179.686 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . 106.98 17.75 11.35 Favored Glycine 0 N--CA 1.431 -1.695 0 O-C-N 120.683 -1.261 . . . . 1.0 115.762 175.408 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 4.9 tt0 -162.41 152.78 16.81 Favored 'General case' 0 N--CA 1.43 -1.455 0 N-CA-C 104.946 -2.242 . . . . 1.0 104.946 179.527 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 35.1 m -53.48 108.31 0.33 Allowed 'General case' 0 N--CA 1.43 -1.463 0 C-N-CA 125.238 1.415 . . . . 1.0 114.571 175.317 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 49.0 t -89.43 110.49 21.69 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.414 0 CA-C-O 123.258 1.504 . . . . 1.0 108.244 176.892 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 61.5 m -94.19 98.98 11.33 Favored 'General case' 0 N--CA 1.43 -1.46 0 N-CA-C 113.615 0.968 . . . . 1.0 113.615 -162.525 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 88.5 m-85 -89.17 -32.91 17.24 Favored 'General case' 0 N--CA 1.429 -1.485 0 O-C-N 120.961 -1.087 . . . . 1.0 112.884 176.738 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 30.7 mmt180 . . . . . 0 C--O 1.26 1.647 0 N-CA-C 107.3 -1.37 . . . . 1.0 107.3 172.78 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 26.5 mmt . . . . . 0 CA--C 1.491 -1.289 0 N-CA-C 114.482 1.289 . . . . 1.0 114.482 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 76.8 m-20 -110.83 -72.02 0.74 Allowed 'General case' 0 N--CA 1.431 -1.405 0 O-C-N 120.548 -1.345 . . . . 1.0 110.542 -173.643 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -56.86 -45.95 82.12 Favored 'General case' 0 N--CA 1.43 -1.446 0 C-N-CA 126.723 2.009 . . . . 1.0 110.611 170.95 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 49.5 m -60.06 -40.79 90.69 Favored 'General case' 0 N--CA 1.431 -1.416 0 C-N-CA 125.285 1.434 . . . . 1.0 114.776 176.57 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 26.1 tt0 -62.8 -57.34 11.25 Favored 'General case' 0 N--CA 1.429 -1.494 0 C-N-CA 124.236 1.014 . . . . 1.0 111.933 175.265 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 2.4 m-85 -67.31 -24.79 65.79 Favored 'General case' 0 N--CA 1.429 -1.499 0 N-CA-C 115.506 1.669 . . . . 1.0 115.506 178.555 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 10.0 t60 -62.56 -43.28 99.19 Favored 'General case' 0 N--CA 1.43 -1.429 0 O-C-N 119.709 -1.869 . . . . 1.0 112.982 167.857 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -73.84 -45.47 51.02 Favored 'General case' 0 N--CA 1.43 -1.458 0 O-C-N 120.355 -1.465 . . . . 1.0 113.683 177.965 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 84.2 mt -59.76 -44.82 93.69 Favored 'General case' 0 N--CA 1.429 -1.495 0 C-N-CA 124.539 1.135 . . . . 1.0 112.782 173.441 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -58.47 -40.57 83.06 Favored 'General case' 0 N--CA 1.43 -1.47 0 O-C-N 120.538 -1.351 . . . . 1.0 113.427 173.01 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -58.51 -38.48 77.78 Favored 'General case' 0 N--CA 1.431 -1.417 0 CA-C-N 120.276 1.398 . . . . 1.0 114.138 172.358 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 57.9 mm-40 -63.06 -47.94 80.79 Favored 'General case' 0 N--CA 1.43 -1.453 0 O-C-N 119.999 -1.688 . . . . 1.0 114.98 171.719 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 77.6 mt -60.71 -50.06 75.0 Favored 'General case' 0 N--CA 1.431 -1.422 0 O-C-N 120.283 -1.51 . . . . 1.0 112.508 173.863 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 0.4 OUTLIER -46.5 -61.75 1.67 Allowed 'General case' 0 N--CA 1.43 -1.451 0 C-N-CA 127.594 2.358 . . . . 1.0 111.799 177.416 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 53.0 tp -53.62 -58.21 7.99 Favored 'General case' 0 N--CA 1.431 -1.415 0 C-N-CA 125.041 1.336 . . . . 1.0 113.304 174.519 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 28.7 m -60.93 -44.13 97.64 Favored 'General case' 0 N--CA 1.429 -1.485 0 N-CA-C 115.038 1.496 . . . . 1.0 115.038 -170.234 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 7.4 mt -83.41 -27.85 7.69 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.408 0 O-C-N 120.237 -1.539 . . . . 1.0 111.4 -178.196 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 5.4 tt0 -59.33 -50.23 74.78 Favored 'General case' 0 N--CA 1.431 -1.394 0 O-C-N 119.852 -1.78 . . . . 1.0 110.944 167.714 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 53.3 mt-10 -51.84 -52.86 46.41 Favored 'General case' 0 N--CA 1.429 -1.48 0 C-N-CA 126.234 1.814 . . . . 1.0 114.397 172.315 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -63.94 -45.28 89.9 Favored 'General case' 0 N--CA 1.43 -1.472 0 O-C-N 120.277 -1.515 . . . . 1.0 114.843 -177.933 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 96.0 mt -63.93 -49.17 73.67 Favored 'General case' 0 N--CA 1.43 -1.447 0 N-CA-C 115.486 1.661 . . . . 1.0 115.486 174.207 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 25.2 t0 -58.28 -37.58 75.3 Favored 'General case' 0 N--CA 1.429 -1.492 0 O-C-N 119.517 -1.99 . . . . 1.0 114.501 174.349 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 18.2 t70 -91.21 28.32 1.67 Allowed 'General case' 0 N--CA 1.43 -1.46 0 C-N-CA 125.643 1.577 . . . . 1.0 113.9 177.201 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 24' ' ' TRP . . . . . . . . . . . . . 14.1 t90 -65.41 -66.81 0.5 Allowed 'General case' 0 N--CA 1.43 -1.47 0 O-C-N 119.51 -1.994 . . . . 1.0 113.356 176.844 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 29.0 t0 83.2 167.71 0.11 Allowed 'General case' 0 N--CA 1.43 -1.452 0 C-N-CA 127.368 2.267 . . . . 1.0 113.841 172.912 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 116.51 -134.59 11.45 Favored Glycine 0 N--CA 1.431 -1.686 0 C-N-CA 124.803 1.192 . . . . 1.0 111.785 177.223 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -80.57 -28.54 37.16 Favored 'General case' 0 N--CA 1.429 -1.519 0 C-N-CA 126.524 1.93 . . . . 1.0 111.054 -174.921 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 81.9 p -77.42 171.51 14.77 Favored 'General case' 0 N--CA 1.432 -1.366 0 C-N-CA 127.176 2.191 . . . . 1.0 115.68 -172.387 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 17.2 t0 -132.32 157.66 43.88 Favored 'General case' 0 N--CA 1.429 -1.478 0 N-CA-C 107.051 -1.462 . . . . 1.0 107.051 166.18 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 16.6 tt -159.62 123.33 0.41 Allowed 'Isoleucine or valine' 0 N--CA 1.43 -1.461 0 CA-C-O 123.088 1.423 . . . . 1.0 107.754 -169.274 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 31.9 t0 -115.7 101.59 8.97 Favored 'General case' 0 N--CA 1.43 -1.472 0 C-N-CA 127.554 2.342 . . . . 1.0 108.212 -179.377 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 21.7 p -89.26 134.48 34.03 Favored 'General case' 0 N--CA 1.43 -1.447 0 O-C-N 120.283 -1.511 . . . . 1.0 110.345 174.841 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 19.5 mt-10 -129.03 130.11 46.19 Favored 'General case' 0 N--CA 1.431 -1.379 0 O-C-N 120.488 -1.383 . . . . 1.0 111.475 -175.996 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 3.3 tp -106.51 110.77 32.71 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.456 0 C-N-CA 127.34 2.256 . . . . 1.0 105.893 178.335 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 62.7 m-80 -115.17 -178.5 3.39 Favored 'General case' 0 N--CA 1.429 -1.503 0 C-N-CA 126.255 1.822 . . . . 1.0 107.786 175.524 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -71.98 92.79 0.56 Allowed Glycine 0 N--CA 1.431 -1.669 0 O-C-N 119.816 -1.803 . . . . 1.0 115.695 -167.031 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 85.76 11.42 74.05 Favored Glycine 0 N--CA 1.429 -1.782 0 C-N-CA 125.898 1.713 . . . . 1.0 113.264 -174.194 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 48.5 t -136.97 125.89 35.8 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.426 0 O-C-N 121.615 -0.932 . . . . 1.0 111.048 -165.429 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 13.5 mt -105.47 126.0 51.63 Favored 'General case' 0 N--CA 1.43 -1.437 0 CA-C-O 124.511 2.101 . . . . 1.0 108.933 161.587 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -126.66 120.73 30.21 Favored 'General case' 0 N--CA 1.43 -1.449 0 N-CA-C 104.412 -2.44 . . . . 1.0 104.412 -178.621 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 4.5 mp -119.09 126.29 75.23 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.484 0 N-CA-C 108.011 -1.107 . . . . 1.0 108.011 -173.676 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 44.0 p -129.88 130.45 45.22 Favored 'General case' 0 N--CA 1.428 -1.547 0 CA-C-O 121.421 0.629 . . . . 1.0 110.932 -171.83 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 43' ' ' PHE . . . . . . . . . . . . . 1.9 p90 -120.02 172.31 7.83 Favored 'General case' 0 N--CA 1.429 -1.494 0 O-C-N 120.552 -1.343 . . . . 1.0 111.343 -176.395 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -64.02 -24.43 67.71 Favored 'General case' 0 N--CA 1.43 -1.466 0 N-CA-C 116.774 2.138 . . . . 1.0 116.774 -160.062 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 31.1 m120 -66.22 -18.17 65.18 Favored 'General case' 0 N--CA 1.429 -1.489 0 N-CA-C 115.369 1.618 . . . . 1.0 115.369 173.848 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 83.57 43.69 7.23 Favored Glycine 0 N--CA 1.429 -1.774 0 N-CA-C 109.898 -1.281 . . . . 1.0 109.898 -169.929 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 57.8 m -123.94 158.71 31.38 Favored 'General case' 0 N--CA 1.43 -1.468 0 C-N-CA 126.336 1.855 . . . . 1.0 107.213 -177.382 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 22.1 ptmt -151.35 142.3 23.0 Favored 'General case' 0 N--CA 1.43 -1.442 0 N-CA-C 115.21 1.559 . . . . 1.0 115.21 -160.985 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 4.7 mm -109.18 132.71 56.53 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.433 0 N-CA-C 106.136 -1.801 . . . . 1.0 106.136 166.651 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 2.7 tp -125.0 119.75 56.69 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.505 0 CA-C-O 123.116 1.436 . . . . 1.0 109.19 174.243 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 3.0 mt -124.69 96.02 3.58 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.386 0 C-N-CA 126.229 1.812 . . . . 1.0 110.769 -179.035 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 27.2 m120 -94.68 150.77 19.88 Favored 'General case' 0 N--CA 1.43 -1.473 0 CA-C-O 123.864 1.792 . . . . 1.0 108.469 166.97 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 5.8 tmm_? -153.51 141.6 20.38 Favored 'General case' 0 N--CA 1.429 -1.495 0 CA-C-O 123.237 1.494 . . . . 1.0 110.933 -163.977 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -111.57 132.02 54.84 Favored 'General case' 0 N--CA 1.428 -1.541 0 C-N-CA 127.484 2.314 . . . . 1.0 107.352 178.047 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 56.0 mt-10 -67.33 -48.88 45.5 Favored Pre-proline 0 N--CA 1.43 -1.44 0 CA-C-O 115.687 -2.101 . . . . 1.0 115.295 165.573 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 92.4 Cg_endo -77.29 -172.31 1.41 Allowed 'Trans proline' 0 N--CA 1.434 -2.004 0 CA-C-N 126.449 3.339 . . . . 1.0 112.586 172.401 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 22.3 mt 77.7 -44.54 0.42 Allowed 'General case' 0 N--CA 1.43 -1.45 0 C-N-CA 127.419 2.288 . . . . 1.0 114.609 173.989 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 3.8 m170 91.15 47.0 0.01 OUTLIER 'General case' 0 N--CA 1.43 -1.458 0 C-N-CA 128.865 2.866 . . . . 1.0 112.673 169.035 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -150.49 161.86 41.72 Favored 'General case' 0 N--CA 1.43 -1.454 0 O-C-N 120.403 -1.435 . . . . 1.0 107.169 174.984 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 91.3 t -123.14 154.5 28.77 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.403 0 N-CA-C 108.126 -1.064 . . . . 1.0 108.126 173.166 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 61' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -90.1 153.67 20.36 Favored 'General case' 0 N--CA 1.43 -1.451 0 CA-C-N 120.91 1.687 . . . . 1.0 110.376 176.665 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 2.1 tm? -147.61 103.93 3.57 Favored 'General case' 0 N--CA 1.429 -1.477 0 O-C-N 119.144 -2.222 . . . . 1.0 111.035 178.761 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -123.97 136.07 54.06 Favored 'General case' 0 N--CA 1.43 -1.433 0 O-C-N 120.818 -1.176 . . . . 1.0 113.742 172.915 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 64' ' ' THR . . . . . . . . . . . . 0.258 0.1 OUTLIER -134.66 -80.84 0.44 Allowed 'General case' 0 N--CA 1.429 -1.475 0 N-CA-C 107.415 -1.328 . . . . 1.0 107.415 171.456 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 6.1 tmtm? -82.31 -83.69 0.12 Allowed 'General case' 0 N--CA 1.43 -1.442 0 O-C-N 120.242 -1.536 . . . . 1.0 113.161 -175.84 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 20.9 tt0 -128.51 -26.38 2.77 Favored 'General case' 0 N--CA 1.43 -1.464 0 O-C-N 120.218 -1.551 . . . . 1.0 111.733 -175.357 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . -92.19 71.25 1.67 Allowed Glycine 0 N--CA 1.431 -1.689 0 O-C-N 120.692 -1.255 . . . . 1.0 110.839 -179.466 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . -77.97 94.78 1.23 Allowed Glycine 0 N--CA 1.43 -1.759 0 C-N-CA 123.382 0.515 . . . . 1.0 112.522 168.831 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 15.5 m-85 -126.45 151.53 47.62 Favored 'General case' 0 N--CA 1.43 -1.447 0 N-CA-C 107.699 -1.223 . . . . 1.0 107.699 -171.625 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 12.8 p80 -92.71 158.17 16.06 Favored 'General case' 0 N--CA 1.431 -1.392 0 O-C-N 120.187 -1.571 . . . . 1.0 111.063 169.411 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 47.1 p90 -130.01 143.32 50.73 Favored 'General case' 0 N--CA 1.431 -1.423 0 N-CA-C 114.379 1.252 . . . . 1.0 114.379 -162.503 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 30.8 m-20 -125.02 154.35 41.41 Favored 'General case' 0 N--CA 1.43 -1.464 0 C-N-CA 125.74 1.616 . . . . 1.0 110.496 -177.729 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 64.2 tp -87.07 137.48 32.31 Favored 'General case' 0 N--CA 1.43 -1.433 0 C-N-CA 125.625 1.57 . . . . 1.0 111.555 -178.397 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 2.5 mmmp? -101.46 -76.15 0.57 Allowed 'General case' 0 N--CA 1.43 -1.471 0 O-C-N 120.694 -1.254 . . . . 1.0 109.279 165.076 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -146.12 -76.35 0.02 OUTLIER Glycine 0 N--CA 1.43 -1.741 0 O-C-N 121.133 -0.98 . . . . 1.0 112.062 -178.674 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 37.8 m-20 -113.99 39.7 2.65 Favored 'General case' 0 N--CA 1.429 -1.502 0 C-N-CA 124.695 1.198 . . . . 1.0 109.382 170.637 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 15.0 tp10 -168.63 138.0 2.3 Favored 'General case' 0 N--CA 1.43 -1.453 0 N-CA-C 103.624 -2.732 . . . . 1.0 103.624 -178.81 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 78' ' ' TRP . . . . . . . . . . . . . 45.1 m95 -101.65 141.55 34.34 Favored 'General case' 0 N--CA 1.429 -1.477 0 N-CA-C 104.984 -2.228 . . . . 1.0 104.984 165.51 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 9.9 pt -105.11 160.6 5.21 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.432 0 O-C-N 120.527 -1.358 . . . . 1.0 107.93 176.744 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 39.0 m -82.74 133.54 35.15 Favored 'General case' 0 N--CA 1.43 -1.431 0 O-C-N 121.041 -1.037 . . . . 1.0 108.674 167.765 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 29.0 t70 -65.25 -43.29 91.84 Favored 'General case' 0 N--CA 1.43 -1.469 0 CA-C-N 120.577 1.535 . . . . 1.0 112.774 -178.092 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 29.2 tpt85 -66.63 101.79 0.83 Allowed 'General case' 0 N--CA 1.43 -1.428 0 C-N-CA 126.822 2.049 . . . . 1.0 111.38 -179.054 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 83' ' ' SER . . . . . . . . . . . . 0.279 15.4 m 80.52 -43.49 0.23 Allowed 'General case' 0 N--CA 1.43 -1.433 0 C-N-CA 128.619 2.767 . . . . 1.0 114.931 -171.87 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 110.86 81.78 1.23 Allowed Glycine 0 N--CA 1.43 -1.751 0 N-CA-C 109.71 -1.356 . . . . 1.0 109.71 -176.181 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . 0.264 16.0 mt-10 -124.72 -140.5 0.29 Allowed 'General case' 0 N--CA 1.43 -1.455 0 CA-C-N 118.19 0.995 . . . . 1.0 109.535 -172.0 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 62.9 m -146.04 129.2 16.63 Favored 'General case' 0 N--CA 1.43 -1.461 0 O-C-N 119.592 -1.942 . . . . 1.0 110.004 -169.388 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 15.0 t80 -58.86 -81.87 0.02 OUTLIER 'General case' 0 N--CA 1.429 -1.481 0 N-CA-C 117.11 2.263 . . . . 1.0 117.11 -171.277 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 88' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -66.94 -34.38 77.65 Favored 'General case' 0 N--CA 1.429 -1.487 0 O-C-N 120.608 -1.307 . . . . 1.0 112.958 -170.697 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 35.5 t70 -59.93 -47.51 85.47 Favored 'General case' 0 N--CA 1.43 -1.458 0 C-N-CA 126.233 1.813 . . . . 1.0 114.62 173.074 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 49.3 tp -69.81 -41.42 75.05 Favored 'General case' 0 N--CA 1.429 -1.524 0 O-C-N 119.541 -1.974 . . . . 1.0 111.981 178.521 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 45.3 tp -50.58 -44.27 56.78 Favored 'General case' 0 N--CA 1.429 -1.519 0 C-N-CA 126.584 1.954 . . . . 1.0 113.763 167.698 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 2.7 tm-20 -59.55 -50.36 74.21 Favored 'General case' 0 N--CA 1.429 -1.504 0 C-N-CA 125.329 1.452 . . . . 1.0 113.122 172.324 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 37.5 mt-30 -53.33 -45.55 69.1 Favored 'General case' 0 N--CA 1.43 -1.446 0 CA-C-N 120.188 1.358 . . . . 1.0 114.373 173.693 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -62.71 -44.47 96.14 Favored 'General case' 0 N--CA 1.43 -1.461 0 O-C-N 120.219 -1.551 . . . . 1.0 115.133 175.024 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -71.21 -45.23 63.77 Favored 'General case' 0 N--CA 1.43 -1.426 0 O-C-N 119.692 -1.88 . . . . 1.0 113.808 178.233 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 63.0 m -57.46 -30.83 65.36 Favored 'General case' 0 N--CA 1.431 -1.409 0 C-N-CA 127.764 2.425 . . . . 1.0 112.521 174.631 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -63.54 -72.36 0.14 Allowed 'General case' 0 N--CA 1.429 -1.507 0 C-N-CA 125.004 1.321 . . . . 1.0 112.098 168.711 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 3.2 pt20 -70.5 -12.17 61.4 Favored 'General case' 0 N--CA 1.43 -1.425 0 N-CA-C 116.756 2.132 . . . . 1.0 116.756 -169.76 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -90.51 -48.2 7.24 Favored 'General case' 0 N--CA 1.43 -1.446 0 C-N-CA 124.854 1.261 . . . . 1.0 112.139 164.643 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . 110.62 4.33 28.38 Favored Glycine 0 N--CA 1.43 -1.702 0 O-C-N 121.037 -1.039 . . . . 1.0 114.379 -178.614 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 11.2 pt-20 -162.91 165.87 24.61 Favored 'General case' 0 N--CA 1.429 -1.511 0 N-CA-C 106.754 -1.573 . . . . 1.0 106.754 -177.087 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 96.4 m -70.83 121.66 18.45 Favored 'General case' 0 N--CA 1.431 -1.424 0 CA-C-N 120.313 1.415 . . . . 1.0 113.424 -173.342 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 76.6 t -98.62 121.36 49.1 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.493 0 C-N-CA 127.272 2.229 . . . . 1.0 109.421 -179.625 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 29.6 m -67.27 124.07 22.09 Favored 'General case' 0 N--CA 1.43 -1.457 0 C-N-CA 128.845 2.858 . . . . 1.0 115.557 -172.721 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 1.6 p90 -140.85 -56.12 0.5 Allowed 'General case' 0 N--CA 1.429 -1.482 0 O-C-N 120.196 -1.565 . . . . 1.0 112.174 -156.032 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 17.6 ttt180 . . . . . 0 C--O 1.262 1.723 0 C-N-CA 125.346 1.459 . . . . 1.0 111.13 -171.938 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 77.4 mtm . . . . . 0 CA--C 1.491 -1.308 0 N-CA-C 113.099 0.777 . . . . 1.0 113.099 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 2.2 m120 -35.88 -70.29 0.09 Allowed 'General case' 0 N--CA 1.431 -1.406 0 N-CA-C 118.876 2.917 . . . . 1.0 118.876 -160.679 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 11.0 p-10 -71.51 -25.34 62.21 Favored 'General case' 0 N--CA 1.43 -1.436 0 O-C-N 120.181 -1.574 . . . . 1.0 114.129 -175.989 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 28.2 m -71.3 -53.65 13.54 Favored 'General case' 0 N--CA 1.43 -1.451 0 C-N-CA 124.877 1.271 . . . . 1.0 110.338 175.943 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 44.6 mm-40 -57.55 -51.17 70.59 Favored 'General case' 0 N--CA 1.429 -1.483 0 C-N-CA 126.622 1.969 . . . . 1.0 113.509 175.778 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 5.1 t80 -56.42 -39.73 73.54 Favored 'General case' 0 CA--C 1.489 -1.4 0 N-CA-C 114.833 1.42 . . . . 1.0 114.833 172.768 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . 0.31 0.2 OUTLIER -67.61 -40.42 84.69 Favored 'General case' 0 N--CA 1.43 -1.429 0 O-C-N 119.543 -1.973 . . . . 1.0 115.009 173.015 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 81.5 mtt180 -56.4 -53.96 51.26 Favored 'General case' 0 N--CA 1.429 -1.476 0 C-N-CA 125.28 1.432 . . . . 1.0 113.832 177.957 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . 0.454 HD12 ' N ' ' A' ' 10' ' ' ALA . 3.4 pp -62.0 -42.28 98.98 Favored 'General case' 0 N--CA 1.429 -1.504 0 C-N-CA 124.042 0.937 . . . . 1.0 112.865 176.936 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . 0.454 ' N ' HD12 ' A' ' 9' ' ' LEU . . . -56.92 -47.06 81.48 Favored 'General case' 0 N--CA 1.431 -1.419 0 C-N-CA 124.927 1.291 . . . . 1.0 113.996 172.598 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 58.7 m-20 -58.85 -41.7 87.6 Favored 'General case' 0 N--CA 1.43 -1.447 0 C-N-CA 125.484 1.514 . . . . 1.0 113.07 176.265 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . 0.26 15.6 pt20 -70.83 -39.24 73.12 Favored 'General case' 0 N--CA 1.431 -1.42 0 O-C-N 119.696 -1.877 . . . . 1.0 115.859 175.405 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 4.2 pp -73.01 -34.58 66.46 Favored 'General case' 0 N--CA 1.431 -1.376 0 O-C-N 119.183 -2.198 . . . . 1.0 114.028 175.128 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -51.73 -52.05 51.48 Favored 'General case' 0 N--CA 1.43 -1.47 0 C-N-CA 126.257 1.823 . . . . 1.0 112.438 166.434 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 50.8 tp -58.69 -45.83 88.6 Favored 'General case' 0 N--CA 1.429 -1.5 0 C-N-CA 124.643 1.177 . . . . 1.0 113.65 175.088 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 75.3 m -57.0 -59.81 4.51 Favored 'General case' 0 N--CA 1.43 -1.435 0 C-N-CA 125.699 1.6 . . . . 1.0 113.063 175.858 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 84.4 mt -50.15 -45.43 23.7 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.449 0 C-N-CA 126.515 1.926 . . . . 1.0 114.765 172.218 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 10.7 mt-10 -55.57 -63.83 1.04 Allowed 'General case' 0 N--CA 1.43 -1.459 0 O-C-N 119.901 -1.749 . . . . 1.0 113.15 173.65 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 95.2 mt-10 -62.53 -46.55 87.9 Favored 'General case' 0 N--CA 1.43 -1.449 0 C-N-CA 124.998 1.319 . . . . 1.0 113.736 -175.448 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 3.3 tpt180 -73.9 -24.03 59.65 Favored 'General case' 0 N--CA 1.43 -1.447 0 N-CA-C 114.372 1.249 . . . . 1.0 114.372 -174.553 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -88.01 -48.25 7.9 Favored 'General case' 0 N--CA 1.43 -1.43 0 O-C-N 120.742 -1.224 . . . . 1.0 112.088 172.895 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 26.2 t70 -60.33 -50.31 74.14 Favored 'General case' 0 N--CA 1.431 -1.408 0 O-C-N 120.25 -1.531 . . . . 1.0 114.531 -179.244 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 15.5 t70 -93.68 106.99 18.92 Favored 'General case' 0 N--CA 1.429 -1.499 0 O-C-N 119.88 -1.762 . . . . 1.0 109.441 171.047 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 24' ' ' TRP . . . . . . . . . . . . . 14.4 t90 -146.47 175.48 10.53 Favored 'General case' 0 N--CA 1.43 -1.471 0 C-N-CA 126.019 1.728 . . . . 1.0 108.335 -179.165 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 61.0 m-20 -100.48 112.15 24.49 Favored 'General case' 0 N--CA 1.432 -1.351 0 O-C-N 120.356 -1.465 . . . . 1.0 108.502 173.335 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -173.71 167.81 40.49 Favored Glycine 0 N--CA 1.429 -1.797 0 C-N-CA 119.136 -1.506 . . . . 1.0 112.892 176.85 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 31.2 m-20 -88.92 -34.21 17.01 Favored 'General case' 0 N--CA 1.43 -1.475 0 C-N-CA 126.837 2.055 . . . . 1.0 110.607 177.593 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 58.5 p -75.79 147.43 39.22 Favored 'General case' 0 CA--C 1.488 -1.42 0 C-N-CA 124.776 1.23 . . . . 1.0 113.302 -178.717 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 3.3 t0 -90.5 170.58 10.08 Favored 'General case' 0 N--CA 1.431 -1.416 0 O-C-N 120.453 -1.404 . . . . 1.0 111.127 -175.555 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 6.9 mm -152.5 122.59 0.87 Allowed 'Isoleucine or valine' 0 N--CA 1.429 -1.485 0 C-N-CA 128.473 2.709 . . . . 1.0 105.623 -171.288 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 60.6 m-20 -111.39 101.72 10.16 Favored 'General case' 0 N--CA 1.429 -1.513 0 C-N-CA 124.146 0.978 . . . . 1.0 108.803 158.419 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 14.3 p -85.08 124.83 32.22 Favored 'General case' 0 N--CA 1.43 -1.463 0 O-C-N 120.57 -1.331 . . . . 1.0 111.666 173.213 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 36.0 mm-40 -99.4 139.4 35.11 Favored 'General case' 0 N--CA 1.43 -1.429 0 O-C-N 119.781 -1.824 . . . . 1.0 109.534 -174.688 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 4.0 mp -127.2 112.53 28.85 Favored 'Isoleucine or valine' 0 N--CA 1.432 -1.366 0 N-CA-C 105.7 -1.963 . . . . 1.0 105.7 174.437 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 48.5 m-80 -123.8 175.26 6.99 Favored 'General case' 0 N--CA 1.43 -1.455 0 C-N-CA 126.918 2.087 . . . . 1.0 108.244 173.104 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -68.07 86.87 0.18 Allowed Glycine 0 N--CA 1.429 -1.781 0 N-CA-C 116.455 1.342 . . . . 1.0 116.455 -170.615 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 85.86 16.6 63.1 Favored Glycine 0 N--CA 1.43 -1.758 0 C-N-CA 125.29 1.424 . . . . 1.0 112.584 -174.152 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 94.7 t -136.54 122.98 30.13 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.395 0 C-N-CA 124.549 1.139 . . . . 1.0 109.162 -169.828 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 98.9 mt -112.91 140.72 47.47 Favored 'General case' 0 N--CA 1.431 -1.386 0 O-C-N 120.411 -1.431 . . . . 1.0 109.064 168.822 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -134.45 121.06 20.54 Favored 'General case' 0 N--CA 1.43 -1.442 0 O-C-N 120.361 -1.462 . . . . 1.0 108.204 179.229 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 96.4 mt -97.02 115.26 36.14 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.483 0 N-CA-C 106.784 -1.561 . . . . 1.0 106.784 -177.882 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 2.9 m -124.77 122.71 38.2 Favored 'General case' 0 N--CA 1.43 -1.472 0 N-CA-C 108.698 -0.853 . . . . 1.0 108.698 -177.354 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 43' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -115.07 173.28 6.57 Favored 'General case' 0 N--CA 1.429 -1.522 0 C-N-CA 124.339 1.055 . . . . 1.0 110.611 179.882 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -68.89 -23.27 64.18 Favored 'General case' 0 N--CA 1.43 -1.471 0 N-CA-C 116.474 2.027 . . . . 1.0 116.474 -161.017 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 8.4 t-20 -66.85 -18.56 65.44 Favored 'General case' 0 N--CA 1.429 -1.484 0 C-N-CA 124.81 1.244 . . . . 1.0 112.925 169.07 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 99.71 5.06 55.59 Favored Glycine 0 N--CA 1.429 -1.768 0 O-C-N 120.603 -1.311 . . . . 1.0 113.49 172.776 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 1.3 t -89.9 171.83 9.31 Favored 'General case' 0 N--CA 1.431 -1.379 0 CA-C-N 118.277 1.038 . . . . 1.0 112.795 -177.293 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 73.7 tttt -138.17 129.38 27.41 Favored 'General case' 0 N--CA 1.43 -1.468 0 N-CA-C 113.816 1.043 . . . . 1.0 113.816 -157.301 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 1.4 mm -112.32 127.14 69.7 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.39 0 N-CA-C 105.242 -2.133 . . . . 1.0 105.242 161.528 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 50' ' ' ILE . . . . . 0.511 HG23 ' HB3' ' A' ' 63' ' ' ALA . 3.0 tp -123.07 117.89 53.08 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.464 0 CA-C-O 123.67 1.7 . . . . 1.0 109.311 -178.803 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 6.6 mt -121.13 131.64 72.52 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.472 0 C-N-CA 125.703 1.601 . . . . 1.0 109.976 -170.127 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 52' ' ' ASN . . . . . 0.495 ' H ' ' HD1' ' A' ' 61' ' ' TRP . 6.8 t-20 -162.91 163.8 26.17 Favored 'General case' 0 N--CA 1.43 -1.439 0 CA-C-O 124.049 1.881 . . . . 1.0 107.108 -170.993 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 2.6 ttp180 -156.81 117.37 3.62 Favored 'General case' 0 N--CA 1.43 -1.456 0 CA-C-N 114.204 -1.362 . . . . 1.0 109.337 -156.098 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 32.2 mm-40 -104.55 122.29 45.27 Favored 'General case' 0 N--CA 1.43 -1.473 0 C-N-CA 126.562 1.945 . . . . 1.0 106.876 -179.342 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 23.5 mt-10 -55.72 -39.77 79.79 Favored Pre-proline 0 N--CA 1.43 -1.473 0 N-CA-C 119.332 3.086 . . . . 1.0 119.332 -175.505 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 50.1 Cg_exo -67.44 114.01 3.11 Favored 'Trans proline' 0 N--CA 1.434 -1.997 0 CA-C-N 126.107 3.217 . . . . 1.0 113.051 172.752 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . 0.389 5.3 mp 76.89 132.84 0.05 Allowed 'General case' 0 N--CA 1.429 -1.499 0 C-N-CA 126.83 2.052 . . . . 1.0 114.376 -166.872 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 35.4 m170 -73.78 43.65 0.16 Allowed 'General case' 0 N--CA 1.43 -1.451 0 C-N-CA 127.191 2.196 . . . . 1.0 114.48 -175.29 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 85.5 mt-30 -116.98 134.57 54.58 Favored 'General case' 0 N--CA 1.43 -1.474 0 O-C-N 119.877 -1.765 . . . . 1.0 110.321 -172.618 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 59.3 t -105.83 156.26 6.67 Favored 'Isoleucine or valine' 0 N--CA 1.427 -1.591 0 N-CA-C 106.173 -1.788 . . . . 1.0 106.173 177.91 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 61' ' ' TRP . . . . . 0.495 ' HD1' ' H ' ' A' ' 52' ' ' ASN . 0.0 OUTLIER -104.29 144.55 31.47 Favored 'General case' 0 N--CA 1.431 -1.394 0 O-C-N 119.788 -1.82 . . . . 1.0 111.447 170.82 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 13.1 mt -112.86 95.34 5.36 Favored 'General case' 0 N--CA 1.431 -1.392 0 N-CA-C 104.578 -2.379 . . . . 1.0 104.578 163.873 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . 0.511 ' HB3' HG23 ' A' ' 50' ' ' ILE . . . -90.79 125.91 35.86 Favored 'General case' 0 N--CA 1.43 -1.444 0 CA-C-O 123.174 1.464 . . . . 1.0 109.224 169.655 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 64' ' ' THR . . . . . . . . . . . . . 9.4 t -152.55 -169.44 3.34 Favored 'General case' 0 N--CA 1.43 -1.453 0 N-CA-C 107.414 -1.328 . . . . 1.0 107.414 -154.9 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 2.3 tptm -56.25 -44.44 79.67 Favored 'General case' 0 N--CA 1.43 -1.466 0 N-CA-C 115.778 1.77 . . . . 1.0 115.778 -178.326 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 82.1 mt-30 -71.66 -24.14 61.79 Favored 'General case' 0 N--CA 1.431 -1.418 0 N-CA-C 115.229 1.566 . . . . 1.0 115.229 -177.313 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 147.25 -46.78 0.71 Allowed Glycine 0 N--CA 1.43 -1.708 0 O-C-N 120.595 -1.315 . . . . 1.0 113.299 175.213 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 125.88 116.77 2.11 Favored Glycine 0 N--CA 1.431 -1.686 0 N-CA-C 117.816 1.886 . . . . 1.0 117.816 178.755 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 20.1 m-30 -123.59 131.99 53.76 Favored 'General case' 0 N--CA 1.431 -1.398 0 C-N-CA 124.791 1.237 . . . . 1.0 109.219 -178.912 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 70' ' ' HIS . . . . . 0.445 ' HE1' ' OD2' ' A' ' 81' ' ' ASP . 17.6 p80 -88.7 158.18 18.29 Favored 'General case' 0 N--CA 1.429 -1.487 0 O-C-N 120.372 -1.455 . . . . 1.0 114.024 173.502 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 48.0 p90 -148.19 148.8 30.94 Favored 'General case' 0 N--CA 1.431 -1.406 0 N-CA-C 115.469 1.655 . . . . 1.0 115.469 -161.369 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 6.2 m-20 -116.46 175.23 5.66 Favored 'General case' 0 N--CA 1.431 -1.414 0 C-N-CA 127.349 2.26 . . . . 1.0 111.808 -172.648 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 50.2 tp -111.3 116.74 31.51 Favored 'General case' 0 N--CA 1.431 -1.416 0 C-N-CA 125.723 1.609 . . . . 1.0 112.039 -178.998 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -72.91 -42.35 63.62 Favored 'General case' 0 N--CA 1.429 -1.495 0 O-C-N 121.14 -0.975 . . . . 1.0 112.476 163.375 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . 166.63 -66.64 0.2 Allowed Glycine 0 N--CA 1.431 -1.694 0 O-C-N 121.035 -1.04 . . . . 1.0 111.815 178.003 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 18.0 p-10 -110.45 6.07 21.86 Favored 'General case' 0 N--CA 1.43 -1.458 0 C-N-CA 124.888 1.275 . . . . 1.0 111.716 -179.108 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 20.2 tt0 -151.72 132.58 14.15 Favored 'General case' 0 N--CA 1.43 -1.44 0 N-CA-C 103.921 -2.622 . . . . 1.0 103.921 -177.574 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 78' ' ' TRP . . . . . 0.445 ' HZ2' HD13 ' A' ' 9' ' ' LEU . 71.3 m95 -89.12 135.54 33.51 Favored 'General case' 0 N--CA 1.43 -1.441 0 N-CA-C 105.667 -1.975 . . . . 1.0 105.667 173.495 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -133.96 136.92 53.13 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.452 0 N-CA-C 104.992 -2.225 . . . . 1.0 104.992 -161.737 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 60.5 m -78.69 137.42 37.79 Favored 'General case' 0 N--CA 1.431 -1.384 0 O-C-N 120.089 -1.632 . . . . 1.0 111.957 -173.194 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 81' ' ' ASP . . . . . 0.445 ' OD2' ' HE1' ' A' ' 70' ' ' HIS . 23.8 t0 -72.78 -56.82 4.68 Favored 'General case' 0 N--CA 1.43 -1.428 0 CA-C-O 123.12 1.438 . . . . 1.0 109.548 177.311 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 1.9 tpt85 -72.73 128.59 36.0 Favored 'General case' 0 N--CA 1.43 -1.449 0 C-N-CA 125.535 1.534 . . . . 1.0 110.076 178.59 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 11.0 t 77.86 -63.2 0.34 Allowed 'General case' 0 N--CA 1.43 -1.471 0 C-N-CA 127.33 2.252 . . . . 1.0 112.916 -170.773 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 110.67 71.68 0.66 Allowed Glycine 0 N--CA 1.429 -1.779 0 C-N-CA 124.62 1.105 . . . . 1.0 110.813 -176.774 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 59.6 mt-10 -136.05 -146.36 0.24 Allowed 'General case' 0 N--CA 1.43 -1.441 0 C-N-CA 125.023 1.329 . . . . 1.0 109.444 -170.246 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 88.7 m -143.32 134.8 26.22 Favored 'General case' 0 N--CA 1.43 -1.464 0 O-C-N 120.427 -1.42 . . . . 1.0 109.998 -156.789 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 31.1 t80 -61.03 -76.85 0.05 OUTLIER 'General case' 0 N--CA 1.43 -1.444 0 N-CA-C 117.353 2.353 . . . . 1.0 117.353 -177.535 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 88' ' ' TRP . . . . . . . . . . . . . 55.0 m95 -60.77 -31.88 71.21 Favored 'General case' 0 N--CA 1.431 -1.425 0 O-C-N 120.032 -1.668 . . . . 1.0 114.727 -169.674 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 6.1 t70 -78.14 -36.2 48.04 Favored 'General case' 0 N--CA 1.43 -1.441 0 C-N-CA 125.83 1.652 . . . . 1.0 113.16 177.721 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 50.5 tp -70.63 -41.39 72.26 Favored 'General case' 0 N--CA 1.431 -1.409 0 O-C-N 118.679 -2.513 . . . . 1.0 110.989 175.591 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 31.6 tp -55.46 -37.8 68.23 Favored 'General case' 0 N--CA 1.431 -1.383 0 C-N-CA 126.554 1.942 . . . . 1.0 114.074 169.614 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 35.0 tt0 -60.66 -54.23 47.84 Favored 'General case' 0 N--CA 1.43 -1.434 0 C-N-CA 125.454 1.502 . . . . 1.0 113.028 169.804 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 10.9 tm0? -51.71 -53.81 35.22 Favored 'General case' 0 N--CA 1.43 -1.438 0 C-N-CA 125.995 1.718 . . . . 1.0 114.268 175.133 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -52.21 -55.56 20.36 Favored 'General case' 0 N--CA 1.431 -1.408 0 C-N-CA 127.721 2.408 . . . . 1.0 113.954 176.053 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -61.58 -44.9 96.16 Favored 'General case' 0 N--CA 1.429 -1.49 0 N-CA-C 114.528 1.307 . . . . 1.0 114.528 177.066 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 93.4 m -64.71 -21.21 66.69 Favored 'General case' 0 N--CA 1.429 -1.478 0 O-C-N 119.634 -1.916 . . . . 1.0 113.779 175.324 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 7.5 tp60 -74.45 -65.13 0.89 Allowed 'General case' 0 N--CA 1.429 -1.496 0 O-C-N 120.345 -1.472 . . . . 1.0 110.927 171.749 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 13.3 pt20 -77.38 -28.37 52.81 Favored 'General case' 0 N--CA 1.429 -1.486 0 N-CA-C 115.478 1.658 . . . . 1.0 115.478 -170.963 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -85.6 -46.2 11.02 Favored 'General case' 0 N--CA 1.43 -1.447 0 O-C-N 120.667 -1.271 . . . . 1.0 112.866 171.602 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . 95.61 32.46 6.91 Favored Glycine 0 N--CA 1.43 -1.742 0 O-C-N 120.878 -1.139 . . . . 1.0 114.655 -178.848 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 14.1 pt-20 -158.37 163.1 37.6 Favored 'General case' 0 N--CA 1.43 -1.433 0 O-C-N 120.955 -1.321 . . . . 1.0 108.987 179.57 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 92.6 m -77.9 85.38 4.16 Favored 'General case' 0 N--CA 1.429 -1.502 0 O-C-N 119.862 -1.774 . . . . 1.0 112.58 -178.937 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 47.8 t -85.12 100.38 8.27 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.42 0 C-N-CA 126.914 2.085 . . . . 1.0 106.617 168.378 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 34.9 t -143.09 154.72 44.23 Favored 'General case' 0 N--CA 1.431 -1.415 0 C-N-CA 125.261 1.424 . . . . 1.0 107.93 -174.78 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -110.98 -16.77 13.44 Favored 'General case' 0 N--CA 1.43 -1.456 0 O-C-N 120.437 -1.415 . . . . 1.0 112.217 176.262 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 16.1 mtp180 . . . . . 0 C--O 1.259 1.574 0 N-CA-C 115.519 1.674 . . . . 1.0 115.519 -167.16 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 91.7 mtp . . . . . 0 CA--C 1.49 -1.35 0 CA-C-O 121.391 0.615 . . . . 1.0 110.725 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 18.8 m120 66.53 -84.62 0.03 OUTLIER 'General case' 0 N--CA 1.43 -1.46 0 C-N-CA 126.7 2.0 . . . . 1.0 114.02 -178.278 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -57.3 -47.61 81.04 Favored 'General case' 0 CA--C 1.49 -1.361 0 C-N-CA 127.493 2.317 . . . . 1.0 113.197 -173.235 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 10.5 m -60.07 -42.5 94.67 Favored 'General case' 0 N--CA 1.43 -1.43 0 C-N-CA 125.743 1.617 . . . . 1.0 113.567 177.106 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 9.0 tp10 -70.6 -46.47 63.35 Favored 'General case' 0 N--CA 1.43 -1.426 0 C-N-CA 125.083 1.353 . . . . 1.0 111.729 -178.732 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 4.4 t80 -50.36 -54.69 19.83 Favored 'General case' 0 N--CA 1.429 -1.5 0 C-N-CA 125.802 1.641 . . . . 1.0 114.63 166.572 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 30.4 m170 -59.47 -45.16 92.42 Favored 'General case' 0 N--CA 1.43 -1.454 0 N-CA-C 115.475 1.657 . . . . 1.0 115.475 178.434 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 73.4 mtp85 -56.52 -56.27 23.34 Favored 'General case' 0 N--CA 1.43 -1.433 0 N-CA-C 113.338 0.866 . . . . 1.0 113.338 173.282 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 82.7 mt -66.23 -40.59 90.37 Favored 'General case' 0 N--CA 1.43 -1.441 0 N-CA-C 114.676 1.361 . . . . 1.0 114.676 -179.161 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -62.79 -48.5 78.87 Favored 'General case' 0 N--CA 1.43 -1.468 0 C-N-CA 124.905 1.282 . . . . 1.0 113.383 178.509 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 58.7 m-20 -66.22 -36.33 82.77 Favored 'General case' 0 N--CA 1.429 -1.485 0 O-C-N 120.829 -1.17 . . . . 1.0 113.071 175.812 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 29.1 mm100 -61.65 -46.73 88.52 Favored 'General case' 0 N--CA 1.43 -1.461 0 O-C-N 120.116 -1.615 . . . . 1.0 114.845 170.398 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 1.2 pp -70.05 -37.18 75.48 Favored 'General case' 0 N--CA 1.43 -1.451 0 O-C-N 119.942 -1.724 . . . . 1.0 114.503 -179.688 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 0.1 OUTLIER -43.82 -62.09 1.22 Allowed 'General case' 0 N--CA 1.43 -1.459 0 C-N-CA 127.786 2.434 . . . . 1.0 112.411 163.348 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 44.7 tp -60.06 -47.85 84.15 Favored 'General case' 0 N--CA 1.43 -1.44 0 C-N-CA 124.738 1.215 . . . . 1.0 113.499 177.88 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 32.6 m -57.33 -50.83 71.71 Favored 'General case' 0 N--CA 1.43 -1.474 0 C-N-CA 125.743 1.617 . . . . 1.0 113.686 179.482 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 95.9 mt -65.32 -45.45 93.37 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.465 0 O-C-N 120.353 -1.467 . . . . 1.0 111.554 179.718 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -57.65 -55.05 39.89 Favored 'General case' 0 N--CA 1.428 -1.532 0 O-C-N 121.774 -0.579 . . . . 1.0 112.542 176.26 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 5.5 tm-20 -58.21 -49.7 76.14 Favored 'General case' 0 N--CA 1.43 -1.467 0 C-N-CA 126.103 1.761 . . . . 1.0 114.591 178.008 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.28 -38.54 77.19 Favored 'General case' 0 N--CA 1.43 -1.471 0 C-N-CA 124.72 1.208 . . . . 1.0 113.912 -179.388 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . 0.44 HD23 HG21 ' A' ' 41' ' ' ILE . 2.7 tp -86.08 -38.32 17.92 Favored 'General case' 0 N--CA 1.429 -1.495 0 N-CA-C 113.877 1.065 . . . . 1.0 113.877 177.914 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 37.3 t70 -61.23 -26.41 67.72 Favored 'General case' 0 N--CA 1.43 -1.469 0 O-C-N 119.281 -2.137 . . . . 1.0 113.969 173.709 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 29.8 t70 -59.85 -35.51 74.93 Favored 'General case' 0 N--CA 1.429 -1.478 0 C-N-CA 126.247 1.819 . . . . 1.0 114.506 171.02 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 24' ' ' TRP . . . . . . . . . . . . . 48.7 t90 -83.93 138.78 32.98 Favored 'General case' 0 N--CA 1.43 -1.46 0 CA-C-O 122.062 0.934 . . . . 1.0 113.124 -167.349 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 24.0 t70 -133.64 131.46 39.59 Favored 'General case' 0 N--CA 1.431 -1.393 0 O-C-N 121.236 -0.915 . . . . 1.0 109.298 -179.661 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -125.88 -141.35 5.52 Favored Glycine 0 N--CA 1.43 -1.74 0 N-CA-C 109.843 -1.303 . . . . 1.0 109.843 177.272 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -89.07 -26.83 21.18 Favored 'General case' 0 N--CA 1.43 -1.438 0 O-C-N 120.825 -1.397 . . . . 1.0 109.134 165.632 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 88.1 p -82.12 163.98 21.63 Favored 'General case' 0 N--CA 1.431 -1.4 0 O-C-N 120.375 -1.453 . . . . 1.0 111.935 165.448 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 9.4 t70 -117.48 175.48 5.61 Favored 'General case' 0 N--CA 1.43 -1.448 0 N-CA-C 107.442 -1.318 . . . . 1.0 107.442 177.653 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 9.1 tp -159.08 114.24 0.15 Allowed 'Isoleucine or valine' 0 N--CA 1.429 -1.499 0 CA-C-O 123.81 1.767 . . . . 1.0 109.502 -159.884 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 25.1 t0 -131.21 102.47 6.01 Favored 'General case' 0 N--CA 1.43 -1.44 0 C-N-CA 125.501 1.52 . . . . 1.0 110.247 -168.079 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 28.2 t -85.57 135.22 33.9 Favored 'General case' 0 N--CA 1.429 -1.509 0 O-C-N 118.899 -2.376 . . . . 1.0 111.976 176.631 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 38.5 mt-10 -85.11 139.59 31.6 Favored 'General case' 0 N--CA 1.43 -1.44 0 O-C-N 120.953 -1.092 . . . . 1.0 110.856 171.538 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 7.9 mm -111.85 105.39 18.7 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.419 0 N-CA-C 104.927 -2.249 . . . . 1.0 104.927 166.859 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 8.0 t30 -122.95 68.25 0.98 Allowed 'General case' 0 N--CA 1.431 -1.413 0 C-N-CA 125.696 1.599 . . . . 1.0 108.208 -176.58 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . 66.61 -88.48 0.13 Allowed Glycine 0 N--CA 1.429 -1.771 0 O-C-N 120.524 -1.36 . . . . 1.0 115.986 176.584 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -113.88 4.57 24.18 Favored Glycine 0 N--CA 1.43 -1.708 0 C-N-CA 124.866 1.222 . . . . 1.0 112.955 177.953 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 40.3 t -117.54 131.17 71.04 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.483 0 C-N-CA 124.786 1.234 . . . . 1.0 107.679 176.919 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 40.1 mt -110.82 131.05 55.38 Favored 'General case' 0 N--CA 1.429 -1.478 0 O-C-N 120.702 -1.249 . . . . 1.0 108.14 166.771 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -130.6 111.69 12.46 Favored 'General case' 0 N--CA 1.431 -1.423 0 CA-C-O 123.119 1.438 . . . . 1.0 108.003 -174.245 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 41' ' ' ILE . . . . . 0.44 HG21 HD23 ' A' ' 21' ' ' LEU . 69.9 mt -89.66 114.83 28.2 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.421 0 O-C-N 120.762 -1.211 . . . . 1.0 108.023 -170.153 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 6.4 m -111.99 128.87 56.3 Favored 'General case' 0 N--CA 1.43 -1.451 0 CA-C-O 121.694 0.759 . . . . 1.0 111.295 -170.631 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 43' ' ' PHE . . . . . . . . . . . . . 2.7 m-85 -114.74 149.42 36.89 Favored 'General case' 0 N--CA 1.43 -1.445 0 O-C-N 120.437 -1.414 . . . . 1.0 107.731 -175.408 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 4.5 mt-10 -65.8 -17.01 64.34 Favored 'General case' 0 N--CA 1.43 -1.458 0 N-CA-C 116.304 1.965 . . . . 1.0 116.304 176.248 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 3.6 m-20 -64.7 -17.76 64.39 Favored 'General case' 0 N--CA 1.429 -1.478 0 O-C-N 120.66 -1.275 . . . . 1.0 113.538 172.771 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 104.45 -4.46 43.75 Favored Glycine 0 N--CA 1.429 -1.792 0 O-C-N 120.996 -1.065 . . . . 1.0 111.092 -177.861 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 69.0 m -73.92 164.57 26.47 Favored 'General case' 0 N--CA 1.43 -1.442 0 C-N-CA 129.115 2.966 . . . . 1.0 113.458 -179.865 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 81.8 tttt -168.48 132.25 1.54 Allowed 'General case' 0 N--CA 1.43 -1.466 0 O-C-N 120.778 -1.201 . . . . 1.0 114.088 -167.799 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 5.5 mm -112.98 144.4 20.71 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.471 0 C-N-CA 125.082 1.353 . . . . 1.0 108.401 174.417 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 50' ' ' ILE . . . . . 0.431 ' HB ' ' HB3' ' A' ' 63' ' ' ALA . 3.6 mm -120.0 119.39 60.0 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.483 0 C-N-CA 125.494 1.517 . . . . 1.0 109.942 -178.979 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 3.7 mt -126.99 125.6 66.84 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.474 0 O-C-N 120.304 -1.498 . . . . 1.0 111.357 -178.894 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 52' ' ' ASN . . . . . 0.409 ' H ' ' HD1' ' A' ' 61' ' ' TRP . 45.7 t-20 -160.56 166.39 29.12 Favored 'General case' 0 N--CA 1.429 -1.477 0 C-N-CA 126.759 2.024 . . . . 1.0 105.833 -177.206 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 11.1 ptm180 -133.61 145.09 49.71 Favored 'General case' 0 N--CA 1.43 -1.442 0 C-N-CA 125.513 1.525 . . . . 1.0 110.996 -162.49 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 6.2 mm-40 -128.45 -72.61 0.61 Allowed 'General case' 0 N--CA 1.429 -1.476 0 O-C-N 120.728 -1.232 . . . . 1.0 112.623 -175.052 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 54.1 mm-40 -74.12 121.64 85.68 Favored Pre-proline 0 N--CA 1.429 -1.488 0 CA-C-O 117.329 -1.32 . . . . 1.0 112.765 -165.809 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 38.4 Cg_endo -81.13 36.55 0.63 Allowed 'Trans proline' 0 C--N 1.3 -1.998 0 C-N-CA 123.877 3.051 . . . . 1.0 112.918 -174.006 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . 0.424 ' O ' ' HD2' ' A' ' 58' ' ' HIS . 55.4 mt -109.79 -100.42 0.39 Allowed 'General case' 0 N--CA 1.431 -1.413 0 N-CA-C 104.354 -2.462 . . . . 1.0 104.354 171.754 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 58' ' ' HIS . . . . . 0.424 ' HD2' ' O ' ' A' ' 57' ' ' LEU . 56.1 m170 -137.52 79.0 1.72 Allowed 'General case' 0 N--CA 1.43 -1.427 0 C-N-CA 125.57 1.548 . . . . 1.0 111.182 170.22 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 17.9 tt0 -155.5 132.75 10.89 Favored 'General case' 0 N--CA 1.43 -1.451 0 CA-C-N 121.84 2.109 . . . . 1.0 113.155 173.24 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 85.0 t -135.82 164.15 33.03 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.454 0 N-CA-C 107.339 -1.356 . . . . 1.0 107.339 179.933 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 61' ' ' TRP . . . . . 0.409 ' HD1' ' H ' ' A' ' 52' ' ' ASN . 0.1 OUTLIER -105.59 153.97 21.05 Favored 'General case' 0 N--CA 1.43 -1.441 0 O-C-N 119.971 -1.706 . . . . 1.0 114.127 178.298 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 68.9 mt -123.19 97.39 5.4 Favored 'General case' 0 N--CA 1.43 -1.446 0 N-CA-C 107.229 -1.397 . . . . 1.0 107.229 162.605 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . 0.431 ' HB3' ' HB ' ' A' ' 50' ' ' ILE . . . -98.24 139.11 34.52 Favored 'General case' 0 N--CA 1.431 -1.417 0 O-C-N 120.811 -1.18 . . . . 1.0 108.744 172.959 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 64' ' ' THR . . . . . . . . . . . . . 6.6 t -152.68 -158.52 0.9 Allowed 'General case' 0 N--CA 1.431 -1.405 0 O-C-N 120.595 -1.316 . . . . 1.0 111.39 -158.794 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 41.3 tptt -57.2 -62.85 1.47 Allowed 'General case' 0 N--CA 1.43 -1.473 0 C-N-CA 127.391 2.276 . . . . 1.0 114.373 178.762 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 31.3 tt0 -76.63 -23.56 53.35 Favored 'General case' 0 N--CA 1.429 -1.51 0 CA-C-O 122.489 1.138 . . . . 1.0 112.933 -171.605 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 155.73 -67.16 0.3 Allowed Glycine 0 N--CA 1.43 -1.704 0 N-CA-C 108.014 -2.034 . . . . 1.0 108.014 -178.398 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 85.92 170.92 47.55 Favored Glycine 0 N--CA 1.43 -1.712 0 C-N-CA 124.245 0.926 . . . . 1.0 114.971 -177.689 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -155.95 164.89 37.91 Favored 'General case' 0 N--CA 1.429 -1.509 0 C-N-CA 123.732 0.813 . . . . 1.0 110.7 -166.375 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 28.2 p80 -82.77 157.76 23.1 Favored 'General case' 0 N--CA 1.431 -1.422 0 N-CA-C 114.952 1.464 . . . . 1.0 114.952 177.518 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 42.6 p90 -121.02 134.42 55.29 Favored 'General case' 0 N--CA 1.431 -1.423 0 CA-C-N 114.835 -1.075 . . . . 1.0 113.55 -175.076 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -131.4 147.33 52.55 Favored 'General case' 0 N--CA 1.43 -1.451 0 C-N-CA 125.207 1.403 . . . . 1.0 108.203 -177.604 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 1.5 tt -85.76 114.0 22.37 Favored 'General case' 0 N--CA 1.43 -1.461 0 O-C-N 119.695 -1.878 . . . . 1.0 112.0 -169.468 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 32.3 mmtp -115.51 72.5 0.8 Allowed 'General case' 0 N--CA 1.43 -1.472 0 O-C-N 120.639 -1.288 . . . . 1.0 111.705 177.944 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . 97.84 -100.27 2.35 Favored Glycine 0 N--CA 1.43 -1.735 0 O-C-N 120.198 -1.564 . . . . 1.0 112.716 175.631 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 34.2 m-20 -115.74 11.09 15.59 Favored 'General case' 0 N--CA 1.431 -1.399 0 C-N-CA 124.436 1.094 . . . . 1.0 111.731 179.908 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 5.3 tp10 -151.44 146.32 25.86 Favored 'General case' 0 N--CA 1.43 -1.467 0 N-CA-C 105.418 -2.068 . . . . 1.0 105.418 -179.957 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 78' ' ' TRP . . . . . 0.449 ' HB2' ' HB2' ' A' ' 87' ' ' PHE . 23.7 m95 -90.25 125.63 35.56 Favored 'General case' 0 N--CA 1.429 -1.499 0 N-CA-C 107.159 -1.423 . . . . 1.0 107.159 176.266 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 2.4 mt -89.44 137.98 20.23 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.469 0 C-N-CA 127.191 2.196 . . . . 1.0 109.396 178.272 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 20.8 m -82.05 141.6 33.05 Favored 'General case' 0 N--CA 1.431 -1.425 0 N-CA-C 108.073 -1.084 . . . . 1.0 108.073 175.655 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 24.7 t70 -78.39 -1.54 33.94 Favored 'General case' 0 N--CA 1.43 -1.426 0 CA-C-N 120.201 1.364 . . . . 1.0 114.555 -175.834 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 2.0 ptt180 -82.29 176.79 9.17 Favored 'General case' 0 N--CA 1.43 -1.446 0 O-C-N 119.171 -2.206 . . . . 1.0 112.312 170.56 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 52.5 m -76.09 65.01 2.03 Favored 'General case' 0 N--CA 1.431 -1.375 0 O-C-N 119.899 -1.751 . . . . 1.0 113.051 170.878 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 170.44 103.14 0.16 Allowed Glycine 0 N--CA 1.43 -1.717 0 N-CA-C 105.577 -3.009 . . . . 1.0 105.577 170.486 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 3.2 pt-20 -116.44 82.08 1.73 Allowed 'General case' 0 N--CA 1.43 -1.444 0 N-CA-C 114.521 1.304 . . . . 1.0 114.521 -146.324 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -162.41 129.41 3.7 Favored 'General case' 0 N--CA 1.431 -1.399 0 N-CA-C 115.545 1.683 . . . . 1.0 115.545 -173.329 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 87' ' ' PHE . . . . . 0.449 ' HB2' ' HB2' ' A' ' 78' ' ' TRP . 4.4 t80 -63.63 -89.24 0.01 OUTLIER 'General case' 0 N--CA 1.43 -1.463 0 N-CA-C 116.432 2.012 . . . . 1.0 116.432 173.048 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 88' ' ' TRP . . . . . . . . . . . . . 68.5 m95 -62.1 -27.31 68.83 Favored 'General case' 0 N--CA 1.429 -1.476 0 C-N-CA 125.313 1.445 . . . . 1.0 113.217 -173.022 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . 0.276 0.6 OUTLIER -78.1 -39.41 41.5 Favored 'General case' 0 N--CA 1.429 -1.479 0 C-N-CA 126.291 1.836 . . . . 1.0 112.916 178.683 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 26.5 tp -72.08 -37.66 69.56 Favored 'General case' 0 N--CA 1.43 -1.436 0 O-C-N 118.419 -2.676 . . . . 1.0 111.784 171.15 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 18.5 tp -54.37 -40.33 68.03 Favored 'General case' 0 N--CA 1.43 -1.435 0 C-N-CA 125.43 1.492 . . . . 1.0 114.144 170.325 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 31.4 tt0 -55.71 -56.23 22.87 Favored 'General case' 0 N--CA 1.431 -1.385 0 C-N-CA 124.535 1.134 . . . . 1.0 112.88 165.908 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 60.7 mt-30 -61.25 -39.38 90.12 Favored 'General case' 0 N--CA 1.43 -1.428 0 N-CA-C 115.14 1.533 . . . . 1.0 115.14 -177.736 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -62.51 -46.7 87.21 Favored 'General case' 0 N--CA 1.43 -1.469 0 O-C-N 119.402 -2.061 . . . . 1.0 112.91 170.622 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -67.59 -36.57 81.14 Favored 'General case' 0 N--CA 1.429 -1.501 0 O-C-N 119.566 -1.959 . . . . 1.0 114.263 176.678 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -57.72 -38.67 75.68 Favored 'General case' 0 N--CA 1.43 -1.448 0 C-N-CA 127.033 2.133 . . . . 1.0 112.474 173.617 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 8.2 pt20 -78.15 -37.11 46.74 Favored 'General case' 0 N--CA 1.431 -1.41 0 O-C-N 121.097 -1.002 . . . . 1.0 113.455 174.963 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 6.9 mm-40 -72.69 -41.91 64.8 Favored 'General case' 0 N--CA 1.43 -1.467 0 N-CA-C 115.308 1.596 . . . . 1.0 115.308 -177.486 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -84.91 -39.15 18.55 Favored 'General case' 0 N--CA 1.429 -1.494 0 C-N-CA 124.804 1.242 . . . . 1.0 112.136 174.255 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . 105.61 12.56 26.24 Favored Glycine 0 N--CA 1.43 -1.715 0 O-C-N 121.004 -1.06 . . . . 1.0 114.256 176.105 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 8.4 pt-20 -165.2 163.44 20.25 Favored 'General case' 0 N--CA 1.43 -1.435 0 N-CA-C 105.439 -2.059 . . . . 1.0 105.439 -175.486 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 94.9 m -67.47 114.06 5.83 Favored 'General case' 0 N--CA 1.43 -1.472 0 CA-C-N 120.286 1.403 . . . . 1.0 113.717 -172.09 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 76.1 t -95.6 122.61 47.23 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.448 0 C-N-CA 126.899 2.08 . . . . 1.0 106.325 171.694 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 59.5 m -103.16 102.63 12.63 Favored 'General case' 0 N--CA 1.43 -1.461 0 C-N-CA 124.556 1.142 . . . . 1.0 112.66 -162.363 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 45.7 m-85 -95.57 -36.67 11.18 Favored 'General case' 0 N--CA 1.43 -1.45 0 O-C-N 120.317 -1.489 . . . . 1.0 111.825 177.363 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 11.7 mmt85 . . . . . 0 C--O 1.26 1.658 0 C-N-CA 124.174 0.99 . . . . 1.0 110.778 -179.42 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 25.0 mmt . . . . . 0 CA--C 1.491 -1.296 0 N-CA-C 112.297 0.48 . . . . 1.0 112.297 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 19.6 m120 -137.77 -179.83 5.99 Favored 'General case' 0 N--CA 1.43 -1.45 0 C-N-CA 124.551 1.14 . . . . 1.0 109.235 175.165 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 25.7 t70 -56.84 -50.35 72.68 Favored 'General case' 0 N--CA 1.43 -1.47 0 C-N-CA 128.239 2.616 . . . . 1.0 112.321 178.947 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 41.9 t -44.7 -50.23 10.07 Favored 'General case' 0 N--CA 1.429 -1.488 0 C-N-CA 128.253 2.621 . . . . 1.0 114.181 170.086 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 14.5 tt0 -74.04 -51.41 15.9 Favored 'General case' 0 N--CA 1.43 -1.457 0 C-N-CA 125.33 1.452 . . . . 1.0 113.024 -177.0 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 11.1 t80 -49.95 -43.51 50.07 Favored 'General case' 0 N--CA 1.431 -1.409 0 N-CA-C 115.753 1.76 . . . . 1.0 115.753 170.698 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 35.2 m170 -69.9 -33.65 72.47 Favored 'General case' 0 N--CA 1.43 -1.425 0 N-CA-C 114.664 1.357 . . . . 1.0 114.664 175.458 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -66.0 -46.39 78.14 Favored 'General case' 0 N--CA 1.43 -1.458 0 O-C-N 120.731 -1.23 . . . . 1.0 112.96 169.742 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 97.7 mt -60.3 -34.73 74.18 Favored 'General case' 0 N--CA 1.43 -1.438 0 O-C-N 120.57 -1.331 . . . . 1.0 113.745 173.647 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -59.05 -46.69 87.62 Favored 'General case' 0 N--CA 1.43 -1.473 0 C-N-CA 125.692 1.597 . . . . 1.0 113.245 170.307 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -58.28 -41.49 84.46 Favored 'General case' 0 N--CA 1.429 -1.482 0 C-N-CA 124.658 1.183 . . . . 1.0 113.11 172.359 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 55.1 mt-30 -58.13 -58.43 8.47 Favored 'General case' 0 N--CA 1.431 -1.42 0 N-CA-C 115.166 1.543 . . . . 1.0 115.166 172.092 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 3.7 pp -66.36 -40.15 89.58 Favored 'General case' 0 N--CA 1.43 -1.433 0 O-C-N 120.15 -1.594 . . . . 1.0 114.996 -176.483 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 33.7 m0 -64.6 -44.19 91.42 Favored 'General case' 0 N--CA 1.429 -1.487 0 C-N-CA 124.814 1.246 . . . . 1.0 112.948 174.548 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 63.0 tp -58.6 -54.77 43.29 Favored 'General case' 0 N--CA 1.431 -1.417 0 O-C-N 120.564 -1.335 . . . . 1.0 112.506 171.533 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 29.4 m -57.42 -53.39 58.66 Favored 'General case' 0 N--CA 1.43 -1.451 0 C-N-CA 125.492 1.517 . . . . 1.0 113.228 -174.381 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 14.4 mt -68.22 -44.24 84.2 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.44 0 O-C-N 120.499 -1.376 . . . . 1.0 113.846 178.826 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 32.3 tt0 -60.86 -47.57 85.78 Favored 'General case' 0 N--CA 1.431 -1.399 0 CA-C-N 120.641 1.564 . . . . 1.0 112.883 179.09 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 34.0 tt0 -58.75 -55.0 40.69 Favored 'General case' 0 N--CA 1.43 -1.438 0 C-N-CA 125.109 1.364 . . . . 1.0 113.551 174.381 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 16.3 tpt180 -58.39 -44.06 88.81 Favored 'General case' 0 N--CA 1.43 -1.462 0 C-N-CA 124.798 1.239 . . . . 1.0 114.11 -176.084 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 84.8 mt -74.83 -43.38 54.88 Favored 'General case' 0 N--CA 1.43 -1.436 0 O-C-N 121.0 -1.062 . . . . 1.0 113.845 179.013 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 21.1 t70 -64.09 -35.14 79.77 Favored 'General case' 0 CA--C 1.488 -1.434 0 O-C-N 120.527 -1.358 . . . . 1.0 114.433 176.092 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 29.4 t70 -71.8 -43.36 65.78 Favored 'General case' 0 N--CA 1.431 -1.404 0 O-C-N 120.33 -1.481 . . . . 1.0 113.84 179.715 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 24' ' ' TRP . . . . . . . . . . . . . 68.8 t-105 -78.71 154.45 30.07 Favored 'General case' 0 N--CA 1.43 -1.474 0 CA-C-O 122.342 1.068 . . . . 1.0 113.523 -173.304 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 52.5 m-20 -96.93 -153.76 0.43 Allowed 'General case' 0 N--CA 1.431 -1.419 0 O-C-N 120.384 -1.447 . . . . 1.0 111.381 -176.165 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 153.16 -173.68 31.99 Favored Glycine 0 N--CA 1.431 -1.639 0 N-CA-C 109.003 -1.639 . . . . 1.0 109.003 -178.275 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 6.6 t70 -78.06 -44.64 25.77 Favored 'General case' 0 N--CA 1.432 -1.351 0 O-C-N 121.418 -1.048 . . . . 1.0 108.322 170.326 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 21.9 t -68.31 156.4 37.79 Favored 'General case' 0 N--CA 1.43 -1.469 0 C-N-CA 125.912 1.685 . . . . 1.0 113.743 172.661 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 4.6 t70 -86.52 175.45 8.34 Favored 'General case' 0 N--CA 1.429 -1.475 0 C-N-CA 125.833 1.653 . . . . 1.0 107.735 164.471 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -162.89 119.63 0.16 Allowed 'Isoleucine or valine' 0 N--CA 1.43 -1.436 0 O-C-N 120.223 -1.548 . . . . 1.0 107.508 -172.051 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 26.3 t70 -131.93 111.26 11.41 Favored 'General case' 0 N--CA 1.43 -1.458 0 O-C-N 120.189 -1.569 . . . . 1.0 108.743 174.258 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 96.3 m -90.25 134.93 33.99 Favored 'General case' 0 N--CA 1.431 -1.385 0 O-C-N 119.231 -2.168 . . . . 1.0 109.857 174.399 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 37.0 mt-10 -101.97 132.78 47.59 Favored 'General case' 0 N--CA 1.431 -1.419 0 C-N-CA 125.012 1.325 . . . . 1.0 109.157 -178.605 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 3.6 tp -112.48 113.59 44.57 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.449 0 CA-C-O 123.792 1.758 . . . . 1.0 106.379 175.756 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -136.42 99.08 3.99 Favored 'General case' 0 N--CA 1.43 -1.45 0 CA-C-N 114.578 -1.192 . . . . 1.0 111.219 -177.849 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . 71.77 26.24 73.25 Favored Glycine 0 N--CA 1.429 -1.774 0 O-C-N 120.251 -1.531 . . . . 1.0 116.34 164.395 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 86.95 20.71 52.76 Favored Glycine 0 N--CA 1.43 -1.752 0 C-N-CA 123.798 0.713 . . . . 1.0 112.889 -173.785 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 84.9 t -125.08 131.48 72.45 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.394 0 N-CA-C 105.815 -1.921 . . . . 1.0 105.815 173.068 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 42.5 mt -102.6 132.25 48.82 Favored 'General case' 0 N--CA 1.431 -1.398 0 CA-C-O 122.56 1.172 . . . . 1.0 109.615 165.785 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 40' ' ' THR . . . . . 0.402 HG23 HD13 ' A' ' 50' ' ' ILE . 0.1 OUTLIER -118.13 124.62 48.45 Favored 'General case' 0 N--CA 1.43 -1.427 0 N-CA-C 106.724 -1.584 . . . . 1.0 106.724 171.392 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 69.7 mt -101.42 121.57 52.48 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.475 0 N-CA-C 108.406 -0.961 . . . . 1.0 108.406 -173.626 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 20.2 p -123.72 118.51 27.38 Favored 'General case' 0 N--CA 1.431 -1.397 0 N-CA-C 113.942 1.09 . . . . 1.0 113.942 -173.439 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 43' ' ' PHE . . . . . . . . . . . . . 3.0 p90 -123.32 169.82 10.93 Favored 'General case' 0 N--CA 1.43 -1.44 0 C-N-CA 126.015 1.726 . . . . 1.0 114.088 174.674 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 7.5 mm-40 -53.34 -32.71 50.42 Favored 'General case' 0 N--CA 1.43 -1.441 0 N-CA-C 118.129 2.64 . . . . 1.0 118.129 -174.44 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -66.78 -12.99 60.89 Favored 'General case' 0 N--CA 1.43 -1.449 0 O-C-N 120.478 -1.389 . . . . 1.0 113.527 -179.715 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 100.96 -14.37 58.68 Favored Glycine 0 N--CA 1.43 -1.755 0 O-C-N 120.791 -1.193 . . . . 1.0 113.425 166.008 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 4.3 m -77.09 168.75 19.55 Favored 'General case' 0 N--CA 1.43 -1.451 0 C-N-CA 124.615 1.166 . . . . 1.0 111.661 176.918 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 93.1 mttt -142.91 135.48 27.64 Favored 'General case' 0 N--CA 1.43 -1.451 0 O-C-N 121.03 -1.044 . . . . 1.0 111.154 -172.266 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 49' ' ' ILE . . . . . 0.633 HD12 HG23 ' A' ' 64' ' ' THR . 4.2 mm -101.36 137.31 29.46 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.414 0 N-CA-C 105.922 -1.881 . . . . 1.0 105.922 175.671 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 50' ' ' ILE . . . . . 0.553 HG23 ' HB3' ' A' ' 63' ' ' ALA . 2.5 tp -128.06 124.83 63.44 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.469 0 CA-C-O 123.078 1.418 . . . . 1.0 109.687 -176.778 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 2.3 mt -127.45 118.03 48.47 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.496 0 C-N-CA 126.316 1.846 . . . . 1.0 111.906 -172.858 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 52' ' ' ASN . . . . . 0.417 ' H ' ' HD1' ' A' ' 61' ' ' TRP . 48.6 t30 -157.75 171.42 20.34 Favored 'General case' 0 N--CA 1.431 -1.418 0 C-N-CA 127.022 2.129 . . . . 1.0 107.792 -176.305 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -136.74 161.17 36.68 Favored 'General case' 0 N--CA 1.43 -1.474 0 C-N-CA 125.722 1.609 . . . . 1.0 114.547 -167.668 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 13.3 mm100 -108.09 129.03 55.17 Favored 'General case' 0 N--CA 1.429 -1.493 0 C-N-CA 125.998 1.719 . . . . 1.0 106.59 169.572 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 47.1 tt0 -60.69 -38.21 53.96 Favored Pre-proline 0 N--CA 1.428 -1.536 0 CA-C-O 117.132 -1.413 . . . . 1.0 114.528 164.481 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 51.9 Cg_exo -66.55 121.57 8.84 Favored 'Trans proline' 0 C--N 1.299 -2.056 0 CA-C-N 124.97 2.811 . . . . 1.0 113.745 160.716 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . 0.381 5.0 mp 75.3 131.9 0.05 OUTLIER 'General case' 0 N--CA 1.43 -1.43 0 CA-C-O 124.944 2.306 . . . . 1.0 116.336 -179.041 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 29.1 m80 -79.98 55.85 2.22 Favored 'General case' 0 N--CA 1.429 -1.502 0 C-N-CA 126.358 1.863 . . . . 1.0 114.144 -172.661 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -144.06 147.37 33.71 Favored 'General case' 0 N--CA 1.43 -1.453 0 C-N-CA 126.112 1.765 . . . . 1.0 110.528 -178.279 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 43.3 t -121.09 151.16 24.1 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.431 0 O-C-N 120.484 -1.385 . . . . 1.0 109.457 -175.372 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 61' ' ' TRP . . . . . 0.456 ' HA ' ' HA ' ' A' ' 70' ' ' HIS . 0.0 OUTLIER -88.77 152.87 21.51 Favored 'General case' 0 N--CA 1.43 -1.461 0 O-C-N 119.65 -1.906 . . . . 1.0 114.533 -178.565 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 80.6 mt -116.17 93.89 4.42 Favored 'General case' 0 N--CA 1.43 -1.444 0 N-CA-C 106.594 -1.632 . . . . 1.0 106.594 162.422 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . 0.553 ' HB3' HG23 ' A' ' 50' ' ' ILE . . . -92.96 100.18 12.68 Favored 'General case' 0 N--CA 1.43 -1.429 0 CA-C-O 123.26 1.505 . . . . 1.0 109.872 169.016 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 64' ' ' THR . . . . . 0.633 HG23 HD12 ' A' ' 49' ' ' ILE . 3.0 m -111.33 -113.51 0.32 Allowed 'General case' 0 N--CA 1.429 -1.509 0 N-CA-C 106.691 -1.596 . . . . 1.0 106.691 -171.909 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 13.3 tmtt? -82.81 -45.59 14.13 Favored 'General case' 0 N--CA 1.43 -1.45 0 O-C-N 119.745 -1.847 . . . . 1.0 111.01 174.452 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 66' ' ' GLN . . . . . 0.436 HE22 ' HB2' ' A' ' 94' ' ' ALA . 17.5 mp0 -74.59 -27.02 60.3 Favored 'General case' 0 N--CA 1.43 -1.469 0 N-CA-C 116.099 1.888 . . . . 1.0 116.099 -166.475 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 117.48 26.24 2.94 Favored Glycine 0 N--CA 1.43 -1.752 0 N-CA-C 117.133 1.613 . . . . 1.0 117.133 166.074 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 115.51 74.59 0.58 Allowed Glycine 0 N--CA 1.43 -1.752 0 CA-C-N 119.569 1.685 . . . . 1.0 115.735 165.185 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 18.2 m-30 -102.07 116.67 33.18 Favored 'General case' 0 N--CA 1.43 -1.468 0 N-CA-C 106.858 -1.534 . . . . 1.0 106.858 178.299 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 70' ' ' HIS . . . . . 0.456 ' HA ' ' HA ' ' A' ' 61' ' ' TRP . 40.8 p-80 -81.68 157.51 24.59 Favored 'General case' 0 N--CA 1.43 -1.468 0 O-C-N 119.802 -1.811 . . . . 1.0 113.891 -179.33 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -116.09 129.76 56.49 Favored 'General case' 0 N--CA 1.43 -1.45 0 N-CA-C 113.375 0.879 . . . . 1.0 113.375 -176.193 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 7.1 m-20 -112.32 179.39 4.0 Favored 'General case' 0 N--CA 1.431 -1.382 0 N-CA-C 107.28 -1.378 . . . . 1.0 107.28 172.483 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 26.3 tp -113.3 106.93 15.2 Favored 'General case' 0 N--CA 1.43 -1.45 0 O-C-N 119.117 -2.239 . . . . 1.0 112.079 -174.957 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 2.8 ttpm? -70.81 -45.18 65.07 Favored 'General case' 0 N--CA 1.431 -1.421 0 O-C-N 119.647 -1.908 . . . . 1.0 113.3 168.024 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -170.51 -103.06 0.16 Allowed Glycine 0 N--CA 1.43 -1.735 0 O-C-N 120.365 -1.459 . . . . 1.0 112.184 177.996 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 40.7 m-20 -89.74 17.94 6.06 Favored 'General case' 0 N--CA 1.431 -1.42 0 O-C-N 120.676 -1.485 . . . . 1.0 111.623 179.698 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 9.2 tt0 -168.13 137.12 2.42 Favored 'General case' 0 N--CA 1.43 -1.467 0 N-CA-C 102.864 -3.013 . . . . 1.0 102.864 -163.676 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 78' ' ' TRP . . . . . . . . . . . . . 33.0 m95 -88.53 145.83 25.51 Favored 'General case' 0 N--CA 1.43 -1.469 0 CA-C-O 122.195 0.998 . . . . 1.0 108.822 -177.131 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 2.1 tt -114.1 130.79 67.7 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.47 0 C-N-CA 129.394 3.078 . . . . 1.0 104.587 -168.818 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 80' ' ' CYS . . . . . 0.402 ' HB2' ' HA ' ' A' ' 85' ' ' GLU . 81.3 m -89.4 146.13 24.87 Favored 'General case' 0 N--CA 1.43 -1.472 0 O-C-N 120.679 -1.263 . . . . 1.0 113.483 -172.674 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 22.0 t70 -45.0 -53.69 7.44 Favored 'General case' 0 N--CA 1.431 -1.383 0 C-N-CA 128.27 2.628 . . . . 1.0 115.871 174.263 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 16.1 ptm180 -149.65 177.43 9.77 Favored 'General case' 0 N--CA 1.43 -1.431 0 O-C-N 120.677 -1.265 . . . . 1.0 110.19 -174.007 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 3.4 t 78.58 -73.47 0.07 Allowed 'General case' 0 N--CA 1.43 -1.439 0 C-N-CA 126.802 2.041 . . . . 1.0 113.026 -175.701 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -170.89 104.1 0.2 Allowed Glycine 0 N--CA 1.43 -1.719 0 N-CA-C 108.845 -1.702 . . . . 1.0 108.845 -176.131 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 85' ' ' GLU . . . . . 0.417 ' HG3' ' H ' ' A' ' 85' ' ' GLU . 0.0 OUTLIER -63.41 105.26 0.73 Allowed 'General case' 0 N--CA 1.429 -1.513 0 N-CA-C 119.86 3.281 . . . . 1.0 119.86 -166.807 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -173.81 127.01 0.39 Allowed 'General case' 0 N--CA 1.43 -1.472 0 C-N-CA 124.718 1.207 . . . . 1.0 112.604 166.522 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 1.2 t80 -45.53 -89.5 0.0 OUTLIER 'General case' 0 N--CA 1.43 -1.44 0 N-CA-C 119.059 2.985 . . . . 1.0 119.059 178.187 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 88' ' ' TRP . . . . . . . . . . . . . 85.7 m95 -72.38 -26.07 61.75 Favored 'General case' 0 N--CA 1.43 -1.436 0 O-C-N 120.07 -1.644 . . . . 1.0 111.546 -166.702 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 6.8 m-20 -69.87 -45.73 67.07 Favored 'General case' 0 N--CA 1.43 -1.451 0 C-N-CA 125.476 1.51 . . . . 1.0 113.283 177.578 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 35.3 tp -69.66 -41.83 75.0 Favored 'General case' 0 N--CA 1.429 -1.521 0 O-C-N 119.557 -1.964 . . . . 1.0 111.523 176.278 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 33.5 tp -56.21 -40.75 74.53 Favored 'General case' 0 N--CA 1.429 -1.52 0 C-N-CA 124.846 1.258 . . . . 1.0 114.26 169.384 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 42.2 tt0 -55.24 -49.87 70.92 Favored 'General case' 0 N--CA 1.43 -1.461 0 C-N-CA 126.711 2.004 . . . . 1.0 112.021 172.379 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 2.1 mp0 -59.96 -46.88 87.98 Favored 'General case' 0 N--CA 1.43 -1.431 0 O-C-N 120.205 -1.559 . . . . 1.0 114.649 173.773 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 94' ' ' ALA . . . . . 0.436 ' HB2' HE22 ' A' ' 66' ' ' GLN . . . -62.87 -42.18 99.67 Favored 'General case' 0 N--CA 1.43 -1.456 0 N-CA-C 115.068 1.507 . . . . 1.0 115.068 177.833 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -80.2 -37.37 33.32 Favored 'General case' 0 N--CA 1.429 -1.497 0 O-C-N 120.268 -1.52 . . . . 1.0 114.043 -179.472 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 96' ' ' THR . . . . . 0.448 HG23 HG12 ' A' ' 103' ' ' VAL . 23.2 p -58.52 -38.51 77.87 Favored 'General case' 0 N--CA 1.43 -1.452 0 CA-C-N 120.663 1.574 . . . . 1.0 112.335 170.574 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 34.1 tp60 -59.44 -61.58 2.52 Favored 'General case' 0 N--CA 1.429 -1.484 0 C-N-CA 124.837 1.255 . . . . 1.0 113.354 172.425 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 4.4 mm-40 -64.25 -43.4 95.01 Favored 'General case' 0 N--CA 1.429 -1.496 0 N-CA-C 116.145 1.906 . . . . 1.0 116.145 -179.038 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -77.45 -31.82 54.08 Favored 'General case' 0 CA--C 1.489 -1.386 0 O-C-N 120.644 -1.285 . . . . 1.0 113.427 -178.017 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . 98.26 16.63 31.81 Favored Glycine 0 N--CA 1.428 -1.857 0 C-N-CA 124.568 1.08 . . . . 1.0 115.537 169.735 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 16.4 pt-20 -168.05 174.86 7.01 Favored 'General case' 0 N--CA 1.428 -1.562 0 N-CA-C 108.204 -1.036 . . . . 1.0 108.204 -172.403 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 25.8 m -66.35 121.73 15.91 Favored 'General case' 0 N--CA 1.431 -1.385 0 O-C-N 120.645 -1.285 . . . . 1.0 112.569 -177.268 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 103' ' ' VAL . . . . . 0.448 HG12 HG23 ' A' ' 96' ' ' THR . 4.7 p -97.83 137.14 26.25 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.508 0 N-CA-C 106.046 -1.835 . . . . 1.0 106.046 179.391 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 2.8 t -117.07 78.88 1.26 Allowed 'General case' 0 N--CA 1.431 -1.396 0 O-C-N 121.181 -0.949 . . . . 1.0 112.161 -162.638 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 61.9 m-85 -103.03 -35.55 8.5 Favored 'General case' 0 N--CA 1.429 -1.486 0 O-C-N 120.06 -1.65 . . . . 1.0 110.306 174.458 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 22.6 mtm180 . . . . . 0 C--O 1.259 1.598 0 C-N-CA 123.411 0.685 . . . . 1.0 110.043 -172.597 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 54.7 mtt . . . . . 0 CA--C 1.489 -1.373 0 CA-C-O 121.681 0.753 . . . . 1.0 111.866 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 56.0 m-80 -128.88 160.73 31.7 Favored 'General case' 0 N--CA 1.43 -1.471 0 O-C-N 120.206 -1.559 . . . . 1.0 112.647 -170.407 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 8.3 p-10 -73.48 -29.2 62.37 Favored 'General case' 0 N--CA 1.43 -1.474 0 C-N-CA 125.19 1.396 . . . . 1.0 112.433 175.786 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 48.3 p -58.66 -52.17 66.84 Favored 'General case' 0 N--CA 1.43 -1.459 0 C-N-CA 125.762 1.625 . . . . 1.0 113.151 168.752 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 95.6 mt-10 -54.31 -54.07 45.34 Favored 'General case' 0 N--CA 1.428 -1.555 0 C-N-CA 126.822 2.049 . . . . 1.0 112.573 172.037 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 43.0 t80 -48.69 -46.94 41.14 Favored 'General case' 0 N--CA 1.429 -1.49 0 N-CA-C 115.343 1.609 . . . . 1.0 115.343 172.728 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 18.0 m170 -60.98 -51.54 68.83 Favored 'General case' 0 N--CA 1.43 -1.428 0 N-CA-C 113.838 1.051 . . . . 1.0 113.838 175.884 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 94.7 mtt180 -61.45 -40.61 95.12 Favored 'General case' 0 N--CA 1.429 -1.493 0 O-C-N 120.542 -1.349 . . . . 1.0 113.92 -179.724 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 72.5 mt -64.33 -45.35 88.23 Favored 'General case' 0 N--CA 1.43 -1.469 0 C-N-CA 125.402 1.481 . . . . 1.0 112.795 173.107 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -60.3 -51.04 71.23 Favored 'General case' 0 N--CA 1.43 -1.459 0 C-N-CA 125.898 1.679 . . . . 1.0 113.641 -179.407 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 -56.64 -49.21 75.68 Favored 'General case' 0 N--CA 1.429 -1.487 0 C-N-CA 124.267 1.027 . . . . 1.0 112.207 172.818 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . 0.315 5.9 pt20 -63.82 -44.73 92.38 Favored 'General case' 0 N--CA 1.431 -1.408 0 O-C-N 120.091 -1.631 . . . . 1.0 115.108 178.705 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 4.2 pp -65.34 -36.7 84.84 Favored 'General case' 0 N--CA 1.43 -1.469 0 CA-C-N 121.375 1.898 . . . . 1.0 115.019 -179.011 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 29.6 m0 -54.9 -60.41 3.4 Favored 'General case' 0 N--CA 1.43 -1.461 0 N-CA-C 113.507 0.929 . . . . 1.0 113.507 166.683 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 35.2 mt -63.67 -33.75 76.32 Favored 'General case' 0 N--CA 1.431 -1.413 0 CA-C-N 120.561 1.528 . . . . 1.0 114.593 -178.416 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 86.0 m -54.86 -59.98 3.99 Favored 'General case' 0 N--CA 1.431 -1.416 0 C-N-CA 125.475 1.51 . . . . 1.0 111.98 173.771 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 38.9 mm -62.12 -39.12 82.71 Favored 'Isoleucine or valine' 0 CA--C 1.489 -1.374 0 N-CA-C 114.596 1.332 . . . . 1.0 114.596 176.844 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 95.4 mt-10 -51.55 -52.33 48.05 Favored 'General case' 0 N--CA 1.43 -1.434 0 CA-C-N 121.434 1.925 . . . . 1.0 113.281 171.529 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 2.4 tp10 -65.4 -36.58 84.38 Favored 'General case' 0 N--CA 1.429 -1.489 0 N-CA-C 114.246 1.202 . . . . 1.0 114.246 -179.819 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 49.8 ttt-85 -54.0 -51.03 65.24 Favored 'General case' 0 N--CA 1.43 -1.465 0 O-C-N 120.793 -1.192 . . . . 1.0 113.053 170.521 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -70.07 -45.05 67.85 Favored 'General case' 0 N--CA 1.43 -1.436 0 N-CA-C 113.085 0.772 . . . . 1.0 113.085 178.302 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 34.8 t0 -55.18 -44.56 75.36 Favored 'General case' 0 N--CA 1.43 -1.449 0 C-N-CA 125.122 1.369 . . . . 1.0 114.075 178.987 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 32.1 t70 -71.04 -28.73 64.6 Favored 'General case' 0 N--CA 1.431 -1.409 0 O-C-N 120.052 -1.655 . . . . 1.0 113.472 177.678 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 24' ' ' TRP . . . . . . . . . . . . . 37.3 t-105 -71.28 149.33 46.26 Favored 'General case' 0 N--CA 1.43 -1.462 0 O-C-N 120.063 -1.648 . . . . 1.0 112.897 -177.831 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 6.8 m-20 -151.66 163.02 40.02 Favored 'General case' 0 N--CA 1.429 -1.488 0 N-CA-C 104.002 -2.592 . . . . 1.0 104.002 163.543 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -161.27 -132.6 1.36 Allowed Glycine 0 N--CA 1.43 -1.72 0 O-C-N 120.622 -1.299 . . . . 1.0 111.417 176.565 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -68.3 -32.6 72.86 Favored 'General case' 0 N--CA 1.43 -1.437 0 O-C-N 121.466 -1.02 . . . . 1.0 110.347 171.743 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 79.9 p -112.86 172.48 6.91 Favored 'General case' 0 N--CA 1.43 -1.452 0 C-N-CA 124.347 1.059 . . . . 1.0 111.212 177.046 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 2.9 t70 -96.12 -168.94 1.83 Allowed 'General case' 0 N--CA 1.43 -1.462 0 C-N-CA 124.811 1.244 . . . . 1.0 110.28 179.091 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 7.1 tp -163.37 119.73 0.15 Allowed 'Isoleucine or valine' 0 N--CA 1.43 -1.456 0 O-C-N 120.502 -1.374 . . . . 1.0 110.652 -169.19 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 37.7 t0 -135.84 108.25 7.35 Favored 'General case' 0 N--CA 1.43 -1.432 0 O-C-N 119.86 -1.775 . . . . 1.0 110.533 169.407 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 33.7 t -81.33 143.97 31.83 Favored 'General case' 0 N--CA 1.43 -1.438 0 O-C-N 119.033 -2.292 . . . . 1.0 112.049 173.012 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 33.4 mt-10 -90.16 139.22 30.84 Favored 'General case' 0 N--CA 1.43 -1.445 0 O-C-N 120.403 -1.436 . . . . 1.0 109.13 168.765 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 3.9 mp -126.28 105.68 14.75 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.425 0 N-CA-C 104.853 -2.277 . . . . 1.0 104.853 173.927 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 48.6 t30 -132.75 76.64 1.7 Allowed 'General case' 0 N--CA 1.429 -1.48 0 C-N-CA 124.882 1.273 . . . . 1.0 110.849 -167.171 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . 78.75 -73.15 2.31 Favored Glycine 0 N--CA 1.43 -1.754 0 O-C-N 120.963 -1.086 . . . . 1.0 115.453 167.343 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -142.93 27.53 2.17 Favored Glycine 0 N--CA 1.431 -1.684 0 C-N-CA 124.906 1.241 . . . . 1.0 110.432 172.116 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 76.4 t -125.44 136.22 61.54 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.419 0 C-N-CA 125.313 1.445 . . . . 1.0 107.198 177.216 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 72.7 mt -109.62 136.66 48.63 Favored 'General case' 0 N--CA 1.43 -1.431 0 N-CA-C 107.084 -1.45 . . . . 1.0 107.084 155.684 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -138.55 111.04 7.51 Favored 'General case' 0 N--CA 1.431 -1.393 0 N-CA-C 106.035 -1.839 . . . . 1.0 106.035 178.368 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 67.9 mt -89.74 126.35 42.65 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.432 0 O-C-N 120.32 -1.488 . . . . 1.0 109.684 -171.097 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 28.3 p -119.85 126.35 50.76 Favored 'General case' 0 N--CA 1.43 -1.435 0 CA-C-O 121.728 0.775 . . . . 1.0 113.004 179.896 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 43' ' ' PHE . . . . . . . . . . . . . 1.0 OUTLIER -122.96 170.27 10.3 Favored 'General case' 0 N--CA 1.43 -1.444 0 O-C-N 120.27 -1.519 . . . . 1.0 112.302 169.909 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 4.4 mm-40 -48.41 -36.75 15.38 Favored 'General case' 0 N--CA 1.429 -1.488 0 N-CA-C 118.557 2.799 . . . . 1.0 118.557 -171.439 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 47.1 m-80 -68.86 -6.0 24.52 Favored 'General case' 0 N--CA 1.43 -1.474 0 N-CA-C 115.535 1.68 . . . . 1.0 115.535 179.716 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 80.24 30.54 41.27 Favored Glycine 0 N--CA 1.43 -1.757 0 O-C-N 120.579 -1.325 . . . . 1.0 112.791 172.142 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 51.0 m -127.12 149.52 49.91 Favored 'General case' 0 N--CA 1.43 -1.46 0 N-CA-C 105.168 -2.16 . . . . 1.0 105.168 -177.571 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 22.8 pttm -140.53 159.07 43.0 Favored 'General case' 0 N--CA 1.431 -1.404 0 N-CA-C 113.826 1.047 . . . . 1.0 113.826 -165.136 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 12.7 mm -110.61 138.56 38.1 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.471 0 N-CA-C 106.195 -1.78 . . . . 1.0 106.195 177.1 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 5.5 mm -120.77 114.91 45.3 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.414 0 CA-C-N 119.937 1.244 . . . . 1.0 110.787 -173.562 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER -125.68 89.26 1.39 Allowed 'Isoleucine or valine' 0 N--CA 1.43 -1.459 0 C-N-CA 126.187 1.795 . . . . 1.0 110.468 -172.565 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 52' ' ' ASN . . . . . 0.425 ' H ' ' HD1' ' A' ' 61' ' ' TRP . 51.3 m-20 -114.25 161.74 17.46 Favored 'General case' 0 N--CA 1.43 -1.448 0 C-N-CA 128.725 2.81 . . . . 1.0 110.239 178.545 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -154.31 151.54 29.22 Favored 'General case' 0 N--CA 1.43 -1.455 0 O-C-N 119.91 -1.744 . . . . 1.0 112.319 -168.666 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -100.33 144.17 29.65 Favored 'General case' 0 N--CA 1.43 -1.433 0 CA-C-O 123.426 1.584 . . . . 1.0 108.192 174.977 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 54.3 mt-10 -70.75 -63.55 1.56 Allowed Pre-proline 0 N--CA 1.431 -1.418 0 CA-C-O 116.034 -1.936 . . . . 1.0 114.479 172.163 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 87.3 Cg_endo -78.85 157.9 27.58 Favored 'Trans proline' 0 C--N 1.3 -1.984 0 CA-C-N 126.135 3.227 . . . . 1.0 112.622 169.959 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . 0.409 5.1 mp 72.18 134.94 0.04 OUTLIER 'General case' 0 N--CA 1.43 -1.456 0 C-N-CA 127.266 2.226 . . . . 1.0 113.588 -165.616 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 17.5 m170 -83.8 50.77 1.88 Allowed 'General case' 0 N--CA 1.431 -1.411 0 O-C-N 120.668 -1.27 . . . . 1.0 112.853 -172.596 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -152.28 158.95 43.51 Favored 'General case' 0 N--CA 1.43 -1.428 0 O-C-N 120.382 -1.449 . . . . 1.0 109.43 -178.401 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 38.2 t -126.5 161.63 32.28 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.438 0 C-N-CA 125.528 1.531 . . . . 1.0 108.55 -169.182 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 61' ' ' TRP . . . . . 0.425 ' HD1' ' H ' ' A' ' 52' ' ' ASN . 0.0 OUTLIER -93.52 154.78 17.7 Favored 'General case' 0 N--CA 1.431 -1.413 0 O-C-N 118.792 -2.443 . . . . 1.0 111.028 177.3 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -142.5 101.41 3.88 Favored 'General case' 0 N--CA 1.431 -1.409 0 O-C-N 118.362 -2.711 . . . . 1.0 112.687 169.55 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -112.22 149.62 32.03 Favored 'General case' 0 N--CA 1.43 -1.467 0 O-C-N 119.494 -2.003 . . . . 1.0 114.61 174.313 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 64' ' ' THR . . . . . . . . . . . . . 95.1 m -151.89 -87.12 0.07 Allowed 'General case' 0 N--CA 1.43 -1.436 0 C-N-CA 126.186 1.794 . . . . 1.0 109.977 -179.891 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -131.23 -54.77 1.04 Allowed 'General case' 0 N--CA 1.43 -1.445 0 O-C-N 121.139 -0.976 . . . . 1.0 113.184 -170.556 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 58.8 mt-30 -71.08 -24.75 62.38 Favored 'General case' 0 N--CA 1.431 -1.418 0 N-CA-C 114.639 1.348 . . . . 1.0 114.639 -171.003 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 177.09 -40.42 0.1 OUTLIER Glycine 0 N--CA 1.429 -1.811 0 C-N-CA 117.753 -2.165 . . . . 1.0 115.588 174.207 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 98.8 106.62 2.65 Favored Glycine 0 N--CA 1.43 -1.745 0 CA-C-O 122.557 1.087 . . . . 1.0 111.978 -173.96 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 14.8 m-85 -128.5 135.77 49.89 Favored 'General case' 0 N--CA 1.43 -1.459 0 N-CA-C 105.802 -1.925 . . . . 1.0 105.802 -167.939 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 70' ' ' HIS . . . . . 0.458 ' HE1' ' OD2' ' A' ' 81' ' ' ASP . 27.2 p80 -83.42 159.8 21.71 Favored 'General case' 0 N--CA 1.43 -1.467 0 O-C-N 119.826 -1.796 . . . . 1.0 112.881 179.905 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 71' ' ' PHE . . . . . . . . . . . . 0.321 24.5 t80 -117.9 112.46 20.37 Favored 'General case' 0 N--CA 1.43 -1.428 0 C-N-CA 127.653 2.381 . . . . 1.0 105.185 -156.875 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -126.45 165.55 18.88 Favored 'General case' 0 N--CA 1.431 -1.394 0 N-CA-C 107.574 -1.269 . . . . 1.0 107.574 -169.689 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 51.4 tp -112.06 124.81 53.21 Favored 'General case' 0 N--CA 1.43 -1.451 0 O-C-N 119.528 -1.982 . . . . 1.0 110.434 -169.963 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 6.2 tmtt? -74.64 -58.73 3.1 Favored 'General case' 0 N--CA 1.429 -1.478 0 O-C-N 121.322 -0.861 . . . . 1.0 109.599 162.277 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -179.3 -61.65 0.07 OUTLIER Glycine 0 N--CA 1.43 -1.716 0 O-C-N 121.098 -1.001 . . . . 1.0 111.551 179.033 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 24.1 t0 -99.32 -18.21 17.66 Favored 'General case' 0 N--CA 1.43 -1.425 0 C-N-CA 126.108 1.763 . . . . 1.0 110.141 179.075 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 1.1 tp10 -130.09 128.43 41.86 Favored 'General case' 0 N--CA 1.431 -1.415 0 N-CA-C 103.377 -2.823 . . . . 1.0 103.377 -170.711 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 78' ' ' TRP . . . . . . . . . . . . . 91.7 m95 -77.47 129.55 35.87 Favored 'General case' 0 N--CA 1.429 -1.481 0 N-CA-C 105.364 -2.088 . . . . 1.0 105.364 162.498 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 79' ' ' ILE . . . . . 0.455 ' HB ' ' HB2' ' A' ' 85' ' ' GLU . 0.1 OUTLIER -131.34 153.24 38.65 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.377 0 O-C-N 119.976 -1.703 . . . . 1.0 106.865 -173.876 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 5.2 m -80.55 132.37 35.65 Favored 'General case' 0 N--CA 1.429 -1.488 0 O-C-N 119.873 -1.767 . . . . 1.0 112.922 -172.378 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 81' ' ' ASP . . . . . 0.458 ' OD2' ' HE1' ' A' ' 70' ' ' HIS . 24.0 t70 -86.61 62.8 7.63 Favored 'General case' 0 N--CA 1.431 -1.42 0 O-C-N 118.928 -2.357 . . . . 1.0 110.932 177.32 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -155.71 -135.73 0.05 OUTLIER 'General case' 0 N--CA 1.43 -1.441 0 O-C-N 120.608 -1.307 . . . . 1.0 111.858 -176.027 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 35.1 p -86.0 -12.44 50.32 Favored 'General case' 0 N--CA 1.428 -1.551 0 O-C-N 119.347 -2.096 . . . . 1.0 113.887 -170.524 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -161.93 92.32 0.11 Allowed Glycine 0 N--CA 1.429 -1.768 0 O-C-N 120.684 -1.26 . . . . 1.0 113.331 -177.534 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 85' ' ' GLU . . . . . 0.455 ' HB2' ' HB ' ' A' ' 79' ' ' ILE . 8.2 pt-20 -77.55 113.41 15.35 Favored 'General case' 0 N--CA 1.431 -1.398 0 N-CA-C 119.014 2.968 . . . . 1.0 119.014 -169.845 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 86.1 m -174.46 125.25 0.31 Allowed 'General case' 0 N--CA 1.431 -1.422 0 C-N-CA 126.315 1.846 . . . . 1.0 110.574 161.775 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 2.0 t80 -52.77 -84.21 0.01 OUTLIER 'General case' 0 N--CA 1.429 -1.508 0 N-CA-C 115.378 1.621 . . . . 1.0 115.378 170.265 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 88' ' ' TRP . . . . . . . . . . . . . 56.0 m95 -58.95 -29.43 67.15 Favored 'General case' 0 N--CA 1.43 -1.445 0 N-CA-C 116.283 1.957 . . . . 1.0 116.283 -166.1 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 24.0 m-20 -76.99 -41.35 43.25 Favored 'General case' 0 N--CA 1.429 -1.479 0 C-N-CA 124.489 1.116 . . . . 1.0 112.254 175.668 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 41.9 tp -69.65 -43.23 73.03 Favored 'General case' 0 N--CA 1.43 -1.425 0 O-C-N 119.521 -1.987 . . . . 1.0 111.88 176.249 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 2.6 tm? -48.38 -50.69 29.71 Favored 'General case' 0 N--CA 1.43 -1.471 0 C-N-CA 128.941 2.896 . . . . 1.0 113.08 172.608 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 37.5 tt0 -51.66 -54.44 27.96 Favored 'General case' 0 N--CA 1.431 -1.423 0 C-N-CA 125.823 1.649 . . . . 1.0 114.547 166.852 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 4.1 tt0 -58.5 -44.73 89.54 Favored 'General case' 0 N--CA 1.43 -1.471 0 N-CA-C 114.372 1.249 . . . . 1.0 114.372 179.929 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -58.75 -48.49 81.03 Favored 'General case' 0 N--CA 1.431 -1.412 0 C-N-CA 127.53 2.332 . . . . 1.0 113.554 174.895 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -64.89 -46.56 81.24 Favored 'General case' 0 N--CA 1.429 -1.483 0 O-C-N 119.426 -2.046 . . . . 1.0 113.131 176.191 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 96.5 m -53.61 -48.89 68.87 Favored 'General case' 0 N--CA 1.431 -1.409 0 C-N-CA 127.224 2.21 . . . . 1.0 114.176 174.037 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 2.1 pt20 -70.18 -28.02 64.98 Favored 'General case' 0 N--CA 1.43 -1.45 0 O-C-N 121.061 -1.025 . . . . 1.0 113.607 -178.911 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 15.7 mm-40 -75.91 -39.02 57.13 Favored 'General case' 0 N--CA 1.43 -1.459 0 N-CA-C 114.309 1.226 . . . . 1.0 114.309 171.988 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -85.85 -46.58 10.49 Favored 'General case' 0 N--CA 1.43 -1.461 0 O-C-N 120.229 -1.545 . . . . 1.0 114.963 -176.436 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . 91.28 43.25 4.7 Favored Glycine 0 N--CA 1.43 -1.745 0 O-C-N 120.418 -1.426 . . . . 1.0 112.55 -170.825 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 18.6 tt0 -170.04 145.75 2.93 Favored 'General case' 0 N--CA 1.43 -1.455 0 N-CA-C 103.712 -2.699 . . . . 1.0 103.712 -172.865 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 13.4 m -74.49 99.95 3.72 Favored 'General case' 0 N--CA 1.429 -1.484 0 CA-C-N 121.792 2.087 . . . . 1.0 111.033 179.282 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 12.2 t -95.36 84.1 1.55 Allowed 'Isoleucine or valine' 0 N--CA 1.432 -1.362 0 CA-C-O 124.231 1.967 . . . . 1.0 107.953 178.769 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 8.2 t -92.36 177.07 6.25 Favored 'General case' 0 N--CA 1.43 -1.438 0 C-N-CA 125.718 1.607 . . . . 1.0 112.695 -168.259 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 30.8 t80 -138.58 -29.32 0.8 Allowed 'General case' 0 N--CA 1.43 -1.434 0 O-C-N 120.83 -1.169 . . . . 1.0 111.04 156.83 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 89.1 mtt180 . . . . . 0 C--O 1.26 1.634 0 O-C-N 120.368 -1.457 . . . . 1.0 110.437 179.27 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 26.4 mmt . . . . . 0 CA--C 1.49 -1.341 0 N-CA-C 113.682 0.994 . . . . 1.0 113.682 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 91.9 m-20 -118.24 57.95 0.83 Allowed 'General case' 0 N--CA 1.431 -1.416 0 O-C-N 120.766 -1.209 . . . . 1.0 109.995 -178.377 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 22.5 m-20 -65.78 -39.16 90.72 Favored 'General case' 0 N--CA 1.429 -1.477 0 C-N-CA 125.272 1.429 . . . . 1.0 113.581 179.131 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 8.6 t -65.07 -43.29 92.7 Favored 'General case' 0 N--CA 1.43 -1.473 0 O-C-N 120.951 -1.093 . . . . 1.0 111.786 -178.854 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 14.0 mt-10 -58.36 -60.83 3.16 Favored 'General case' 0 N--CA 1.429 -1.483 0 C-N-CA 124.694 1.197 . . . . 1.0 112.364 171.148 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 1.1 t80 -53.26 -38.48 63.06 Favored 'General case' 0 N--CA 1.43 -1.425 0 N-CA-C 115.911 1.819 . . . . 1.0 115.911 179.229 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 2.5 m-70 -61.18 -50.56 72.66 Favored 'General case' 0 N--CA 1.43 -1.439 0 N-CA-C 115.524 1.676 . . . . 1.0 115.524 170.224 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 23.1 ttm180 -67.81 -45.38 74.91 Favored 'General case' 0 N--CA 1.43 -1.47 0 C-N-CA 124.17 0.988 . . . . 1.0 112.207 -176.106 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 83.4 mt -55.26 -45.59 76.12 Favored 'General case' 0 N--CA 1.43 -1.464 0 C-N-CA 126.507 1.923 . . . . 1.0 113.611 172.367 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -56.84 -55.49 33.77 Favored 'General case' 0 N--CA 1.43 -1.467 0 C-N-CA 125.27 1.428 . . . . 1.0 113.152 173.949 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -56.3 -43.53 79.01 Favored 'General case' 0 N--CA 1.431 -1.415 0 C-N-CA 124.228 1.011 . . . . 1.0 112.617 -176.05 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 28.3 mm100 -63.4 -53.86 45.76 Favored 'General case' 0 N--CA 1.43 -1.441 0 N-CA-C 115.165 1.542 . . . . 1.0 115.165 173.846 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 2.4 pp -65.2 -47.18 77.79 Favored 'General case' 0 N--CA 1.43 -1.443 0 O-C-N 120.387 -1.446 . . . . 1.0 114.272 -177.697 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 39.8 m0 -52.87 -50.04 64.61 Favored 'General case' 0 N--CA 1.43 -1.468 0 C-N-CA 126.953 2.101 . . . . 1.0 113.447 174.256 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 44.0 tp -60.79 -49.34 77.87 Favored 'General case' 0 N--CA 1.429 -1.517 0 C-N-CA 123.651 0.78 . . . . 1.0 112.719 177.49 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 36.5 m -59.11 -53.15 61.63 Favored 'General case' 0 N--CA 1.431 -1.398 0 C-N-CA 125.818 1.647 . . . . 1.0 113.276 -178.676 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 78.8 mt -57.64 -54.1 35.87 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.464 0 C-N-CA 125.839 1.656 . . . . 1.0 114.169 174.989 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 31.8 tt0 -60.18 -48.42 81.82 Favored 'General case' 0 N--CA 1.429 -1.496 0 CA-C-N 120.072 1.306 . . . . 1.0 113.117 -177.774 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 42.9 tt0 -57.85 -48.57 79.41 Favored 'General case' 0 N--CA 1.429 -1.511 0 C-N-CA 125.102 1.361 . . . . 1.0 114.164 178.144 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -71.15 -29.64 65.48 Favored 'General case' 0 N--CA 1.43 -1.456 0 N-CA-C 113.056 0.761 . . . . 1.0 113.056 -177.548 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 5.3 tp -67.14 -50.92 59.59 Favored 'General case' 0 N--CA 1.43 -1.446 0 O-C-N 120.919 -1.113 . . . . 1.0 112.597 171.393 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 11.3 t70 -62.31 -36.42 82.1 Favored 'General case' 0 N--CA 1.429 -1.507 0 O-C-N 121.023 -1.048 . . . . 1.0 112.889 -177.425 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 21.2 t0 -90.81 21.89 3.88 Favored 'General case' 0 N--CA 1.43 -1.438 0 O-C-N 120.486 -1.384 . . . . 1.0 113.847 177.515 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 24' ' ' TRP . . . . . . . . . . . . . 47.0 t-105 -84.56 -59.7 2.29 Favored 'General case' 0 N--CA 1.43 -1.452 0 O-C-N 119.025 -2.297 . . . . 1.0 113.691 -179.445 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 7.0 t70 67.03 -132.0 0.14 Allowed 'General case' 0 N--CA 1.43 -1.453 0 C-N-CA 126.784 2.034 . . . . 1.0 112.603 -176.32 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 93.1 -138.38 14.09 Favored Glycine 0 N--CA 1.43 -1.709 0 O-C-N 120.737 -1.227 . . . . 1.0 112.691 176.116 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -82.23 -26.27 33.4 Favored 'General case' 0 N--CA 1.429 -1.489 0 O-C-N 120.592 -1.534 . . . . 1.0 109.79 172.589 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 4.4 p -75.36 144.27 42.4 Favored 'General case' 0 N--CA 1.429 -1.498 0 C-N-CA 126.506 1.923 . . . . 1.0 114.434 174.642 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . 0.41 ' H ' ' HG2' ' A' ' 44' ' ' GLU . 13.8 t70 -104.36 138.43 40.8 Favored 'General case' 0 N--CA 1.43 -1.469 0 N-CA-C 104.137 -2.542 . . . . 1.0 104.137 162.925 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -146.15 115.48 1.47 Allowed 'Isoleucine or valine' 0 N--CA 1.429 -1.481 0 CA-C-O 122.84 1.305 . . . . 1.0 108.62 -157.653 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 13.8 m-20 -126.47 143.3 51.24 Favored 'General case' 0 N--CA 1.429 -1.493 0 C-N-CA 124.103 0.961 . . . . 1.0 109.291 168.625 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 17.8 t -109.67 149.9 29.05 Favored 'General case' 0 N--CA 1.43 -1.432 0 O-C-N 119.832 -1.793 . . . . 1.0 108.203 164.627 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 17.2 mt-10 -113.65 142.39 46.06 Favored 'General case' 0 N--CA 1.429 -1.511 0 O-C-N 120.829 -1.169 . . . . 1.0 108.113 176.822 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 3.3 tp -122.47 110.34 26.62 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.484 0 CA-C-O 124.086 1.898 . . . . 1.0 107.259 -178.099 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 48.3 m-80 -108.95 73.75 0.87 Allowed 'General case' 0 N--CA 1.431 -1.396 0 CA-C-N 114.477 -1.238 . . . . 1.0 109.088 176.677 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . 73.35 -7.65 11.3 Favored Glycine 0 N--CA 1.43 -1.761 0 N-CA-C 117.618 1.807 . . . . 1.0 117.618 171.503 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 151.91 -33.7 0.87 Allowed Glycine 0 N--CA 1.43 -1.764 0 N-CA-C 109.127 -1.589 . . . . 1.0 109.127 -168.734 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 64.7 t -79.27 105.94 9.47 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.43 0 O-C-N 120.397 -1.649 . . . . 1.0 109.595 175.5 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 18.5 mt -94.8 129.16 41.87 Favored 'General case' 0 N--CA 1.43 -1.464 0 CA-C-O 123.074 1.416 . . . . 1.0 110.206 175.667 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 18.6 p -126.52 121.89 33.61 Favored 'General case' 0 N--CA 1.43 -1.455 0 N-CA-C 107.358 -1.349 . . . . 1.0 107.358 -179.713 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 74.2 mt -97.2 122.28 48.59 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.479 0 C-N-CA 124.721 1.208 . . . . 1.0 109.32 -169.866 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 21.8 p -123.74 108.38 12.46 Favored 'General case' 0 N--CA 1.431 -1.396 0 N-CA-C 114.863 1.431 . . . . 1.0 114.863 -171.55 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 43' ' ' PHE . . . . . . . . . . . . . 9.0 p90 -114.55 164.86 13.42 Favored 'General case' 0 N--CA 1.429 -1.49 0 O-C-N 119.633 -1.917 . . . . 1.0 113.894 178.75 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . 0.41 ' HG2' ' H ' ' A' ' 29' ' ' ASP . 0.5 OUTLIER -61.76 -20.18 63.27 Favored 'General case' 0 N--CA 1.43 -1.442 0 C-N-CA 128.77 2.828 . . . . 1.0 118.371 -166.779 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 22.5 t30 -66.69 -15.08 63.26 Favored 'General case' 0 N--CA 1.429 -1.491 0 C-N-CA 124.674 1.19 . . . . 1.0 113.618 173.583 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 101.48 -5.25 54.72 Favored Glycine 0 N--CA 1.431 -1.686 0 O-C-N 120.508 -1.37 . . . . 1.0 113.066 171.197 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 70.0 m -93.73 159.28 15.28 Favored 'General case' 0 N--CA 1.43 -1.425 0 O-C-N 121.467 -1.02 . . . . 1.0 111.33 178.493 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 24.0 pttm -142.29 140.08 32.08 Favored 'General case' 0 N--CA 1.429 -1.497 0 O-C-N 121.526 -0.734 . . . . 1.0 111.566 -178.784 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -108.45 143.95 17.88 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.453 0 C-N-CA 126.701 2.0 . . . . 1.0 107.572 179.549 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 9.7 mm -126.38 122.43 61.21 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.458 0 C-N-CA 124.227 1.011 . . . . 1.0 110.816 -163.33 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 3.7 mt -124.61 108.18 19.79 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.428 0 CA-C-O 123.328 1.537 . . . . 1.0 112.874 -179.77 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 52' ' ' ASN . . . . . 0.444 ' H ' ' HD1' ' A' ' 61' ' ' TRP . 29.1 m-80 -120.44 160.63 22.73 Favored 'General case' 0 N--CA 1.429 -1.481 0 C-N-CA 128.224 2.61 . . . . 1.0 108.445 173.497 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 10.3 ptt180 -141.68 140.21 33.15 Favored 'General case' 0 N--CA 1.43 -1.453 0 C-N-CA 124.713 1.205 . . . . 1.0 111.737 174.083 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 24.6 mm100 -110.02 114.46 28.01 Favored 'General case' 0 N--CA 1.431 -1.406 0 C-N-CA 126.004 1.722 . . . . 1.0 108.522 174.558 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 54.8 mt-10 -48.09 -47.48 65.37 Favored Pre-proline 0 N--CA 1.431 -1.414 0 N-CA-C 119.479 3.14 . . . . 1.0 119.479 -175.548 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 50.9 Cg_exo -73.01 -11.41 25.4 Favored 'Trans proline' 0 N--CA 1.434 -2.021 0 CA-C-N 126.022 3.186 . . . . 1.0 114.829 -175.468 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 38.5 mt -84.18 -39.67 19.09 Favored 'General case' 0 N--CA 1.43 -1.443 0 CA-C-N 119.269 0.941 . . . . 1.0 111.191 -174.977 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 19.8 m80 71.33 23.73 3.91 Favored 'General case' 0 CA--C 1.488 -1.433 0 C-N-CA 125.448 1.499 . . . . 1.0 113.866 -179.423 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 1.7 pt20 -131.32 156.58 45.24 Favored 'General case' 0 N--CA 1.429 -1.483 0 C-N-CA 127.898 2.479 . . . . 1.0 106.072 172.903 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 48.0 t -116.41 158.19 16.98 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.43 0 O-C-N 121.185 -0.947 . . . . 1.0 108.687 -171.732 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 61' ' ' TRP . . . . . 0.444 ' HD1' ' H ' ' A' ' 52' ' ' ASN . 0.0 OUTLIER -101.67 152.55 20.7 Favored 'General case' 0 N--CA 1.43 -1.436 0 O-C-N 119.831 -1.793 . . . . 1.0 114.194 176.018 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 93.7 mt -125.83 97.99 5.36 Favored 'General case' 0 N--CA 1.428 -1.55 0 C-N-CA 125.957 1.703 . . . . 1.0 109.056 164.71 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . 0.406 ' HA ' ' HA2' ' A' ' 68' ' ' GLY . . . -94.49 141.75 28.23 Favored 'General case' 0 N--CA 1.43 -1.44 0 O-C-N 120.285 -1.509 . . . . 1.0 110.478 167.451 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 64' ' ' THR . . . . . . . . . . . . . 74.5 p -142.49 -119.71 0.1 Allowed 'General case' 0 N--CA 1.43 -1.452 0 C-N-CA 124.79 1.236 . . . . 1.0 108.223 -165.43 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 3.5 tmtt? -101.53 -40.83 6.85 Favored 'General case' 0 N--CA 1.431 -1.419 0 O-C-N 120.503 -1.373 . . . . 1.0 109.717 170.134 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 51.2 tt0 -74.22 -25.93 59.95 Favored 'General case' 0 N--CA 1.429 -1.484 0 N-CA-C 116.863 2.171 . . . . 1.0 116.863 -164.101 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 157.7 -34.99 0.54 Allowed Glycine 0 N--CA 1.43 -1.728 0 O-C-N 119.585 -1.947 . . . . 1.0 115.65 175.501 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . 0.406 ' HA2' ' HA ' ' A' ' 63' ' ' ALA . . . 117.17 115.05 2.76 Favored Glycine 0 N--CA 1.429 -1.775 0 C-N-CA 125.625 1.583 . . . . 1.0 112.806 -179.19 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -104.34 142.81 33.9 Favored 'General case' 0 N--CA 1.43 -1.445 0 C-N-CA 125.498 1.519 . . . . 1.0 106.963 175.444 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 3.4 p-80 -109.25 152.79 24.74 Favored 'General case' 0 N--CA 1.43 -1.438 0 O-C-N 119.082 -2.262 . . . . 1.0 110.545 165.68 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 48.8 p90 -129.77 131.37 46.21 Favored 'General case' 0 N--CA 1.43 -1.472 0 N-CA-C 113.975 1.102 . . . . 1.0 113.975 -166.068 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 32.7 m-20 -110.01 169.7 8.55 Favored 'General case' 0 N--CA 1.429 -1.49 0 C-N-CA 126.356 1.863 . . . . 1.0 109.21 -176.197 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 50.9 tp -115.97 114.22 24.32 Favored 'General case' 0 N--CA 1.43 -1.447 0 O-C-N 119.984 -1.698 . . . . 1.0 110.584 -178.164 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 18.5 mttm -71.05 -60.21 2.36 Favored 'General case' 0 N--CA 1.431 -1.408 0 O-C-N 120.124 -1.61 . . . . 1.0 112.984 164.729 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -171.56 -73.65 0.04 OUTLIER Glycine 0 N--CA 1.429 -1.775 0 O-C-N 120.622 -1.299 . . . . 1.0 113.518 -179.38 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 4.2 t70 -107.34 26.98 9.54 Favored 'General case' 0 N--CA 1.43 -1.45 0 CA-C-O 123.141 1.448 . . . . 1.0 107.831 174.615 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 1.7 pm0 -161.19 116.71 2.14 Favored 'General case' 0 N--CA 1.43 -1.427 0 N-CA-C 105.205 -2.146 . . . . 1.0 105.205 -168.949 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 78' ' ' TRP . . . . . . . . . . . . . 97.0 m95 -80.95 130.51 35.06 Favored 'General case' 0 N--CA 1.429 -1.505 0 N-CA-C 105.011 -2.218 . . . . 1.0 105.011 162.206 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -126.36 135.32 64.14 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.482 0 O-C-N 119.529 -1.982 . . . . 1.0 108.041 -171.325 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 30.1 m -84.38 122.14 28.52 Favored 'General case' 0 N--CA 1.43 -1.46 0 O-C-N 120.05 -1.656 . . . . 1.0 114.553 -171.275 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 13.2 t70 -84.86 55.21 3.36 Favored 'General case' 0 N--CA 1.429 -1.489 0 O-C-N 119.757 -1.84 . . . . 1.0 112.608 -177.228 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 1.1 tmt_? -148.38 81.7 1.47 Allowed 'General case' 0 N--CA 1.43 -1.428 0 O-C-N 120.36 -1.463 . . . . 1.0 107.347 179.884 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 83' ' ' SER . . . . . . . . . . . . 0.268 16.3 m 79.23 -44.69 0.34 Allowed 'General case' 0 N--CA 1.429 -1.488 0 C-N-CA 127.397 2.279 . . . . 1.0 116.754 175.117 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -159.48 103.19 0.22 Allowed Glycine 0 N--CA 1.431 -1.693 0 N-CA-C 109.128 -1.589 . . . . 1.0 109.128 -167.063 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 1.8 pm0 -87.43 105.97 17.65 Favored 'General case' 0 N--CA 1.429 -1.521 0 N-CA-C 119.424 3.12 . . . . 1.0 119.424 -153.421 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 7.3 m -160.74 122.53 3.08 Favored 'General case' 0 N--CA 1.43 -1.434 0 O-C-N 118.8 -2.438 . . . . 1.0 112.34 174.823 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 41.5 t80 -63.35 -80.17 0.03 OUTLIER 'General case' 0 N--CA 1.43 -1.46 0 N-CA-C 117.254 2.316 . . . . 1.0 117.254 -176.614 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 88' ' ' TRP . . . . . . . . . . . . . 72.6 m95 -63.21 -24.46 67.89 Favored 'General case' 0 N--CA 1.43 -1.432 0 O-C-N 120.442 -1.411 . . . . 1.0 113.892 -169.809 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 1.3 t70 -79.37 -42.76 24.86 Favored 'General case' 0 N--CA 1.428 -1.531 0 C-N-CA 125.87 1.668 . . . . 1.0 113.049 178.568 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 38.5 tp -69.49 -40.2 77.19 Favored 'General case' 0 N--CA 1.431 -1.417 0 O-C-N 119.137 -2.227 . . . . 1.0 111.135 175.514 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 21.4 tp -51.37 -41.4 60.62 Favored 'General case' 0 N--CA 1.43 -1.434 0 C-N-CA 126.926 2.09 . . . . 1.0 114.85 168.049 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 2.0 tm-20 -61.33 -46.42 90.32 Favored 'General case' 0 N--CA 1.43 -1.426 0 C-N-CA 125.627 1.571 . . . . 1.0 113.31 171.085 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 15.4 tt0 -60.96 -46.04 92.31 Favored 'General case' 0 N--CA 1.429 -1.477 0 O-C-N 120.785 -1.197 . . . . 1.0 113.09 176.209 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -58.16 -36.99 73.82 Favored 'General case' 0 N--CA 1.43 -1.425 0 C-N-CA 127.001 2.12 . . . . 1.0 114.703 172.101 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 95' ' ' ALA . . . . . 0.585 ' HB1' ' HB ' ' A' ' 103' ' ' VAL . . . -75.31 -41.34 57.14 Favored 'General case' 0 N--CA 1.428 -1.542 0 O-C-N 119.787 -1.821 . . . . 1.0 113.09 178.42 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 29.8 m -58.23 -28.5 64.92 Favored 'General case' 0 N--CA 1.429 -1.509 0 C-N-CA 126.809 2.044 . . . . 1.0 112.954 169.912 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -69.94 -55.93 8.37 Favored 'General case' 0 N--CA 1.431 -1.413 0 C-N-CA 127.706 2.402 . . . . 1.0 111.891 171.672 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 47.5 mt-30 -75.14 -40.47 59.64 Favored 'General case' 0 N--CA 1.43 -1.453 0 N-CA-C 115.829 1.788 . . . . 1.0 115.829 -175.868 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -81.24 -36.02 30.48 Favored 'General case' 0 N--CA 1.431 -1.402 0 O-C-N 120.376 -1.453 . . . . 1.0 112.619 -179.241 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . 79.44 36.0 27.89 Favored Glycine 0 N--CA 1.429 -1.824 0 O-C-N 120.972 -1.08 . . . . 1.0 111.782 -173.551 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 19.4 tt0 -170.79 145.98 2.52 Favored 'General case' 0 N--CA 1.429 -1.496 0 N-CA-C 103.93 -2.619 . . . . 1.0 103.93 -168.911 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 57.4 m -72.25 97.12 1.93 Allowed 'General case' 0 N--CA 1.429 -1.476 0 CA-C-N 120.851 1.66 . . . . 1.0 111.883 178.957 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 103' ' ' VAL . . . . . 0.585 ' HB ' ' HB1' ' A' ' 95' ' ' ALA . 85.6 t -95.91 106.7 18.65 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.434 0 N-CA-C 106.314 -1.735 . . . . 1.0 106.314 171.802 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 35.6 p -132.24 136.89 47.3 Favored 'General case' 0 N--CA 1.429 -1.497 0 C-N-CA 124.171 0.988 . . . . 1.0 109.995 -171.862 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 37.2 m-85 -93.68 -10.35 34.75 Favored 'General case' 0 N--CA 1.43 -1.429 0 C-N-CA 124.265 1.026 . . . . 1.0 112.129 178.904 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 9.7 mmm180 . . . . . 0 C--O 1.26 1.63 0 C-N-CA 124.489 1.116 . . . . 1.0 109.332 177.582 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 26.5 mmt . . . . . 0 CA--C 1.49 -1.361 0 CA-C-O 121.369 0.604 . . . . 1.0 110.964 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 7.1 p30 -93.27 -51.21 5.11 Favored 'General case' 0 N--CA 1.43 -1.458 0 O-C-N 120.185 -1.572 . . . . 1.0 113.842 -170.172 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 35.3 t70 -55.92 -40.08 72.59 Favored 'General case' 0 N--CA 1.429 -1.479 0 C-N-CA 127.125 2.17 . . . . 1.0 113.46 -178.543 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 5.2 p -68.49 -37.94 80.55 Favored 'General case' 0 N--CA 1.43 -1.467 0 C-N-CA 126.274 1.83 . . . . 1.0 114.359 174.972 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 14.2 tp10 -67.74 -53.06 30.44 Favored 'General case' 0 N--CA 1.43 -1.435 0 C-N-CA 125.226 1.41 . . . . 1.0 110.115 177.925 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 16.3 t80 -47.25 -50.94 20.17 Favored 'General case' 0 N--CA 1.431 -1.425 0 C-N-CA 127.425 2.29 . . . . 1.0 114.821 169.657 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 35.2 m-70 -63.97 -41.43 97.56 Favored 'General case' 0 N--CA 1.43 -1.452 0 N-CA-C 114.907 1.447 . . . . 1.0 114.907 177.989 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -70.76 -37.19 73.38 Favored 'General case' 0 N--CA 1.43 -1.435 0 O-C-N 120.366 -1.459 . . . . 1.0 114.074 178.887 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 79.7 mt -59.58 -51.55 69.37 Favored 'General case' 0 N--CA 1.43 -1.444 0 C-N-CA 124.99 1.316 . . . . 1.0 111.747 168.239 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -54.06 -50.34 66.95 Favored 'General case' 0 N--CA 1.431 -1.416 0 C-N-CA 125.011 1.324 . . . . 1.0 113.458 176.991 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -51.58 -49.71 61.57 Favored 'General case' 0 N--CA 1.43 -1.425 0 N-CA-C 114.783 1.401 . . . . 1.0 114.783 173.136 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 12.2 pt20 -68.9 -33.27 73.49 Favored 'General case' 0 N--CA 1.43 -1.433 0 N-CA-C 115.583 1.697 . . . . 1.0 115.583 179.764 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 84.8 mt -66.74 -59.07 3.89 Favored 'General case' 0 N--CA 1.431 -1.419 0 O-C-N 120.087 -1.633 . . . . 1.0 111.02 174.753 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 1.2 m-90 -50.3 -50.11 51.58 Favored 'General case' 0 N--CA 1.429 -1.487 0 C-N-CA 125.65 1.58 . . . . 1.0 113.27 -179.565 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 41.0 tp -61.85 -59.05 5.71 Favored 'General case' 0 N--CA 1.43 -1.447 0 N-CA-C 113.626 0.973 . . . . 1.0 113.626 175.775 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 59.6 m -64.88 -37.42 87.58 Favored 'General case' 0 N--CA 1.431 -1.4 0 N-CA-C 114.252 1.204 . . . . 1.0 114.252 -173.621 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 93.5 mt -64.63 -54.24 32.7 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.458 0 C-N-CA 124.923 1.289 . . . . 1.0 111.686 174.83 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 1.7 tt0 -55.48 -49.66 71.94 Favored 'General case' 0 N--CA 1.43 -1.473 0 C-N-CA 123.984 0.914 . . . . 1.0 113.386 178.565 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 44.4 tt0 -54.65 -49.1 71.38 Favored 'General case' 0 N--CA 1.429 -1.493 0 C-N-CA 125.966 1.706 . . . . 1.0 114.025 174.173 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 7.4 tpm_? -58.95 -45.92 89.29 Favored 'General case' 0 N--CA 1.431 -1.406 0 O-C-N 120.726 -1.234 . . . . 1.0 114.291 179.818 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 3.8 pp -83.51 -26.97 29.71 Favored 'General case' 0 N--CA 1.431 -1.384 0 N-CA-C 115.097 1.517 . . . . 1.0 115.097 -177.387 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 8.7 t70 -62.71 -34.09 76.44 Favored 'General case' 0 CA--C 1.488 -1.405 0 O-C-N 120.336 -1.478 . . . . 1.0 113.342 163.591 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 19.2 t70 -70.59 -55.08 9.65 Favored 'General case' 0 N--CA 1.43 -1.472 0 C-N-CA 126.201 1.8 . . . . 1.0 114.559 178.405 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 24' ' ' TRP . . . . . . . . . . . . . 32.4 t-105 -73.03 138.68 46.11 Favored 'General case' 0 N--CA 1.43 -1.456 0 O-C-N 120.703 -1.248 . . . . 1.0 113.104 -172.643 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 63.3 m-20 -84.16 -141.33 0.07 Allowed 'General case' 0 N--CA 1.431 -1.408 0 O-C-N 120.327 -1.483 . . . . 1.0 112.054 177.519 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 164.3 -164.8 36.9 Favored Glycine 0 N--CA 1.431 -1.664 0 O-C-N 118.592 -2.568 . . . . 1.0 114.181 -175.221 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 37.4 t70 -86.84 -53.43 4.92 Favored 'General case' 0 N--CA 1.43 -1.463 0 C-N-CA 125.238 1.415 . . . . 1.0 107.911 169.242 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 4.5 t -82.7 -176.48 6.3 Favored 'General case' 0 N--CA 1.431 -1.414 0 C-N-CA 125.728 1.611 . . . . 1.0 109.691 178.94 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 32.9 t0 -99.85 178.63 4.76 Favored 'General case' 0 N--CA 1.43 -1.449 0 O-C-N 120.26 -1.525 . . . . 1.0 108.142 175.218 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 9.3 tp -152.26 126.58 1.41 Allowed 'Isoleucine or valine' 0 N--CA 1.43 -1.431 0 N-CA-C 106.936 -1.505 . . . . 1.0 106.936 -173.974 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 28.4 t70 -131.73 119.07 20.82 Favored 'General case' 0 N--CA 1.43 -1.439 0 CA-C-O 122.956 1.36 . . . . 1.0 109.13 163.299 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 17.3 p -86.21 131.17 34.3 Favored 'General case' 0 N--CA 1.43 -1.445 0 O-C-N 120.088 -1.632 . . . . 1.0 111.228 174.349 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 41.0 mm-40 -100.06 137.5 38.42 Favored 'General case' 0 N--CA 1.429 -1.488 0 C-N-CA 124.708 1.203 . . . . 1.0 108.916 174.651 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 3.5 tp -127.42 114.1 34.79 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.407 0 CA-C-O 124.046 1.879 . . . . 1.0 106.245 178.81 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 1.6 t-20 -125.81 179.98 4.93 Favored 'General case' 0 N--CA 1.43 -1.427 0 C-N-CA 124.805 1.242 . . . . 1.0 107.828 176.663 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -71.36 87.36 0.41 Allowed Glycine 0 N--CA 1.431 -1.653 0 O-C-N 120.566 -1.334 . . . . 1.0 115.898 -168.657 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 82.2 23.57 56.67 Favored Glycine 0 N--CA 1.429 -1.792 0 C-N-CA 125.379 1.466 . . . . 1.0 112.526 -171.889 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 61.8 t -138.84 135.05 42.92 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.475 0 CA-C-N 118.307 1.053 . . . . 1.0 109.109 -173.253 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 31.1 mt -118.07 142.01 47.86 Favored 'General case' 0 N--CA 1.43 -1.427 0 CA-C-O 122.919 1.343 . . . . 1.0 108.799 166.273 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -138.49 111.3 7.71 Favored 'General case' 0 N--CA 1.43 -1.426 0 O-C-N 120.422 -1.424 . . . . 1.0 108.436 178.032 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 70.3 mt -96.83 105.41 17.07 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.467 0 N-CA-C 107.362 -1.347 . . . . 1.0 107.362 -165.859 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 14.0 m -118.44 131.2 56.28 Favored 'General case' 0 N--CA 1.43 -1.457 0 CA-C-N 118.896 0.771 . . . . 1.0 112.994 -163.053 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 43' ' ' PHE . . . . . . . . . . . . . 1.4 m-85 -99.56 173.68 6.61 Favored 'General case' 0 N--CA 1.43 -1.431 0 O-C-N 120.608 -1.308 . . . . 1.0 111.193 -179.381 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -71.77 -19.03 62.08 Favored 'General case' 0 N--CA 1.429 -1.481 0 O-C-N 119.219 -2.175 . . . . 1.0 113.476 -179.466 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 29.0 t-20 -67.21 -17.97 65.05 Favored 'General case' 0 N--CA 1.429 -1.502 0 C-N-CA 126.811 2.044 . . . . 1.0 113.512 170.731 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 92.34 -14.9 63.5 Favored Glycine 0 N--CA 1.43 -1.74 0 O-C-N 119.962 -1.712 . . . . 1.0 113.683 179.666 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 13.8 m -77.8 167.86 20.86 Favored 'General case' 0 N--CA 1.431 -1.425 0 O-C-N 121.082 -1.246 . . . . 1.0 111.077 172.943 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 12.9 ptpt -169.93 157.68 6.82 Favored 'General case' 0 N--CA 1.43 -1.439 0 O-C-N 121.156 -0.965 . . . . 1.0 113.07 -162.668 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 5.3 mm -101.54 137.11 30.39 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.438 0 C-N-CA 125.791 1.636 . . . . 1.0 107.389 171.823 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 16.1 mm -111.17 116.85 53.61 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.437 0 C-N-CA 125.032 1.333 . . . . 1.0 109.382 -178.013 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 3.0 mt -125.43 124.76 67.68 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.506 0 O-C-N 120.717 -1.239 . . . . 1.0 110.695 179.297 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 52' ' ' ASN . . . . . 0.481 ' H ' ' HD1' ' A' ' 61' ' ' TRP . 26.6 t30 -162.52 172.93 14.7 Favored 'General case' 0 N--CA 1.43 -1.471 0 N-CA-C 103.142 -2.91 . . . . 1.0 103.142 -172.815 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 1.9 ptm180 -139.76 150.57 44.93 Favored 'General case' 0 N--CA 1.429 -1.524 0 CA-C-O 122.546 1.165 . . . . 1.0 112.337 -158.913 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 15.8 mm-40 -107.16 -108.42 0.31 Allowed 'General case' 0 N--CA 1.43 -1.448 0 C-N-CA 124.653 1.181 . . . . 1.0 109.562 -167.173 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 33.2 mm-40 -79.23 135.75 57.6 Favored Pre-proline 0 N--CA 1.43 -1.446 0 CA-C-O 117.718 -1.134 . . . . 1.0 112.799 -172.041 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 98.5 Cg_endo -73.45 62.69 4.46 Favored 'Trans proline' 0 N--CA 1.434 -1.999 0 C-N-CA 123.277 2.651 . . . . 1.0 112.319 162.997 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . 0.432 ' O ' ' HD2' ' A' ' 58' ' ' HIS . 73.1 mt -120.32 -103.0 0.41 Allowed 'General case' 0 N--CA 1.429 -1.493 0 N-CA-C 102.841 -3.022 . . . . 1.0 102.841 164.483 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 58' ' ' HIS . . . . . 0.432 ' HD2' ' O ' ' A' ' 57' ' ' LEU . 42.0 m170 -132.47 92.02 3.01 Favored 'General case' 0 N--CA 1.429 -1.489 0 N-CA-C 106.622 -1.622 . . . . 1.0 106.622 159.412 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 22.1 tt0 -158.68 122.05 3.84 Favored 'General case' 0 N--CA 1.429 -1.516 0 CA-C-N 121.687 2.04 . . . . 1.0 114.161 173.005 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 86.4 t -133.36 157.57 42.63 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.451 0 C-N-CA 127.031 2.132 . . . . 1.0 109.437 -179.013 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 61' ' ' TRP . . . . . 0.481 ' HD1' ' H ' ' A' ' 52' ' ' ASN . 0.0 OUTLIER -111.36 156.06 22.16 Favored 'General case' 0 N--CA 1.429 -1.505 0 C-N-CA 127.867 2.467 . . . . 1.0 109.755 -174.169 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . 0.277 2.3 pt? -150.91 134.01 16.03 Favored 'General case' 0 N--CA 1.432 -1.364 0 CA-C-N 120.686 1.584 . . . . 1.0 113.916 150.939 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -120.08 147.29 45.03 Favored 'General case' 0 N--CA 1.429 -1.514 0 C-N-CA 125.367 1.467 . . . . 1.0 114.429 -179.557 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 64' ' ' THR . . . . . . . . . . . . . 12.5 t -153.96 -149.52 0.29 Allowed 'General case' 0 N--CA 1.429 -1.509 0 C-N-CA 126.745 2.018 . . . . 1.0 112.388 -172.694 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 5.6 tmtm? -63.56 -53.57 49.64 Favored 'General case' 0 N--CA 1.43 -1.456 0 C-N-CA 130.116 3.366 . . . . 1.0 114.362 -174.404 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 31.3 tt0 -82.24 2.19 33.02 Favored 'General case' 0 N--CA 1.429 -1.492 0 CA-C-O 122.581 1.181 . . . . 1.0 111.602 -177.008 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 117.5 -72.92 0.29 Allowed Glycine 0 N--CA 1.43 -1.732 0 N-CA-C 107.343 -2.303 . . . . 1.0 107.343 -177.4 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 106.06 -173.43 19.85 Favored Glycine 0 N--CA 1.43 -1.733 0 C-N-CA 124.229 0.918 . . . . 1.0 112.486 -176.382 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -162.05 169.83 20.29 Favored 'General case' 0 N--CA 1.431 -1.423 0 N-CA-C 107.284 -1.376 . . . . 1.0 107.284 -173.008 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 19.8 p80 -79.87 159.9 26.25 Favored 'General case' 0 N--CA 1.431 -1.422 0 O-C-N 119.775 -1.828 . . . . 1.0 114.653 174.504 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 71' ' ' PHE . . . . . . . . . . . . 0.3 72.3 t80 -112.21 113.77 26.2 Favored 'General case' 0 N--CA 1.431 -1.402 0 C-N-CA 127.744 2.418 . . . . 1.0 107.019 -158.565 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 5.7 m-20 -134.12 155.1 50.66 Favored 'General case' 0 N--CA 1.43 -1.459 0 CA-C-O 121.851 0.834 . . . . 1.0 110.546 -173.99 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 8.0 tt -97.37 133.53 41.84 Favored 'General case' 0 N--CA 1.431 -1.42 0 O-C-N 119.68 -1.888 . . . . 1.0 111.869 -166.677 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 53.5 tttm -101.81 -56.39 2.29 Favored 'General case' 0 N--CA 1.43 -1.471 0 O-C-N 120.823 -1.173 . . . . 1.0 109.556 174.539 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -157.03 -96.91 0.12 Allowed Glycine 0 N--CA 1.431 -1.677 0 O-C-N 121.035 -1.041 . . . . 1.0 111.346 175.863 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 27.9 m-20 -89.72 16.31 8.17 Favored 'General case' 0 N--CA 1.429 -1.479 0 O-C-N 121.047 -1.266 . . . . 1.0 111.405 179.94 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 32.9 tt0 -166.02 132.83 2.66 Favored 'General case' 0 N--CA 1.43 -1.427 0 N-CA-C 102.046 -3.316 . . . . 1.0 102.046 -161.484 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 78' ' ' TRP . . . . . . . . . . . . . 50.2 m95 -87.75 144.88 26.39 Favored 'General case' 0 N--CA 1.432 -1.37 0 N-CA-C 106.322 -1.732 . . . . 1.0 106.322 175.186 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 9.4 pt -102.35 167.54 2.33 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.485 0 N-CA-C 106.618 -1.623 . . . . 1.0 106.618 174.083 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 1.4 m -89.79 135.65 33.5 Favored 'General case' 0 N--CA 1.429 -1.484 0 O-C-N 120.195 -1.565 . . . . 1.0 107.193 155.29 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 36.8 t70 -59.94 -38.87 83.66 Favored 'General case' 0 N--CA 1.43 -1.447 0 CA-C-N 120.689 1.586 . . . . 1.0 115.069 -174.238 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -9.85 -84.34 0.0 OUTLIER 'General case' 0 N--CA 1.43 -1.467 0 C-N-CA 131.628 3.971 . . . . 1.0 118.457 176.634 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 58.8 m -111.19 -12.79 14.09 Favored 'General case' 0 CA--C 1.489 -1.371 0 O-C-N 120.485 -1.384 . . . . 1.0 109.588 158.126 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 115.85 76.41 0.63 Allowed Glycine 0 N--CA 1.43 -1.763 0 N-CA-C 108.041 -2.023 . . . . 1.0 108.041 -173.509 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 5.2 mm-40 -100.74 -136.4 0.31 Allowed 'General case' 0 N--CA 1.431 -1.419 0 N-CA-C 109.141 -0.688 . . . . 1.0 109.141 -175.583 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 95.5 m -154.2 133.95 12.94 Favored 'General case' 0 N--CA 1.43 -1.445 0 O-C-N 120.156 -1.59 . . . . 1.0 110.402 -171.317 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 1.1 t80 -38.02 -92.13 0.0 OUTLIER 'General case' 0 CA--C 1.489 -1.375 0 C-N-CA 128.432 2.693 . . . . 1.0 115.842 168.895 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 88' ' ' TRP . . . . . . . . . . . . . 50.7 m95 -63.16 -32.69 74.14 Favored 'General case' 0 N--CA 1.431 -1.419 0 C-N-CA 125.649 1.58 . . . . 1.0 113.454 -167.195 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 35.7 t70 -77.96 -42.94 31.24 Favored 'General case' 0 N--CA 1.43 -1.456 0 C-N-CA 125.088 1.355 . . . . 1.0 113.027 -175.898 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 35.0 tp -75.3 -38.9 60.08 Favored 'General case' 0 N--CA 1.43 -1.46 0 O-C-N 119.427 -2.045 . . . . 1.0 111.332 179.335 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 41.9 tp -54.78 -38.64 67.51 Favored 'General case' 0 N--CA 1.43 -1.427 0 C-N-CA 126.33 1.852 . . . . 1.0 113.626 168.106 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 3.4 tm-20 -56.85 -59.9 4.35 Favored 'General case' 0 N--CA 1.429 -1.506 0 C-N-CA 124.611 1.164 . . . . 1.0 112.043 165.875 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 35.9 mt-30 -51.92 -41.81 62.29 Favored 'General case' 0 N--CA 1.43 -1.425 0 N-CA-C 116.28 1.956 . . . . 1.0 116.28 177.394 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -59.19 -58.39 8.84 Favored 'General case' 0 N--CA 1.43 -1.473 0 C-N-CA 126.523 1.929 . . . . 1.0 113.906 172.424 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -62.77 -49.11 76.3 Favored 'General case' 0 N--CA 1.429 -1.507 0 O-C-N 120.41 -1.431 . . . . 1.0 113.446 179.783 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 66.1 m -48.18 -47.55 35.11 Favored 'General case' 0 N--CA 1.43 -1.437 0 C-N-CA 127.859 2.464 . . . . 1.0 114.913 170.501 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 6.6 pt20 -73.4 -30.93 63.59 Favored 'General case' 0 N--CA 1.43 -1.441 0 O-C-N 120.306 -1.496 . . . . 1.0 114.428 -179.222 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 49.7 mt-30 -81.03 -37.93 28.3 Favored 'General case' 0 N--CA 1.431 -1.379 0 O-C-N 120.323 -1.486 . . . . 1.0 113.868 174.715 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -79.42 -42.76 24.73 Favored 'General case' 0 N--CA 1.43 -1.456 0 O-C-N 120.32 -1.488 . . . . 1.0 114.98 -179.686 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . 106.98 17.75 11.35 Favored Glycine 0 N--CA 1.431 -1.695 0 O-C-N 120.683 -1.261 . . . . 1.0 115.762 175.408 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 4.9 tt0 -162.41 152.78 16.81 Favored 'General case' 0 N--CA 1.43 -1.455 0 N-CA-C 104.946 -2.242 . . . . 1.0 104.946 179.527 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 35.1 m -53.48 108.31 0.33 Allowed 'General case' 0 N--CA 1.43 -1.463 0 C-N-CA 125.238 1.415 . . . . 1.0 114.571 175.317 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 49.0 t -89.43 110.49 21.69 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.414 0 CA-C-O 123.258 1.504 . . . . 1.0 108.244 176.892 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 61.5 m -94.19 98.98 11.33 Favored 'General case' 0 N--CA 1.43 -1.46 0 N-CA-C 113.615 0.968 . . . . 1.0 113.615 -162.525 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 88.5 m-85 -89.17 -32.91 17.24 Favored 'General case' 0 N--CA 1.429 -1.485 0 O-C-N 120.961 -1.087 . . . . 1.0 112.884 176.738 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 30.7 mmt180 . . . . . 0 C--O 1.26 1.647 0 N-CA-C 107.3 -1.37 . . . . 1.0 107.3 172.78 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 14.1 ttt . . . . . 0 CA--C 1.489 -1.373 0 CA-C-O 121.891 0.853 . . . . 0.0 110.883 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 62.2 t30 -162.75 163.63 26.67 Favored 'General case' 0 N--CA 1.43 -1.438 0 O-C-N 120.177 -1.577 . . . . 0.0 109.979 -164.028 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 31.1 t70 -64.61 -54.92 24.39 Favored 'General case' 0 N--CA 1.429 -1.48 0 C-N-CA 126.701 2.0 . . . . 0.0 113.678 -175.513 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 9.5 t -65.71 -35.25 80.21 Favored 'General case' 0 N--CA 1.429 -1.479 0 O-C-N 120.066 -1.646 . . . . 0.0 112.696 178.392 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 6.6 tp10 -60.51 -54.93 39.61 Favored 'General case' 0 N--CA 1.431 -1.424 0 C-N-CA 125.433 1.493 . . . . 0.0 112.446 175.616 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 23.2 t80 -46.12 -50.46 15.4 Favored 'General case' 0 N--CA 1.428 -1.54 0 C-N-CA 126.504 1.922 . . . . 0.0 115.2 168.89 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 34.1 t60 -67.56 -46.01 73.96 Favored 'General case' 0 N--CA 1.429 -1.5 0 O-C-N 121.189 -0.944 . . . . 0.0 113.125 179.775 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 51.1 ttt180 -63.04 -45.82 90.43 Favored 'General case' 0 N--CA 1.431 -1.384 0 O-C-N 120.872 -1.142 . . . . 0.0 113.268 -178.224 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 76.8 mt -58.66 -48.08 82.29 Favored 'General case' 0 N--CA 1.429 -1.476 0 C-N-CA 124.818 1.247 . . . . 0.0 112.774 172.959 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -58.94 -48.75 80.38 Favored 'General case' 0 N--CA 1.432 -1.368 0 C-N-CA 124.549 1.14 . . . . 0.0 113.712 178.402 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -62.7 -36.45 82.97 Favored 'General case' 0 N--CA 1.431 -1.4 0 C-N-CA 124.776 1.23 . . . . 0.0 114.148 175.967 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 27.1 mm-40 -64.72 -47.93 76.49 Favored 'General case' 0 N--CA 1.43 -1.45 0 O-C-N 120.491 -1.381 . . . . 0.0 114.435 174.218 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 2.9 pp -69.1 -40.34 78.44 Favored 'General case' 0 N--CA 1.43 -1.458 0 O-C-N 120.12 -1.613 . . . . 0.0 113.884 175.969 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 0.3 OUTLIER -40.76 -58.87 1.54 Allowed 'General case' 0 N--CA 1.43 -1.442 0 C-N-CA 127.445 2.298 . . . . 0.0 113.8 164.584 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 41.4 tp -63.89 -43.05 97.16 Favored 'General case' 0 N--CA 1.43 -1.468 0 C-N-CA 126.137 1.775 . . . . 0.0 113.515 -178.462 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 58.5 m -61.03 -49.7 76.32 Favored 'General case' 0 N--CA 1.431 -1.408 0 C-N-CA 125.043 1.337 . . . . 0.0 113.269 175.192 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 93.8 mt -55.99 -54.02 31.79 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.447 0 C-N-CA 126.037 1.735 . . . . 0.0 112.943 173.899 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 2.3 tm-20 -56.5 -55.11 37.82 Favored 'General case' 0 N--CA 1.429 -1.485 0 C-N-CA 124.912 1.285 . . . . 0.0 113.213 -178.042 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 34.3 mt-10 -68.13 -35.2 77.72 Favored 'General case' 0 N--CA 1.43 -1.441 0 N-CA-C 116.099 1.889 . . . . 0.0 116.099 -179.382 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 22.7 tpp180 -65.11 -40.06 93.99 Favored 'General case' 0 N--CA 1.43 -1.45 0 O-C-N 119.839 -1.788 . . . . 0.0 112.503 175.743 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 69.1 mt -74.65 -43.1 57.03 Favored 'General case' 0 N--CA 1.431 -1.397 0 N-CA-C 114.354 1.242 . . . . 0.0 114.354 176.91 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 12.5 t70 -54.42 -31.98 56.37 Favored 'General case' 0 N--CA 1.431 -1.415 0 C-N-CA 125.414 1.485 . . . . 0.0 113.697 171.792 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 32.9 t70 -78.51 -15.08 59.0 Favored 'General case' 0 N--CA 1.431 -1.401 0 O-C-N 119.642 -1.911 . . . . 0.0 116.085 174.33 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 24' ' ' TRP . . . . . . . . . . . . . 14.5 t-105 -90.77 121.42 32.63 Favored 'General case' 0 N--CA 1.43 -1.446 0 O-C-N 118.962 -2.336 . . . . 0.0 112.872 -170.347 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 6.5 t70 -120.76 171.77 8.36 Favored 'General case' 0 N--CA 1.43 -1.454 0 O-C-N 119.987 -1.696 . . . . 0.0 110.744 -175.099 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 171.89 -135.42 3.4 Favored Glycine 0 N--CA 1.43 -1.751 0 O-C-N 119.987 -1.695 . . . . 0.0 114.123 -174.971 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 31.5 t0 -84.39 -39.25 19.27 Favored 'General case' 0 N--CA 1.431 -1.39 0 C-N-CA 125.576 1.55 . . . . 0.0 108.667 177.741 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 68.3 m -101.88 143.39 31.83 Favored 'General case' 0 N--CA 1.431 -1.405 0 C-N-CA 124.714 1.206 . . . . 0.0 111.568 -178.363 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 31.2 t0 -86.03 160.12 19.4 Favored 'General case' 0 N--CA 1.43 -1.445 0 O-C-N 121.295 -0.878 . . . . 0.0 109.428 174.554 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -157.35 114.92 0.22 Allowed 'Isoleucine or valine' 0 N--CA 1.43 -1.46 0 CA-C-O 123.067 1.413 . . . . 0.0 107.932 -168.048 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 11.4 m-20 -123.17 131.41 53.67 Favored 'General case' 0 N--CA 1.429 -1.501 0 N-CA-C 107.042 -1.466 . . . . 0.0 107.042 171.334 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 71.3 m -92.64 148.48 22.03 Favored 'General case' 0 N--CA 1.429 -1.503 0 O-C-N 119.471 -2.018 . . . . 0.0 110.431 171.053 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 50.6 mt-10 -102.5 138.12 39.83 Favored 'General case' 0 N--CA 1.43 -1.455 0 C-N-CA 125.54 1.536 . . . . 0.0 109.329 -176.753 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 3.7 mp -124.8 109.08 21.44 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.416 0 CA-C-O 123.745 1.736 . . . . 0.0 107.472 -176.644 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 47.5 t30 -130.73 71.14 1.46 Allowed 'General case' 0 N--CA 1.43 -1.439 0 C-N-CA 125.812 1.645 . . . . 0.0 110.486 179.981 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . 72.27 -101.42 1.05 Allowed Glycine 0 N--CA 1.43 -1.733 0 O-C-N 119.784 -1.822 . . . . 0.0 114.572 174.571 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -105.9 24.55 26.47 Favored Glycine 0 N--CA 1.43 -1.75 0 O-C-N 121.607 -0.937 . . . . 0.0 111.366 173.489 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 95.9 t -122.04 124.71 71.85 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.43 0 C-N-CA 125.539 1.536 . . . . 0.0 107.775 174.532 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 58.3 mt -111.62 140.75 45.98 Favored 'General case' 0 N--CA 1.429 -1.503 0 N-CA-C 107.604 -1.258 . . . . 0.0 107.604 161.83 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 1.2 m -134.57 125.07 26.52 Favored 'General case' 0 N--CA 1.431 -1.38 0 O-C-N 120.292 -1.505 . . . . 0.0 107.979 175.883 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 36.4 mt -96.32 116.62 38.74 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.437 0 N-CA-C 107.236 -1.394 . . . . 0.0 107.236 -175.601 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 86.4 m -127.6 111.61 13.94 Favored 'General case' 0 N--CA 1.43 -1.434 0 CA-C-O 123.713 1.721 . . . . 0.0 113.107 -169.292 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 43' ' ' PHE . . . . . . . . . . . . . 7.5 p90 -120.31 160.14 23.61 Favored 'General case' 0 N--CA 1.43 -1.461 0 C-N-CA 126.546 1.938 . . . . 0.0 112.209 178.938 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 25.8 mt-10 -52.88 -25.55 12.03 Favored 'General case' 0 N--CA 1.431 -1.421 0 N-CA-C 119.402 3.112 . . . . 0.0 119.402 -165.605 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 2.2 t-20 -66.77 -9.19 34.31 Favored 'General case' 0 N--CA 1.429 -1.495 0 C-N-CA 124.625 1.17 . . . . 0.0 113.998 177.686 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 94.56 25.2 16.21 Favored Glycine 0 N--CA 1.43 -1.747 0 O-C-N 120.506 -1.371 . . . . 0.0 110.712 177.107 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 18.3 m -89.52 163.88 15.03 Favored 'General case' 0 N--CA 1.429 -1.479 0 C-N-CA 125.523 1.529 . . . . 0.0 113.298 -170.528 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 36.5 ttmt -151.58 99.37 2.6 Favored 'General case' 0 N--CA 1.431 -1.401 0 O-C-N 121.549 -0.719 . . . . 0.0 111.237 -170.697 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 4.1 mm -101.58 107.91 22.5 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.457 0 N-CA-C 105.028 -2.212 . . . . 0.0 105.028 174.737 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 50' ' ' ILE . . . . . 0.42 HG23 ' HB3' ' A' ' 63' ' ' ALA . 3.4 tp -111.49 120.88 62.99 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.478 0 CA-C-O 123.438 1.59 . . . . 0.0 109.246 -169.824 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 2.4 mt -124.26 120.98 60.71 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.474 0 C-N-CA 125.653 1.581 . . . . 0.0 109.766 -173.994 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 7.5 t-20 -158.42 158.8 34.87 Favored 'General case' 0 N--CA 1.431 -1.389 0 CA-C-O 123.681 1.705 . . . . 0.0 106.843 -172.184 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 37.2 ptt180 -133.25 138.25 46.4 Favored 'General case' 0 N--CA 1.43 -1.454 0 C-N-CA 126.546 1.938 . . . . 0.0 111.077 -163.813 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 13.7 pt20 -100.36 137.58 38.59 Favored 'General case' 0 N--CA 1.43 -1.429 0 CA-C-O 122.496 1.141 . . . . 0.0 108.528 176.977 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 15.5 mm-40 -59.72 -49.02 93.87 Favored Pre-proline 0 N--CA 1.428 -1.531 0 CA-C-O 116.166 -1.874 . . . . 0.0 115.916 174.618 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 88.4 Cg_endo -75.21 139.78 24.16 Favored 'Trans proline' 0 C--N 1.301 -1.972 0 CA-C-N 126.04 3.193 . . . . 0.0 112.056 165.058 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . 0.368 5.5 mp 74.65 127.38 0.04 OUTLIER 'General case' 0 N--CA 1.431 -1.387 0 CA-C-O 124.354 2.026 . . . . 0.0 115.927 -176.22 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 24.1 m80 -76.94 40.24 0.25 Allowed 'General case' 0 N--CA 1.43 -1.438 0 C-N-CA 126.712 2.005 . . . . 0.0 115.016 -177.756 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 7.1 mp0 -127.61 132.18 49.82 Favored 'General case' 0 N--CA 1.43 -1.466 0 C-N-CA 128.591 2.756 . . . . 0.0 107.851 -171.567 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 60' ' ' VAL . . . . . 0.438 ' HB ' ' CE1' ' A' ' 71' ' ' PHE . 29.4 t -113.58 154.49 14.96 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.4 0 O-C-N 119.941 -1.724 . . . . 0.0 108.368 177.745 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 61' ' ' TRP . . . . . 0.436 ' HA ' ' HA ' ' A' ' 70' ' ' HIS 0.28 0.0 OUTLIER -89.3 154.0 20.44 Favored 'General case' 0 N--CA 1.429 -1.477 0 N-CA-C 115.045 1.498 . . . . 0.0 115.045 -178.67 . . . . . . . . 4 4 . 1 . 009 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -117.77 92.31 3.8 Favored 'General case' 0 N--CA 1.43 -1.46 0 N-CA-C 104.916 -2.253 . . . . 0.0 104.916 165.842 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . 0.42 ' HB3' HG23 ' A' ' 50' ' ' ILE . . . -104.22 100.89 10.63 Favored 'General case' 0 N--CA 1.431 -1.389 0 CA-C-O 123.689 1.709 . . . . 0.0 110.972 177.534 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 64' ' ' THR . . . . . . . . . . . . . 9.2 t -149.74 172.67 14.72 Favored 'General case' 0 N--CA 1.431 -1.4 0 C-N-CA 126.259 1.824 . . . . 0.0 106.893 -171.234 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 42.4 tptt -78.88 53.36 1.37 Allowed 'General case' 0 N--CA 1.43 -1.468 0 C-N-CA 126.579 1.952 . . . . 0.0 114.77 -166.439 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 38.4 tp60 -130.33 -24.33 2.56 Favored 'General case' 0 N--CA 1.43 -1.434 0 O-C-N 119.992 -1.693 . . . . 0.0 109.363 163.5 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 132.21 112.9 1.44 Allowed Glycine 0 N--CA 1.43 -1.71 0 N-CA-C 107.227 -2.349 . . . . 0.0 107.227 -167.199 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . -71.21 120.48 8.5 Favored Glycine 0 N--CA 1.429 -1.789 0 O-C-N 120.695 -1.473 . . . . 0.0 116.105 -177.195 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 18.6 m-30 -118.11 170.79 8.57 Favored 'General case' 0 N--CA 1.43 -1.459 0 C-N-CA 126.265 1.826 . . . . 0.0 108.7 -175.993 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 70' ' ' HIS . . . . . 0.436 ' HA ' ' HA ' ' A' ' 61' ' ' TRP . 3.0 p80 -120.74 159.25 25.78 Favored 'General case' 0 N--CA 1.43 -1.465 0 O-C-N 119.226 -2.171 . . . . 0.0 110.93 165.318 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 71' ' ' PHE . . . . . 0.438 ' CE1' ' HB ' ' A' ' 60' ' ' VAL . 0.0 OUTLIER -117.66 153.66 32.94 Favored 'General case' 0 N--CA 1.429 -1.491 0 N-CA-C 117.471 2.397 . . . . 0.0 117.471 -165.43 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 -127.98 145.47 50.96 Favored 'General case' 0 N--CA 1.43 -1.433 0 C-N-CA 124.659 1.184 . . . . 0.0 110.286 178.126 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 60.0 tp -96.1 114.26 25.94 Favored 'General case' 0 N--CA 1.429 -1.477 0 O-C-N 119.883 -1.761 . . . . 0.0 111.609 -178.108 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 74.1 mmtt -82.95 -11.79 57.86 Favored 'General case' 0 N--CA 1.43 -1.451 0 C-N-CA 124.875 1.27 . . . . 0.0 113.185 174.037 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . 121.96 -61.28 0.55 Allowed Glycine 0 N--CA 1.429 -1.768 0 N-CA-C 109.137 -1.585 . . . . 0.0 109.137 178.486 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 6.2 p-10 -89.51 -20.32 23.97 Favored 'General case' 0 N--CA 1.431 -1.392 0 C-N-CA 124.909 1.284 . . . . 0.0 113.162 179.039 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 6.5 tp10 -147.76 136.48 21.86 Favored 'General case' 0 N--CA 1.43 -1.458 0 N-CA-C 107.115 -1.439 . . . . 0.0 107.115 -174.422 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 78' ' ' TRP . . . . . . . . . . . . . 95.7 m95 -80.94 111.22 17.22 Favored 'General case' 0 N--CA 1.431 -1.405 0 N-CA-C 105.927 -1.879 . . . . 0.0 105.927 159.94 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -106.08 155.7 6.96 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.473 0 N-CA-C 105.657 -1.979 . . . . 0.0 105.657 179.658 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 66.4 m -85.4 146.87 26.78 Favored 'General case' 0 N--CA 1.43 -1.457 0 O-C-N 119.597 -1.939 . . . . 0.0 111.946 -175.987 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 51.6 t0 -66.68 -52.07 48.87 Favored 'General case' 0 N--CA 1.43 -1.46 0 C-N-CA 126.011 1.724 . . . . 0.0 112.301 179.261 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 4.4 mmp_? -67.65 129.38 39.73 Favored 'General case' 0 N--CA 1.43 -1.456 0 C-N-CA 124.812 1.245 . . . . 0.0 110.916 173.756 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 71.2 m 70.94 -59.48 0.54 Allowed 'General case' 0 N--CA 1.43 -1.458 0 C-N-CA 126.84 2.056 . . . . 0.0 115.054 -179.175 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 119.99 63.39 0.26 Allowed Glycine 0 N--CA 1.431 -1.665 0 C-N-CA 126.286 1.898 . . . . 0.0 108.751 -172.589 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 15.2 mm-40 -108.64 -152.83 0.5 Allowed 'General case' 0 N--CA 1.43 -1.448 0 N-CA-C 108.092 -1.077 . . . . 0.0 108.092 -170.994 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 8.9 m -150.33 129.83 13.02 Favored 'General case' 0 N--CA 1.431 -1.413 0 O-C-N 119.428 -2.045 . . . . 0.0 109.861 -158.397 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 4.0 t80 -53.12 -81.85 0.01 OUTLIER 'General case' 0 N--CA 1.431 -1.409 0 N-CA-C 119.12 3.008 . . . . 0.0 119.12 -175.945 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 88' ' ' TRP . . . . . . . . . . . . . 84.9 m95 -67.25 -26.43 66.57 Favored 'General case' 0 N--CA 1.43 -1.429 0 O-C-N 119.841 -1.787 . . . . 0.0 113.423 -167.751 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 17.4 t70 -77.94 -36.97 48.65 Favored 'General case' 0 N--CA 1.432 -1.358 0 C-N-CA 126.171 1.788 . . . . 0.0 113.034 179.428 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 42.2 tp -70.76 -44.41 66.79 Favored 'General case' 0 N--CA 1.43 -1.449 0 O-C-N 119.862 -1.774 . . . . 0.0 111.241 173.046 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 9.0 tt -51.03 -48.17 61.53 Favored 'General case' 0 N--CA 1.431 -1.391 0 C-N-CA 127.238 2.215 . . . . 0.0 112.721 171.622 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 23.8 tt0 -53.08 -55.77 21.34 Favored 'General case' 0 N--CA 1.43 -1.438 0 C-N-CA 126.109 1.764 . . . . 0.0 113.468 168.739 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 9.1 tt0 -52.42 -52.91 51.35 Favored 'General case' 0 N--CA 1.428 -1.551 0 C-N-CA 125.424 1.49 . . . . 0.0 113.958 -178.419 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -66.62 -42.45 86.78 Favored 'General case' 0 N--CA 1.43 -1.466 0 N-CA-C 113.926 1.084 . . . . 0.0 113.926 -178.979 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -67.56 -35.82 79.77 Favored 'General case' 0 N--CA 1.43 -1.446 0 O-C-N 120.674 -1.266 . . . . 0.0 113.294 176.516 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 78.9 m -61.05 -47.07 88.07 Favored 'General case' 0 N--CA 1.431 -1.388 0 C-N-CA 125.835 1.654 . . . . 0.0 112.248 174.268 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 16.3 pt20 -78.29 -10.67 59.77 Favored 'General case' 0 N--CA 1.43 -1.456 0 N-CA-C 114.783 1.401 . . . . 0.0 114.783 177.688 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 4.0 mm-40 -76.79 -50.38 13.64 Favored 'General case' 0 N--CA 1.429 -1.495 0 O-C-N 120.261 -1.524 . . . . 0.0 112.913 163.299 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -80.15 -42.97 22.45 Favored 'General case' 0 N--CA 1.43 -1.469 0 N-CA-C 115.493 1.664 . . . . 0.0 115.493 -174.795 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . 95.51 21.43 24.33 Favored Glycine 0 N--CA 1.43 -1.753 0 C-N-CA 124.567 1.08 . . . . 0.0 112.957 -173.713 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 16.4 pt-20 -157.56 164.18 37.59 Favored 'General case' 0 N--CA 1.43 -1.438 0 N-CA-C 105.914 -1.884 . . . . 0.0 105.914 173.399 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 49.1 m -72.43 102.93 3.31 Favored 'General case' 0 N--CA 1.431 -1.4 0 CA-C-N 119.936 1.243 . . . . 0.0 113.053 -173.0 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 4.3 t -98.49 85.68 1.32 Allowed 'Isoleucine or valine' 0 N--CA 1.429 -1.475 0 CA-C-O 123.359 1.552 . . . . 0.0 109.84 -179.024 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 27.9 p -115.84 156.75 25.53 Favored 'General case' 0 N--CA 1.43 -1.454 0 C-N-CA 125.669 1.587 . . . . 0.0 114.064 -170.322 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 29.6 m-85 -102.96 -34.61 8.87 Favored 'General case' 0 N--CA 1.429 -1.493 0 C-N-CA 125.834 1.654 . . . . 0.0 110.011 165.949 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 30.7 mmt180 . . . . . 0 C--O 1.26 1.65 0 O-C-N 121.513 -0.742 . . . . 0.0 109.539 -177.643 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 68.2 mtm . . . . . 0 CA--C 1.49 -1.352 0 CA-C-O 122.23 1.014 . . . . 1.0 111.518 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 33.9 p-10 -60.8 -36.61 79.48 Favored 'General case' 0 N--CA 1.43 -1.465 0 C-N-CA 126.167 1.787 . . . . 1.0 113.458 170.203 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 11.2 t70 -56.15 -54.36 46.03 Favored 'General case' 0 N--CA 1.43 -1.458 0 C-N-CA 127.554 2.342 . . . . 1.0 112.862 179.297 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 62.5 m -52.92 -53.64 46.39 Favored 'General case' 0 N--CA 1.43 -1.462 0 C-N-CA 126.516 1.926 . . . . 1.0 113.994 176.237 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 5.8 mm-40 -65.17 -49.04 71.36 Favored 'General case' 0 N--CA 1.43 -1.445 0 C-N-CA 125.616 1.566 . . . . 1.0 113.601 -178.034 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 12.9 t80 -61.96 -38.25 87.81 Favored 'General case' 0 N--CA 1.43 -1.43 0 N-CA-C 114.272 1.212 . . . . 1.0 114.272 173.373 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 23.6 t60 -65.56 -37.53 86.96 Favored 'General case' 0 N--CA 1.43 -1.445 0 O-C-N 119.882 -1.761 . . . . 1.0 113.2 176.422 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 1.7 tpm_? -59.12 -54.5 46.27 Favored 'General case' 0 N--CA 1.431 -1.422 0 C-N-CA 125.565 1.546 . . . . 1.0 112.353 171.796 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 81.5 mt -57.03 -49.13 76.74 Favored 'General case' 0 N--CA 1.429 -1.506 0 C-N-CA 125.043 1.337 . . . . 1.0 113.806 174.629 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -56.67 -48.34 77.82 Favored 'General case' 0 N--CA 1.431 -1.384 0 C-N-CA 127.087 2.155 . . . . 1.0 114.511 -178.283 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -59.78 -52.57 64.89 Favored 'General case' 0 N--CA 1.429 -1.502 0 O-C-N 121.29 -0.881 . . . . 1.0 112.498 171.639 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 39.6 mt-30 -55.2 -45.9 75.86 Favored 'General case' 0 N--CA 1.43 -1.458 0 N-CA-C 117.839 2.533 . . . . 1.0 117.839 177.637 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 4.0 pp -65.67 -38.51 89.52 Favored 'General case' 0 N--CA 1.43 -1.474 0 O-C-N 120.707 -1.246 . . . . 1.0 113.669 175.679 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 0.1 OUTLIER -49.84 -56.52 10.09 Favored 'General case' 0 N--CA 1.429 -1.506 0 N-CA-C 113.988 1.107 . . . . 1.0 113.988 167.894 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 38.1 mt -56.46 -44.21 80.31 Favored 'General case' 0 N--CA 1.43 -1.431 0 CA-C-O 122.183 0.992 . . . . 1.0 113.313 178.743 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 14.9 m -57.56 -54.21 49.44 Favored 'General case' 0 N--CA 1.431 -1.411 0 C-N-CA 125.047 1.339 . . . . 1.0 113.323 178.981 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 80.9 mt -59.62 -46.86 92.79 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.416 0 C-N-CA 126.879 2.072 . . . . 1.0 113.541 177.213 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 26.1 mt-10 -52.67 -57.61 9.52 Favored 'General case' 0 N--CA 1.43 -1.469 0 C-N-CA 126.225 1.81 . . . . 1.0 112.248 176.526 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -53.45 -54.93 29.86 Favored 'General case' 0 CA--C 1.489 -1.391 0 C-N-CA 125.174 1.39 . . . . 1.0 113.545 174.421 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 3.4 tpt180 -57.9 -49.05 78.05 Favored 'General case' 0 N--CA 1.431 -1.42 0 N-CA-C 114.992 1.479 . . . . 1.0 114.992 -171.508 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -80.9 -32.82 34.63 Favored 'General case' 0 N--CA 1.43 -1.458 0 N-CA-C 114.255 1.206 . . . . 1.0 114.255 177.84 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 15.0 t70 -56.02 -49.32 74.0 Favored 'General case' 0 N--CA 1.428 -1.532 0 O-C-N 119.738 -1.851 . . . . 1.0 114.064 172.448 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 13.6 t70 -52.83 -45.41 67.31 Favored 'General case' 0 N--CA 1.43 -1.427 0 C-N-CA 128.081 2.553 . . . . 1.0 117.206 -175.356 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 24' ' ' TRP . . . . . . . . . . . . . 76.9 t-105 -43.9 -65.12 0.54 Allowed 'General case' 0 N--CA 1.43 -1.472 0 C-N-CA 127.677 2.391 . . . . 1.0 116.57 -169.594 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 40.4 t0 59.34 70.03 0.67 Allowed 'General case' 0 N--CA 1.43 -1.46 0 C-N-CA 126.653 1.981 . . . . 1.0 114.161 173.231 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -99.65 -134.29 8.44 Favored Glycine 0 N--CA 1.429 -1.818 0 CA-C-O 122.823 1.235 . . . . 1.0 113.386 -175.45 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -72.69 -34.52 67.22 Favored 'General case' 0 N--CA 1.43 -1.447 0 C-N-CA 125.024 1.329 . . . . 1.0 109.64 174.547 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 36.1 m -89.3 148.84 23.33 Favored 'General case' 0 N--CA 1.43 -1.429 0 CA-C-O 122.899 1.333 . . . . 1.0 113.033 -179.926 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 22.5 t0 -76.84 172.84 12.47 Favored 'General case' 0 N--CA 1.431 -1.381 0 C-N-CA 125.187 1.395 . . . . 1.0 110.135 170.432 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 5.4 tp -157.04 114.78 0.23 Allowed 'Isoleucine or valine' 0 N--CA 1.43 -1.464 0 CA-C-O 123.477 1.608 . . . . 1.0 108.253 -164.78 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 7.5 t0 -131.68 102.31 5.84 Favored 'General case' 0 N--CA 1.431 -1.388 0 O-C-N 120.507 -1.371 . . . . 1.0 108.806 170.767 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 27.3 p -89.58 124.45 34.56 Favored 'General case' 0 N--CA 1.431 -1.424 0 O-C-N 120.241 -1.537 . . . . 1.0 111.669 -178.697 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 5.2 mm-40 -94.34 135.13 36.09 Favored 'General case' 0 N--CA 1.429 -1.478 0 O-C-N 120.087 -1.633 . . . . 1.0 110.623 -177.191 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 1.6 tp -131.42 115.89 30.31 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.422 0 C-N-CA 126.758 2.023 . . . . 1.0 107.357 -176.929 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 4.9 t-20 -147.66 81.42 1.51 Allowed 'General case' 0 N--CA 1.431 -1.423 0 O-C-N 121.62 -0.675 . . . . 1.0 111.374 172.281 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . 68.27 -70.49 0.34 Allowed Glycine 0 N--CA 1.429 -1.808 0 C-N-CA 126.777 2.132 . . . . 1.0 118.221 167.815 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -119.5 -3.07 12.93 Favored Glycine 0 N--CA 1.43 -1.762 0 C-N-CA 126.125 1.821 . . . . 1.0 112.24 179.693 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 21.5 t -120.99 123.78 70.85 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.457 0 CA-C-N 118.538 1.169 . . . . 1.0 109.689 -177.707 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 42.1 mt -110.23 135.67 50.63 Favored 'General case' 0 N--CA 1.431 -1.408 0 O-C-N 120.286 -1.509 . . . . 1.0 108.707 163.254 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -136.91 107.51 6.54 Favored 'General case' 0 N--CA 1.431 -1.407 0 N-CA-C 107.183 -1.414 . . . . 1.0 107.183 -178.329 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 6.5 mt -100.46 114.62 39.8 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.513 0 O-C-N 119.457 -2.027 . . . . 1.0 108.664 -168.075 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 23.0 m -116.03 131.94 56.8 Favored 'General case' 0 N--CA 1.43 -1.436 0 CA-C-O 121.473 0.654 . . . . 1.0 111.265 -167.102 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 43' ' ' PHE . . . . . . . . . . . . 0.263 0.2 OUTLIER -120.55 173.03 7.42 Favored 'General case' 0 N--CA 1.429 -1.486 0 C-N-CA 124.624 1.17 . . . . 1.0 112.481 177.142 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -57.88 -33.32 68.59 Favored 'General case' 0 N--CA 1.431 -1.418 0 N-CA-C 118.256 2.687 . . . . 1.0 118.256 -160.097 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -69.46 -13.78 62.53 Favored 'General case' 0 N--CA 1.43 -1.459 0 C-N-CA 125.543 1.537 . . . . 1.0 113.283 -179.775 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 82.27 38.32 13.12 Favored Glycine 0 N--CA 1.429 -1.772 0 O-C-N 119.868 -1.77 . . . . 1.0 109.228 -168.793 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 68.8 m -120.86 151.61 39.43 Favored 'General case' 0 CA--C 1.489 -1.4 0 N-CA-C 106.145 -1.798 . . . . 1.0 106.145 179.456 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 47.6 pttt -161.3 165.64 28.82 Favored 'General case' 0 N--CA 1.431 -1.411 0 N-CA-C 113.905 1.076 . . . . 1.0 113.905 -165.54 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 5.7 mm -112.86 135.23 52.95 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.506 0 C-N-CA 127.327 2.251 . . . . 1.0 106.269 175.517 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 3.2 mm -117.88 114.46 45.42 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.466 0 C-N-CA 124.577 1.151 . . . . 1.0 108.737 -179.912 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 4.7 mt -128.08 128.25 68.62 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.5 0 CA-C-O 123.006 1.384 . . . . 1.0 111.617 -176.902 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 52' ' ' ASN . . . . . 0.459 ' H ' ' HD1' ' A' ' 61' ' ' TRP . 14.0 t-20 -160.96 174.41 13.83 Favored 'General case' 0 N--CA 1.43 -1.452 0 N-CA-C 102.809 -3.034 . . . . 1.0 102.809 -178.349 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 12.6 ptt180 -142.46 135.26 28.25 Favored 'General case' 0 CA--C 1.489 -1.374 0 N-CA-C 108.66 -0.867 . . . . 1.0 108.66 -169.263 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 55.2 mm-40 -139.46 67.02 1.39 Allowed 'General case' 0 N--CA 1.431 -1.393 0 N-CA-C 106.892 -1.522 . . . . 1.0 106.892 -171.401 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . 0.426 ' H ' ' HG3' ' A' ' 55' ' ' GLU . 1.0 OUTLIER -70.91 126.82 92.17 Favored Pre-proline 0 N--CA 1.43 -1.438 0 N-CA-C 117.24 2.311 . . . . 1.0 117.24 -157.655 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 49.6 Cg_endo -76.63 -55.62 0.06 OUTLIER 'Trans proline' 0 C--N 1.299 -2.069 0 C-N-CA 122.052 1.835 . . . . 1.0 109.812 150.908 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . 0.419 ' HB2' ' H ' ' A' ' 58' ' ' HIS . 40.8 mt -115.96 -93.23 0.5 Allowed 'General case' 0 N--CA 1.429 -1.508 0 C-N-CA 124.932 1.293 . . . . 1.0 109.307 -177.692 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 58' ' ' HIS . . . . . 0.419 ' H ' ' HB2' ' A' ' 57' ' ' LEU . 51.4 m170 -132.76 78.96 1.82 Allowed 'General case' 0 N--CA 1.43 -1.436 0 C-N-CA 126.68 1.992 . . . . 1.0 106.604 175.892 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 12.0 tt0 -138.47 140.43 39.23 Favored 'General case' 0 N--CA 1.43 -1.45 0 O-C-N 119.908 -1.745 . . . . 1.0 108.252 -170.389 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 48.9 t -119.85 154.43 22.71 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.381 0 N-CA-C 106.198 -1.778 . . . . 1.0 106.198 -177.611 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 61' ' ' TRP . . . . . 0.459 ' HD1' ' H ' ' A' ' 52' ' ' ASN . 0.0 OUTLIER -99.42 148.44 24.21 Favored 'General case' 0 N--CA 1.43 -1.45 0 O-C-N 120.555 -1.341 . . . . 1.0 110.092 178.228 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -133.55 92.21 2.95 Favored 'General case' 0 N--CA 1.429 -1.477 0 O-C-N 120.38 -1.45 . . . . 1.0 111.829 176.862 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -103.71 149.9 24.54 Favored 'General case' 0 N--CA 1.43 -1.429 0 CA-C-O 123.628 1.68 . . . . 1.0 112.011 173.712 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 64' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -151.15 -82.92 0.09 Allowed 'General case' 0 N--CA 1.43 -1.438 0 N-CA-C 107.197 -1.409 . . . . 1.0 107.197 -171.161 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 42.8 tttp -122.88 -59.03 1.63 Allowed 'General case' 0 N--CA 1.43 -1.431 0 C-N-CA 123.696 0.798 . . . . 1.0 111.881 178.432 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 51.7 tt0 -121.1 -23.35 5.83 Favored 'General case' 0 N--CA 1.431 -1.417 0 N-CA-C 112.969 0.729 . . . . 1.0 112.969 -160.066 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . -90.84 -83.79 1.41 Allowed Glycine 0 N--CA 1.431 -1.668 0 O-C-N 120.627 -1.295 . . . . 1.0 114.762 -175.958 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 74.69 51.1 8.37 Favored Glycine 0 N--CA 1.43 -1.748 0 O-C-N 121.375 -1.074 . . . . 1.0 112.845 -166.425 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 11.0 m-30 -99.44 125.78 45.22 Favored 'General case' 0 N--CA 1.429 -1.475 0 O-C-N 121.257 -1.143 . . . . 1.0 108.648 -169.358 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 12.0 p-80 -92.37 156.45 17.22 Favored 'General case' 0 N--CA 1.43 -1.459 0 O-C-N 120.214 -1.554 . . . . 1.0 112.072 179.26 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 50.9 p90 -144.13 142.9 30.85 Favored 'General case' 0 N--CA 1.43 -1.448 0 N-CA-C 115.164 1.542 . . . . 1.0 115.164 -156.381 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -119.54 155.69 31.71 Favored 'General case' 0 N--CA 1.429 -1.476 0 C-N-CA 126.834 2.054 . . . . 1.0 110.866 -172.001 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 58.5 tp -92.35 117.4 29.86 Favored 'General case' 0 N--CA 1.43 -1.426 0 O-C-N 120.318 -1.489 . . . . 1.0 111.427 178.801 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 68.3 mmtt -79.99 -45.74 17.89 Favored 'General case' 0 N--CA 1.43 -1.473 0 O-C-N 120.746 -1.221 . . . . 1.0 113.122 170.034 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -174.92 -76.18 0.05 OUTLIER Glycine 0 N--CA 1.43 -1.73 0 O-C-N 121.001 -1.062 . . . . 1.0 112.453 -179.459 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 4.0 p-10 -101.67 0.33 35.94 Favored 'General case' 0 N--CA 1.429 -1.509 0 C-N-CA 124.876 1.27 . . . . 1.0 112.149 173.675 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 20.6 pt-20 -153.44 148.8 27.08 Favored 'General case' 0 N--CA 1.431 -1.404 0 N-CA-C 106.127 -1.805 . . . . 1.0 106.127 -174.764 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 78' ' ' TRP . . . . . . . . . . . . . 27.4 m95 -97.86 135.36 39.72 Favored 'General case' 0 N--CA 1.43 -1.442 0 N-CA-C 106.982 -1.488 . . . . 1.0 106.982 177.413 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 3.1 mt -104.87 134.38 46.45 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.426 0 C-N-CA 125.502 1.521 . . . . 1.0 107.186 177.832 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 75.4 m -82.58 127.6 33.51 Favored 'General case' 0 N--CA 1.432 -1.368 0 CA-C-N 115.403 -0.817 . . . . 1.0 108.841 -179.376 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 30.1 t70 -70.08 -37.9 75.57 Favored 'General case' 0 N--CA 1.43 -1.438 0 C-N-CA 124.16 0.984 . . . . 1.0 112.827 -166.894 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -75.51 121.0 21.71 Favored 'General case' 0 N--CA 1.43 -1.461 0 O-C-N 121.234 -0.916 . . . . 1.0 110.017 176.743 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 83' ' ' SER . . . . . . . . . . . . 0.378 80.2 p 72.59 -53.2 0.7 Allowed 'General case' 0 N--CA 1.43 -1.449 0 C-N-CA 128.065 2.546 . . . . 1.0 115.954 -173.028 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 116.54 80.12 0.79 Allowed Glycine 0 N--CA 1.43 -1.719 0 N-CA-C 109.123 -1.591 . . . . 1.0 109.123 -176.375 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 4.6 mm-40 -135.11 -156.02 0.69 Allowed 'General case' 0 N--CA 1.43 -1.458 0 N-CA-C 105.467 -2.049 . . . . 1.0 105.467 -172.158 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 18.8 m -145.71 137.64 25.31 Favored 'General case' 0 N--CA 1.431 -1.413 0 O-C-N 119.866 -1.771 . . . . 1.0 109.087 -154.267 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 1.3 t80 -30.72 -91.23 0.0 OUTLIER 'General case' 0 N--CA 1.43 -1.447 0 C-N-CA 128.702 2.801 . . . . 1.0 118.309 176.551 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 88' ' ' TRP . . . . . . . . . . . . . 56.0 m95 -73.72 -28.09 61.53 Favored 'General case' 0 N--CA 1.43 -1.463 0 O-C-N 120.794 -1.191 . . . . 1.0 111.499 -169.653 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 59.3 m-20 -74.75 -38.82 62.13 Favored 'General case' 0 N--CA 1.429 -1.506 0 C-N-CA 124.603 1.161 . . . . 1.0 114.06 -178.636 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 58.2 tp -69.64 -45.5 68.32 Favored 'General case' 0 N--CA 1.43 -1.435 0 O-C-N 119.611 -1.931 . . . . 1.0 109.79 174.338 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 60.9 tp -50.93 -44.84 60.36 Favored 'General case' 0 N--CA 1.43 -1.469 0 C-N-CA 125.678 1.591 . . . . 1.0 114.35 170.278 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 2.9 tm-20 -55.78 -49.04 74.24 Favored 'General case' 0 N--CA 1.431 -1.384 0 C-N-CA 126.495 1.918 . . . . 1.0 113.505 172.193 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 1.8 tm0? -61.27 -50.92 71.08 Favored 'General case' 0 N--CA 1.429 -1.499 0 N-CA-C 114.253 1.205 . . . . 1.0 114.253 176.288 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -54.43 -44.26 72.29 Favored 'General case' 0 N--CA 1.431 -1.41 0 C-N-CA 128.019 2.528 . . . . 1.0 115.256 174.544 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -72.97 -45.82 55.82 Favored 'General case' 0 N--CA 1.431 -1.418 0 O-C-N 120.299 -1.5 . . . . 1.0 113.868 178.203 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 91.9 m -50.52 -45.77 56.85 Favored 'General case' 0 N--CA 1.428 -1.549 0 C-N-CA 127.125 2.17 . . . . 1.0 112.891 168.997 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 2.7 tp60 -57.28 -54.75 43.29 Favored 'General case' 0 N--CA 1.432 -1.371 0 C-N-CA 126.31 1.844 . . . . 1.0 113.188 172.795 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 10.1 mm100 -58.41 -45.18 88.91 Favored 'General case' 0 N--CA 1.43 -1.449 0 N-CA-C 116.345 1.98 . . . . 1.0 116.345 176.648 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -78.51 -43.21 27.43 Favored 'General case' 0 N--CA 1.429 -1.481 0 O-C-N 120.302 -1.499 . . . . 1.0 113.402 -178.926 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . 97.27 13.69 44.45 Favored Glycine 0 N--CA 1.431 -1.699 0 C-N-CA 125.085 1.326 . . . . 1.0 111.7 -172.98 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 8.0 tt0 -157.13 144.99 19.12 Favored 'General case' 0 N--CA 1.43 -1.455 0 N-CA-C 106.226 -1.768 . . . . 1.0 106.226 -174.665 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 57.0 m -58.86 119.2 6.74 Favored 'General case' 0 N--CA 1.429 -1.515 0 C-N-CA 125.078 1.351 . . . . 1.0 114.51 -178.726 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 92.2 t -96.19 130.42 44.88 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.45 0 C-N-CA 125.53 1.532 . . . . 1.0 108.816 -179.025 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 7.5 t -93.2 96.76 10.21 Favored 'General case' 0 N--CA 1.429 -1.487 0 C-N-CA 125.449 1.5 . . . . 1.0 114.448 -170.346 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 14.9 m-85 -118.23 -18.97 9.16 Favored 'General case' 0 N--CA 1.431 -1.421 0 C-N-CA 124.87 1.268 . . . . 1.0 111.278 172.17 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.26 1.658 0 O-C-N 120.965 -1.085 . . . . 1.0 113.849 -168.911 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 11.8 tpt . . . . . 0 CA--C 1.489 -1.387 0 CA-C-O 121.81 0.814 . . . . 1.0 111.087 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 80.6 m-20 -109.89 76.09 0.97 Allowed 'General case' 0 N--CA 1.431 -1.413 0 O-C-N 120.905 -1.122 . . . . 1.0 111.081 -172.164 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 9.0 t70 -68.5 -42.31 78.79 Favored 'General case' 0 N--CA 1.429 -1.52 0 C-N-CA 124.635 1.174 . . . . 1.0 114.08 -172.328 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 15.9 t -64.17 -43.63 94.53 Favored 'General case' 0 N--CA 1.429 -1.478 0 O-C-N 120.473 -1.392 . . . . 1.0 112.904 175.846 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 9.4 mm-40 -55.02 -58.32 8.12 Favored 'General case' 0 N--CA 1.43 -1.433 0 C-N-CA 124.893 1.277 . . . . 1.0 113.168 172.908 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 31.3 t80 -50.59 -57.65 7.68 Favored 'General case' 0 N--CA 1.43 -1.426 0 N-CA-C 114.625 1.343 . . . . 1.0 114.625 172.873 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 37.4 m80 -65.07 -38.98 92.54 Favored 'General case' 0 N--CA 1.43 -1.436 0 N-CA-C 115.759 1.763 . . . . 1.0 115.759 -175.588 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 47.6 mtt-85 -62.79 -53.5 53.29 Favored 'General case' 0 N--CA 1.43 -1.432 0 CA-C-N 120.239 1.381 . . . . 1.0 112.972 172.14 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 98.2 mt -62.11 -42.86 99.65 Favored 'General case' 0 N--CA 1.43 -1.465 0 O-C-N 120.752 -1.217 . . . . 1.0 113.571 -178.394 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -62.78 -36.27 82.54 Favored 'General case' 0 N--CA 1.431 -1.424 0 N-CA-C 114.424 1.268 . . . . 1.0 114.424 174.965 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 10.8 t70 -61.17 -45.18 95.66 Favored 'General case' 0 N--CA 1.429 -1.491 0 O-C-N 120.569 -1.332 . . . . 1.0 111.762 172.741 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 29.4 mm100 -57.19 -39.85 76.2 Favored 'General case' 0 N--CA 1.429 -1.49 0 N-CA-C 115.019 1.488 . . . . 1.0 115.019 173.759 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 28.5 mt -59.78 -52.49 65.24 Favored 'General case' 0 N--CA 1.43 -1.452 0 O-C-N 120.312 -1.493 . . . . 1.0 112.942 171.436 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 0.7 OUTLIER -42.67 -56.11 3.28 Favored 'General case' 0 N--CA 1.43 -1.466 0 C-N-CA 127.028 2.131 . . . . 1.0 114.305 174.606 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 44.1 mt -60.32 -48.8 80.19 Favored 'General case' 0 N--CA 1.429 -1.51 0 C-N-CA 124.437 1.095 . . . . 1.0 113.701 176.279 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 24.1 m -64.67 -45.88 84.84 Favored 'General case' 0 N--CA 1.43 -1.43 0 C-N-CA 124.831 1.253 . . . . 1.0 113.539 -175.132 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 65.7 mt -59.53 -51.23 75.17 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.499 0 C-N-CA 126.018 1.727 . . . . 1.0 111.024 175.821 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 4.8 tt0 -55.62 -51.2 67.99 Favored 'General case' 0 N--CA 1.43 -1.438 0 N-CA-C 112.972 0.731 . . . . 1.0 112.972 176.064 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 13.0 tt0 -60.49 -44.75 95.61 Favored 'General case' 0 N--CA 1.429 -1.522 0 N-CA-C 115.3 1.592 . . . . 1.0 115.3 -178.493 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -67.54 -39.14 85.01 Favored 'General case' 0 N--CA 1.431 -1.42 0 O-C-N 119.925 -1.734 . . . . 1.0 112.465 178.113 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 15.2 mt -62.1 -57.11 12.78 Favored 'General case' 0 N--CA 1.431 -1.393 0 N-CA-C 114.628 1.344 . . . . 1.0 114.628 170.724 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 7.6 t70 -52.92 -37.99 61.35 Favored 'General case' 0 N--CA 1.432 -1.368 0 C-N-CA 127.092 2.157 . . . . 1.0 114.962 179.441 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 29.0 t70 -74.96 -0.42 18.66 Favored 'General case' 0 N--CA 1.429 -1.485 0 O-C-N 120.102 -1.624 . . . . 1.0 115.109 179.81 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 24' ' ' TRP . . . . . . . . . . . . . 68.4 t-105 -75.27 129.38 37.34 Favored 'General case' 0 N--CA 1.431 -1.385 0 O-C-N 118.433 -2.667 . . . . 1.0 112.496 172.237 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 34.3 m-20 -117.74 136.5 53.33 Favored 'General case' 0 N--CA 1.43 -1.465 0 N-CA-C 106.788 -1.56 . . . . 1.0 106.788 167.814 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -172.31 -149.01 6.46 Favored Glycine 0 N--CA 1.431 -1.672 0 N-CA-C 110.043 -1.223 . . . . 1.0 110.043 178.724 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 1.5 t70 -79.36 -28.8 41.98 Favored 'General case' 0 N--CA 1.43 -1.462 0 CA-C-O 122.293 1.044 . . . . 1.0 110.694 179.867 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 96.1 p -86.31 -164.41 1.04 Allowed 'General case' 0 N--CA 1.43 -1.465 0 C-N-CA 127.873 2.469 . . . . 1.0 113.749 -179.677 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 3.4 t70 -142.29 179.09 7.13 Favored 'General case' 0 N--CA 1.43 -1.444 0 O-C-N 120.313 -1.492 . . . . 1.0 109.851 176.21 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 7.4 tp -162.77 113.82 0.09 OUTLIER 'Isoleucine or valine' 0 N--CA 1.431 -1.411 0 CA-C-O 123.247 1.498 . . . . 1.0 110.626 -175.149 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -121.36 107.27 12.3 Favored 'General case' 0 N--CA 1.43 -1.458 0 O-C-N 120.363 -1.46 . . . . 1.0 108.991 169.593 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 91.2 m -87.03 139.02 30.99 Favored 'General case' 0 N--CA 1.43 -1.425 0 O-C-N 119.588 -1.945 . . . . 1.0 109.224 164.752 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -105.93 140.13 39.41 Favored 'General case' 0 N--CA 1.43 -1.429 0 C-N-CA 126.083 1.753 . . . . 1.0 110.85 -171.249 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 5.0 mm -115.32 106.85 21.35 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.453 0 C-N-CA 125.333 1.453 . . . . 1.0 107.796 -170.758 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 69.2 m-80 -128.36 -179.37 4.99 Favored 'General case' 0 N--CA 1.429 -1.481 0 O-C-N 120.465 -1.397 . . . . 1.0 110.636 176.069 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -73.22 94.86 0.73 Allowed Glycine 0 N--CA 1.431 -1.666 0 O-C-N 120.112 -1.618 . . . . 1.0 114.326 -167.174 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 78.19 25.33 61.89 Favored Glycine 0 N--CA 1.43 -1.741 0 C-N-CA 125.855 1.693 . . . . 1.0 112.675 -173.067 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 54.8 t -139.82 129.37 28.95 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.454 0 C-N-CA 124.176 0.99 . . . . 1.0 110.45 -167.139 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 14.4 mt -111.69 132.41 54.63 Favored 'General case' 0 N--CA 1.43 -1.445 0 N-CA-C 108.159 -1.052 . . . . 1.0 108.159 154.814 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 2.7 m -124.99 119.89 30.02 Favored 'General case' 0 N--CA 1.429 -1.481 0 N-CA-C 106.989 -1.486 . . . . 1.0 106.989 178.644 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 73.7 mt -93.92 120.53 43.47 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.437 0 O-C-N 120.767 -1.208 . . . . 1.0 108.206 -168.919 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 43.4 p -126.64 129.11 47.85 Favored 'General case' 0 N--CA 1.43 -1.438 0 CA-C-O 122.183 0.992 . . . . 1.0 111.619 178.577 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 43' ' ' PHE . . . . . . . . . . . . . 7.2 p90 -120.28 168.41 11.29 Favored 'General case' 0 N--CA 1.431 -1.424 0 O-C-N 120.372 -1.455 . . . . 1.0 109.57 172.563 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -64.52 -28.88 69.95 Favored 'General case' 0 N--CA 1.431 -1.423 0 N-CA-C 116.16 1.911 . . . . 1.0 116.16 -166.981 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 15.8 m-80 -66.82 -4.94 10.4 Favored 'General case' 0 N--CA 1.43 -1.461 0 C-N-CA 126.068 1.747 . . . . 1.0 114.824 173.181 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 103.23 15.74 22.69 Favored Glycine 0 N--CA 1.43 -1.717 0 O-C-N 120.063 -1.648 . . . . 1.0 116.894 158.874 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 3.2 t -91.86 -175.77 4.23 Favored 'General case' 0 N--CA 1.431 -1.404 0 CA-C-N 118.54 1.17 . . . . 1.0 113.639 -178.072 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -160.81 99.44 1.24 Allowed 'General case' 0 N--CA 1.43 -1.461 0 CA-C-O 122.967 1.365 . . . . 1.0 110.938 -174.401 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -107.58 119.95 58.08 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.443 0 N-CA-C 105.798 -1.927 . . . . 1.0 105.798 -174.468 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 3.7 tp -112.95 128.65 69.58 Favored 'Isoleucine or valine' 0 CA--C 1.488 -1.408 0 O-C-N 119.611 -1.931 . . . . 1.0 111.789 -165.897 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 4.1 mt -124.99 127.59 72.5 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.489 0 C-N-CA 126.749 2.02 . . . . 1.0 110.558 -179.173 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 52' ' ' ASN . . . . . 0.487 ' H ' ' HD1' ' A' ' 61' ' ' TRP . 6.8 t-20 -162.47 169.71 19.92 Favored 'General case' 0 N--CA 1.431 -1.416 0 N-CA-C 105.347 -2.094 . . . . 1.0 105.347 -165.706 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 34.4 ttp180 -155.03 136.17 13.91 Favored 'General case' 0 N--CA 1.431 -1.418 0 O-C-N 120.761 -1.212 . . . . 1.0 110.754 -156.651 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 4.7 mm100 -97.26 127.59 43.35 Favored 'General case' 0 N--CA 1.429 -1.512 0 N-CA-C 107.115 -1.439 . . . . 1.0 107.115 177.673 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 87.4 mt-10 -58.58 -37.62 56.32 Favored Pre-proline 0 N--CA 1.429 -1.502 0 CA-C-O 114.812 -2.518 . . . . 1.0 117.004 167.132 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 68.5 Cg_endo -79.33 155.85 25.34 Favored 'Trans proline' 0 N--CA 1.434 -2.025 0 CA-C-N 127.694 3.783 . . . . 1.0 111.793 161.379 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . 0.361 5.5 mp 67.06 134.94 0.02 OUTLIER 'General case' 0 N--CA 1.431 -1.411 0 CA-C-O 124.553 2.12 . . . . 1.0 115.95 -174.213 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 22.0 m170 -76.15 41.72 0.24 Allowed 'General case' 0 N--CA 1.429 -1.51 0 C-N-CA 126.416 1.886 . . . . 1.0 114.869 -176.23 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 2.1 pt20 -146.91 158.34 43.89 Favored 'General case' 0 N--CA 1.431 -1.379 0 O-C-N 119.402 -2.061 . . . . 1.0 110.073 -171.657 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 93.0 t -118.28 162.28 16.48 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.402 0 N-CA-C 107.03 -1.47 . . . . 1.0 107.03 -177.305 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 61' ' ' TRP . . . . . 0.487 ' HD1' ' H ' ' A' ' 52' ' ' ASN . 0.0 OUTLIER -104.17 153.24 21.19 Favored 'General case' 0 N--CA 1.43 -1.453 0 O-C-N 119.654 -1.904 . . . . 1.0 109.907 178.963 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 2.0 pt? -143.68 126.39 16.08 Favored 'General case' 0 N--CA 1.431 -1.408 0 O-C-N 120.24 -1.538 . . . . 1.0 108.564 158.897 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -120.18 146.79 45.67 Favored 'General case' 0 N--CA 1.429 -1.499 0 CA-C-O 122.46 1.124 . . . . 1.0 112.486 176.09 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 64' ' ' THR . . . . . . . . . . . . . 72.0 p -136.52 -148.99 0.3 Allowed 'General case' 0 N--CA 1.429 -1.513 0 C-N-CA 125.702 1.601 . . . . 1.0 110.503 -152.206 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 12.2 tmtt? -60.7 -67.5 0.39 Allowed 'General case' 0 N--CA 1.429 -1.498 0 C-N-CA 126.654 1.982 . . . . 1.0 112.675 173.817 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 13.1 tt0 -131.0 -22.04 2.62 Favored 'General case' 0 N--CA 1.43 -1.433 0 O-C-N 121.098 -1.001 . . . . 1.0 113.458 176.97 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . -82.98 -99.29 0.52 Allowed Glycine 0 N--CA 1.43 -1.719 0 O-C-N 119.838 -1.789 . . . . 1.0 114.033 -176.397 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 69.3 149.01 0.29 Allowed Glycine 0 N--CA 1.43 -1.72 0 N-CA-C 116.261 1.264 . . . . 1.0 116.261 -171.951 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 1.4 t80 -166.44 169.19 14.16 Favored 'General case' 0 N--CA 1.43 -1.448 0 N-CA-C 107.408 -1.33 . . . . 1.0 107.408 168.262 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 3.7 p-80 -95.23 159.29 15.08 Favored 'General case' 0 N--CA 1.429 -1.492 0 O-C-N 120.17 -1.582 . . . . 1.0 111.811 172.817 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 43.5 p90 -138.48 133.49 32.78 Favored 'General case' 0 N--CA 1.43 -1.471 0 N-CA-C 114.817 1.414 . . . . 1.0 114.817 -158.825 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 43.0 m-20 -105.43 176.28 5.22 Favored 'General case' 0 N--CA 1.431 -1.422 0 C-N-CA 126.361 1.865 . . . . 1.0 109.445 -176.403 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 45.8 tp -110.6 125.46 53.43 Favored 'General case' 0 N--CA 1.431 -1.397 0 O-C-N 119.588 -1.945 . . . . 1.0 110.551 177.974 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 94.5 mttt -73.91 -99.13 0.01 OUTLIER 'General case' 0 N--CA 1.43 -1.472 0 O-C-N 120.645 -1.285 . . . . 1.0 112.238 154.3 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -131.46 -57.51 0.09 OUTLIER Glycine 0 N--CA 1.43 -1.74 0 O-C-N 120.165 -1.584 . . . . 1.0 113.544 -174.547 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 48.6 m-20 -111.34 3.63 18.41 Favored 'General case' 0 N--CA 1.43 -1.469 0 C-N-CA 125.724 1.609 . . . . 1.0 109.99 178.535 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -147.91 120.89 8.79 Favored 'General case' 0 N--CA 1.429 -1.522 0 N-CA-C 105.484 -2.043 . . . . 1.0 105.484 -162.038 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 78' ' ' TRP . . . . . . . . . . . . . 71.5 m95 -84.41 124.39 31.27 Favored 'General case' 0 N--CA 1.431 -1.406 0 N-CA-C 104.099 -2.556 . . . . 1.0 104.099 168.435 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 79' ' ' ILE . . . . . 0.404 ' HB ' ' HB2' ' A' ' 85' ' ' GLU . 0.1 OUTLIER -126.01 139.17 52.29 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.474 0 O-C-N 119.92 -1.738 . . . . 1.0 110.304 -166.589 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 79.9 m -78.09 134.79 37.67 Favored 'General case' 0 N--CA 1.429 -1.488 0 O-C-N 119.837 -1.789 . . . . 1.0 113.306 -174.767 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 25.7 t0 -81.86 55.07 2.62 Favored 'General case' 0 N--CA 1.431 -1.413 0 O-C-N 120.145 -1.597 . . . . 1.0 113.532 -174.401 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -149.82 -152.1 0.42 Allowed 'General case' 0 N--CA 1.43 -1.466 0 O-C-N 120.126 -1.609 . . . . 1.0 108.381 -175.7 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 58.2 p -72.62 -19.74 61.4 Favored 'General case' 0 N--CA 1.43 -1.451 0 O-C-N 119.909 -1.745 . . . . 1.0 114.582 -175.216 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -132.36 78.98 0.35 Allowed Glycine 0 N--CA 1.432 -1.628 0 N-CA-C 109.189 -1.564 . . . . 1.0 109.189 -173.93 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 85' ' ' GLU . . . . . 0.404 ' HB2' ' HB ' ' A' ' 79' ' ' ILE . 11.8 pt-20 -73.42 88.38 1.59 Allowed 'General case' 0 N--CA 1.431 -1.411 0 N-CA-C 116.334 1.976 . . . . 1.0 116.334 -174.566 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 24.8 m -166.63 124.52 1.37 Allowed 'General case' 0 N--CA 1.429 -1.498 0 C-N-CA 125.245 1.418 . . . . 1.0 111.485 172.942 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 3.0 t80 -53.63 -81.97 0.01 OUTLIER 'General case' 0 N--CA 1.43 -1.449 0 C-N-CA 127.031 2.133 . . . . 1.0 116.129 176.617 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 88' ' ' TRP . . . . . . . . . . . . . 0.3 OUTLIER -64.38 -35.11 79.83 Favored 'General case' 0 N--CA 1.43 -1.458 0 O-C-N 120.343 -1.473 . . . . 1.0 114.095 -170.344 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -68.01 -33.1 73.96 Favored 'General case' 0 N--CA 1.429 -1.476 0 C-N-CA 125.136 1.374 . . . . 1.0 114.64 175.577 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 52.8 tp -71.78 -44.44 63.99 Favored 'General case' 0 N--CA 1.429 -1.478 0 O-C-N 119.387 -2.071 . . . . 1.0 110.791 173.204 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 8.1 tt -52.54 -43.12 64.98 Favored 'General case' 0 N--CA 1.43 -1.474 0 C-N-CA 126.571 1.948 . . . . 1.0 113.575 170.985 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 4.9 tt0 -53.09 -60.31 3.45 Favored 'General case' 0 N--CA 1.429 -1.488 0 C-N-CA 126.503 1.921 . . . . 1.0 112.548 168.216 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 20.1 tt0 -52.28 -48.26 65.39 Favored 'General case' 0 N--CA 1.431 -1.414 0 C-N-CA 125.032 1.333 . . . . 1.0 114.314 -177.51 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -55.92 -57.53 11.69 Favored 'General case' 0 N--CA 1.429 -1.519 0 C-N-CA 127.961 2.504 . . . . 1.0 116.16 171.246 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -73.79 -37.0 65.1 Favored 'General case' 0 N--CA 1.43 -1.44 0 O-C-N 118.945 -2.347 . . . . 1.0 112.891 -173.964 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 3.1 m -62.35 -40.12 95.36 Favored 'General case' 0 N--CA 1.43 -1.465 0 C-N-CA 125.141 1.376 . . . . 1.0 112.533 170.8 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 3.0 pt20 -67.59 -30.85 70.56 Favored 'General case' 0 N--CA 1.429 -1.502 0 O-C-N 120.424 -1.422 . . . . 1.0 113.989 178.05 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 15.9 mm-40 -74.07 -47.43 36.62 Favored 'General case' 0 N--CA 1.43 -1.469 0 N-CA-C 114.816 1.413 . . . . 1.0 114.816 168.729 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -72.19 -42.45 65.8 Favored 'General case' 0 N--CA 1.429 -1.502 0 N-CA-C 115.933 1.827 . . . . 1.0 115.933 -176.502 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . 92.31 29.07 11.7 Favored Glycine 0 N--CA 1.43 -1.766 0 C-N-CA 125.078 1.323 . . . . 1.0 113.159 -177.442 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 11.9 pt-20 -167.95 171.65 9.58 Favored 'General case' 0 N--CA 1.43 -1.432 0 O-C-N 121.514 -0.992 . . . . 1.0 110.372 -170.256 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 16.5 m -67.48 121.46 15.86 Favored 'General case' 0 N--CA 1.43 -1.433 0 O-C-N 120.827 -1.171 . . . . 1.0 111.144 176.531 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 9.8 p -98.39 160.42 3.15 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.492 0 C-N-CA 125.107 1.363 . . . . 1.0 107.984 -178.799 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 11.5 t -109.08 107.51 17.85 Favored 'General case' 0 N--CA 1.429 -1.513 0 O-C-N 121.025 -1.047 . . . . 1.0 112.875 -165.706 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 34.5 p90 -138.95 -37.54 0.52 Allowed 'General case' 0 N--CA 1.431 -1.398 0 O-C-N 120.515 -1.365 . . . . 1.0 113.056 -172.232 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 4.9 mtm180 . . . . . 0 C--O 1.259 1.595 0 C-N-CA 124.857 1.263 . . . . 1.0 110.034 177.484 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 51.9 mtt . . . . . 0 CA--C 1.491 -1.293 0 CA-C-O 121.242 0.544 . . . . 1.0 112.282 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 48.8 m-80 49.59 83.66 0.04 OUTLIER 'General case' 0 N--CA 1.43 -1.46 0 N-CA-C 117.309 2.337 . . . . 1.0 117.309 173.093 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 30.4 t70 -56.26 -49.4 74.3 Favored 'General case' 0 N--CA 1.43 -1.433 0 C-N-CA 125.978 1.711 . . . . 1.0 113.189 -178.225 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 12.9 m -58.95 -38.15 78.38 Favored 'General case' 0 N--CA 1.43 -1.462 0 N-CA-C 114.598 1.333 . . . . 1.0 114.598 -179.812 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 29.0 tt0 -67.67 -54.44 19.52 Favored 'General case' 0 N--CA 1.431 -1.411 0 C-N-CA 125.04 1.336 . . . . 1.0 111.907 176.051 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 1.1 t80 -49.23 -47.79 46.09 Favored 'General case' 0 N--CA 1.431 -1.4 0 C-N-CA 125.93 1.692 . . . . 1.0 113.94 170.182 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 1.0 OUTLIER -57.12 -50.17 73.62 Favored 'General case' 0 N--CA 1.431 -1.392 0 O-C-N 120.239 -1.538 . . . . 1.0 114.231 173.905 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 26.3 ttm-85 -62.24 -47.67 83.38 Favored 'General case' 0 N--CA 1.431 -1.407 0 CA-C-N 119.463 1.028 . . . . 1.0 112.406 -179.376 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 90.6 mt -55.17 -57.53 11.37 Favored 'General case' 0 N--CA 1.429 -1.481 0 C-N-CA 126.534 1.933 . . . . 1.0 112.167 173.172 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -53.52 -47.36 69.99 Favored 'General case' 0 N--CA 1.429 -1.516 0 O-C-N 120.563 -1.335 . . . . 1.0 114.024 178.863 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -61.85 -40.69 96.22 Favored 'General case' 0 N--CA 1.43 -1.437 0 N-CA-C 113.942 1.089 . . . . 1.0 113.942 178.643 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . 0.25 11.6 pt20 -71.87 -38.41 70.04 Favored 'General case' 0 N--CA 1.43 -1.467 0 N-CA-C 114.833 1.42 . . . . 1.0 114.833 175.452 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 82.8 mt -62.13 -50.5 71.66 Favored 'General case' 0 N--CA 1.43 -1.452 0 O-C-N 120.186 -1.572 . . . . 1.0 111.171 174.67 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 0.1 OUTLIER -52.25 -49.97 62.99 Favored 'General case' 0 N--CA 1.43 -1.445 0 C-N-CA 126.079 1.752 . . . . 1.0 111.903 177.264 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 55.2 tp -58.79 -54.01 51.95 Favored 'General case' 0 N--CA 1.431 -1.395 0 C-N-CA 125.441 1.496 . . . . 1.0 113.554 174.413 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 75.0 m -58.68 -57.16 14.22 Favored 'General case' 0 N--CA 1.431 -1.404 0 C-N-CA 124.716 1.207 . . . . 1.0 113.296 178.442 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 29.8 mt -50.74 -52.9 15.25 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.402 0 C-N-CA 125.711 1.604 . . . . 1.0 114.32 176.072 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 29.9 tt0 -57.96 -54.09 50.9 Favored 'General case' 0 N--CA 1.43 -1.429 0 O-C-N 120.709 -1.244 . . . . 1.0 113.639 178.169 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 7.0 tp10 -75.42 -32.45 60.72 Favored 'General case' 0 N--CA 1.431 -1.415 0 N-CA-C 114.838 1.422 . . . . 1.0 114.838 -172.142 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 20.0 tpt180 -75.87 -33.48 59.99 Favored 'General case' 0 N--CA 1.43 -1.434 0 O-C-N 119.943 -1.723 . . . . 1.0 112.981 175.686 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -76.66 -31.83 57.58 Favored 'General case' 0 N--CA 1.43 -1.428 0 O-C-N 120.269 -1.519 . . . . 1.0 110.927 175.659 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 19.7 t70 -58.86 -65.39 0.67 Allowed 'General case' 0 N--CA 1.43 -1.434 0 C-N-CA 125.959 1.704 . . . . 1.0 113.976 168.38 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 32.3 t70 -84.92 112.31 20.45 Favored 'General case' 0 N--CA 1.43 -1.433 0 CA-C-O 123.11 1.433 . . . . 1.0 111.426 178.826 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 24' ' ' TRP . . . . . . . . . . . . . 51.8 t-105 -132.95 -166.1 1.71 Allowed 'General case' 0 N--CA 1.431 -1.412 0 C-N-CA 125.429 1.492 . . . . 1.0 108.108 -174.167 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 5.7 t0 -138.86 85.59 2.09 Favored 'General case' 0 N--CA 1.429 -1.481 0 N-CA-C 106.006 -1.85 . . . . 1.0 106.006 172.211 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -161.12 -159.83 10.29 Favored Glycine 0 N--CA 1.43 -1.74 0 O-C-N 120.428 -1.42 . . . . 1.0 112.916 -173.315 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 9.1 t0 -113.1 -34.59 5.65 Favored 'General case' 0 N--CA 1.431 -1.397 0 C-N-CA 125.387 1.475 . . . . 1.0 111.096 -177.705 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 49.3 m -60.28 149.82 32.26 Favored 'General case' 0 N--CA 1.43 -1.43 0 C-N-CA 125.79 1.636 . . . . 1.0 113.602 178.032 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 2.4 t70 -110.11 151.54 27.11 Favored 'General case' 0 N--CA 1.431 -1.407 0 O-C-N 120.966 -1.084 . . . . 1.0 109.356 174.277 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 50.8 mm -139.83 115.68 8.49 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.426 0 C-N-CA 126.811 2.044 . . . . 1.0 105.487 -161.245 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 41.8 m-20 -119.55 100.65 7.41 Favored 'General case' 0 N--CA 1.432 -1.373 0 CA-C-O 122.126 0.965 . . . . 1.0 109.27 167.51 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 24.7 t -73.95 137.73 43.75 Favored 'General case' 0 N--CA 1.43 -1.446 0 O-C-N 119.372 -2.08 . . . . 1.0 111.363 162.585 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -94.66 149.51 21.17 Favored 'General case' 0 N--CA 1.429 -1.507 0 C-N-CA 126.625 1.97 . . . . 1.0 108.679 179.81 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 3.3 mp -135.51 106.6 6.5 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.439 0 CA-C-O 123.787 1.756 . . . . 1.0 109.278 -171.345 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 4.7 m120 -113.09 172.34 7.0 Favored 'General case' 0 N--CA 1.431 -1.418 0 N-CA-C 106.829 -1.545 . . . . 1.0 106.829 167.109 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -69.75 85.09 0.28 Allowed Glycine 0 N--CA 1.43 -1.729 0 N-CA-C 117.019 1.568 . . . . 1.0 117.019 -168.745 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 94.87 12.47 55.42 Favored Glycine 0 N--CA 1.431 -1.698 0 C-N-CA 126.19 1.853 . . . . 1.0 112.882 -177.27 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 44.9 t -132.28 131.88 60.72 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.452 0 N-CA-C 107.083 -1.451 . . . . 1.0 107.083 -175.6 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 68.5 mt -121.77 137.94 54.56 Favored 'General case' 0 N--CA 1.43 -1.436 0 O-C-N 120.698 -1.251 . . . . 1.0 109.558 174.187 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -128.68 107.18 9.47 Favored 'General case' 0 N--CA 1.432 -1.372 0 N-CA-C 107.193 -1.41 . . . . 1.0 107.193 -174.654 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 42.6 mt -89.55 122.67 41.15 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.451 0 O-C-N 119.456 -2.027 . . . . 1.0 109.355 -167.397 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 27.2 p -123.9 135.01 53.43 Favored 'General case' 0 N--CA 1.43 -1.465 0 CA-C-O 122.114 0.959 . . . . 1.0 113.389 -179.741 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 43' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -121.41 171.74 8.55 Favored 'General case' 0 N--CA 1.43 -1.459 0 O-C-N 120.444 -1.41 . . . . 1.0 111.534 173.406 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 14.7 mm-40 -52.12 -32.69 36.51 Favored 'General case' 0 N--CA 1.43 -1.446 0 N-CA-C 118.495 2.776 . . . . 1.0 118.495 -169.694 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 31.5 t30 -66.05 -12.41 55.11 Favored 'General case' 0 N--CA 1.432 -1.367 0 N-CA-C 114.783 1.401 . . . . 1.0 114.783 175.712 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 90.04 17.27 54.18 Favored Glycine 0 N--CA 1.43 -1.718 0 O-C-N 120.14 -1.6 . . . . 1.0 111.528 -179.485 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 73.4 m -91.72 157.8 16.72 Favored 'General case' 0 N--CA 1.429 -1.486 0 C-N-CA 126.019 1.728 . . . . 1.0 110.907 -174.074 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 5.2 ptmm? -149.21 121.47 8.39 Favored 'General case' 0 N--CA 1.431 -1.381 0 N-CA-C 114.089 1.144 . . . . 1.0 114.089 -151.211 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 1.7 mm -116.1 134.91 57.98 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.491 0 N-CA-C 107.012 -1.477 . . . . 1.0 107.012 176.415 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 3.5 tp -125.13 119.67 56.3 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.504 0 CA-C-N 121.887 2.13 . . . . 1.0 110.543 -179.969 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 3.9 mt -130.57 125.83 59.61 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.394 0 CA-C-O 123.588 1.661 . . . . 1.0 113.098 -167.728 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 7.6 t-20 -161.8 175.73 11.62 Favored 'General case' 0 N--CA 1.43 -1.445 0 N-CA-C 105.661 -1.977 . . . . 1.0 105.661 -171.302 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 1.4 ptp85 -108.86 153.97 22.77 Favored 'General case' 0 N--CA 1.43 -1.471 0 O-C-N 120.04 -1.663 . . . . 1.0 111.966 -173.444 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 15.7 mm100 -103.92 86.05 2.52 Favored 'General case' 0 N--CA 1.43 -1.429 0 C-N-CA 125.0 1.32 . . . . 1.0 108.187 173.209 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . 0.281 28.6 tt0 -61.43 -39.34 61.38 Favored Pre-proline 0 N--CA 1.43 -1.46 0 N-CA-C 118.923 2.934 . . . . 1.0 118.923 -161.682 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 77.0 Cg_exo -64.62 -7.71 15.33 Favored 'Trans proline' 0 C--N 1.298 -2.086 0 CA-C-N 126.474 3.348 . . . . 1.0 117.198 -178.447 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . 0.503 HD12 HE22 ' A' ' 59' ' ' GLN . 61.4 mt -117.75 -113.08 0.34 Allowed 'General case' 0 N--CA 1.43 -1.437 0 CA-C-N 120.115 1.325 . . . . 1.0 110.395 173.972 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 58' ' ' HIS . . . . . 0.439 ' C ' ' CD2' ' A' ' 58' ' ' HIS . 7.8 t60 -146.53 -30.23 0.37 Allowed 'General case' 0 N--CA 1.431 -1.411 0 C-N-CA 124.784 1.234 . . . . 1.0 111.484 -168.221 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 59' ' ' GLN . . . . . 0.503 HE22 HD12 ' A' ' 57' ' ' LEU . 16.5 pm0 -80.88 152.58 28.06 Favored 'General case' 0 N--CA 1.431 -1.409 0 CA-C-O 124.977 2.323 . . . . 1.0 116.845 -169.967 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 59.5 t -91.29 147.29 5.35 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.469 0 CA-C-N 113.008 -1.905 . . . . 1.0 108.096 171.615 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 61' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -106.8 148.06 28.94 Favored 'General case' 0 N--CA 1.43 -1.462 0 O-C-N 120.139 -1.601 . . . . 1.0 107.972 175.681 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 2.4 pt? -146.49 115.93 7.11 Favored 'General case' 0 N--CA 1.428 -1.536 0 CA-C-O 123.248 1.499 . . . . 1.0 111.122 166.019 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . 0.415 ' HA ' ' HA2' ' A' ' 68' ' ' GLY . . . -100.29 140.27 34.78 Favored 'General case' 0 N--CA 1.431 -1.39 0 CA-C-O 123.255 1.502 . . . . 1.0 113.779 172.644 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 64' ' ' THR . . . . . . . . . . . . . 9.0 t -151.86 -167.15 2.7 Favored 'General case' 0 N--CA 1.431 -1.421 0 C-N-CA 126.364 1.866 . . . . 1.0 107.318 -169.137 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 33.1 tptt -69.49 -29.96 67.73 Favored 'General case' 0 N--CA 1.43 -1.466 0 N-CA-C 116.286 1.958 . . . . 1.0 116.286 -165.847 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 11.1 tt0 -77.7 -13.3 59.94 Favored 'General case' 0 N--CA 1.429 -1.485 0 O-C-N 120.208 -1.557 . . . . 1.0 113.874 176.079 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 146.67 -56.42 0.51 Allowed Glycine 0 N--CA 1.43 -1.748 0 O-C-N 119.529 -1.982 . . . . 1.0 112.133 174.123 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . 0.415 ' HA2' ' HA ' ' A' ' 63' ' ' ALA . . . 123.67 124.44 2.9 Favored Glycine 0 N--CA 1.43 -1.714 0 O-C-N 121.723 -0.869 . . . . 1.0 115.002 -176.704 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 19.6 m-30 -120.56 170.16 9.67 Favored 'General case' 0 N--CA 1.43 -1.442 0 C-N-CA 125.727 1.611 . . . . 1.0 107.392 -177.227 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 28.4 p80 -114.54 159.34 20.51 Favored 'General case' 0 N--CA 1.43 -1.434 0 O-C-N 119.796 -1.815 . . . . 1.0 111.905 170.221 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 71' ' ' PHE . . . . . . . . . . . . 0.259 20.0 t80 -118.48 113.27 21.08 Favored 'General case' 0 N--CA 1.432 -1.361 0 C-N-CA 127.291 2.236 . . . . 1.0 108.587 -160.607 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -128.58 166.45 18.83 Favored 'General case' 0 N--CA 1.429 -1.49 0 C-N-CA 124.713 1.205 . . . . 1.0 108.689 -170.371 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -112.35 121.31 44.5 Favored 'General case' 0 N--CA 1.43 -1.447 0 O-C-N 119.02 -2.3 . . . . 1.0 112.865 -163.633 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 12.1 mmtm -110.97 79.64 1.22 Allowed 'General case' 0 N--CA 1.431 -1.399 0 O-C-N 120.057 -1.652 . . . . 1.0 110.143 167.572 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . 72.36 -79.92 0.64 Allowed Glycine 0 N--CA 1.431 -1.675 0 C-N-CA 125.668 1.604 . . . . 1.0 115.93 173.452 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -116.75 -7.49 11.49 Favored 'General case' 0 N--CA 1.429 -1.504 0 C-N-CA 125.233 1.413 . . . . 1.0 110.862 -178.739 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 53.9 mt-10 -131.16 125.47 33.11 Favored 'General case' 0 N--CA 1.43 -1.469 0 N-CA-C 105.537 -2.023 . . . . 1.0 105.537 -171.687 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 78' ' ' TRP . . . . . 0.411 ' HB2' ' HB3' ' A' ' 87' ' ' PHE . 71.3 m95 -82.82 111.51 18.8 Favored 'General case' 0 N--CA 1.43 -1.428 0 N-CA-C 107.391 -1.337 . . . . 1.0 107.391 174.472 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 8.6 mt -90.21 124.85 43.04 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.433 0 CA-C-O 124.032 1.872 . . . . 1.0 107.437 178.373 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 80' ' ' CYS . . . . . 0.409 ' HB2' ' HB2' ' A' ' 85' ' ' GLU . 38.5 m -76.96 121.36 23.36 Favored 'General case' 0 N--CA 1.429 -1.496 0 CA-C-N 113.971 -1.468 . . . . 1.0 108.7 177.935 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 11.8 t70 -71.75 -41.62 68.23 Favored 'General case' 0 N--CA 1.429 -1.51 0 N-CA-C 114.634 1.346 . . . . 1.0 114.634 -154.223 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 24.1 mmt85 -70.94 129.63 39.52 Favored 'General case' 0 N--CA 1.43 -1.46 0 O-C-N 121.195 -0.941 . . . . 1.0 109.057 173.545 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 83' ' ' SER . . . . . . . . . . . . 0.257 29.6 t 69.8 -71.09 0.13 Allowed 'General case' 0 N--CA 1.43 -1.446 0 C-N-CA 125.91 1.684 . . . . 1.0 112.21 -159.482 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 120.85 68.09 0.27 Allowed Glycine 0 N--CA 1.431 -1.663 0 N-CA-C 108.066 -2.013 . . . . 1.0 108.066 -168.467 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 85' ' ' GLU . . . . . 0.409 ' HB2' ' HB2' ' A' ' 80' ' ' CYS . 60.1 mm-40 -113.83 -145.48 0.4 Allowed 'General case' 0 N--CA 1.429 -1.477 0 C-N-CA 124.737 1.215 . . . . 1.0 108.306 -171.252 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 93.2 m -150.57 133.99 16.38 Favored 'General case' 0 N--CA 1.43 -1.474 0 O-C-N 119.561 -1.962 . . . . 1.0 108.945 -160.685 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 87' ' ' PHE . . . . . 0.411 ' HB3' ' HB2' ' A' ' 78' ' ' TRP 0.278 0.0 OUTLIER -39.91 -85.95 0.0 OUTLIER 'General case' 0 N--CA 1.43 -1.447 0 N-CA-C 120.373 3.471 . . . . 1.0 120.373 179.923 . . . . . . . . 4 4 . 1 . 012 nuclear nobuild full ' A' A ' 88' ' ' TRP . . . . . . . . . . . . . 65.9 m95 -68.85 -29.62 67.97 Favored 'General case' 0 N--CA 1.43 -1.433 0 O-C-N 120.682 -1.261 . . . . 1.0 113.321 -172.956 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 24.0 m-20 -71.31 -38.81 71.73 Favored 'General case' 0 N--CA 1.429 -1.485 0 O-C-N 120.987 -1.071 . . . . 1.0 113.607 175.87 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 45.3 tp -69.06 -44.07 73.35 Favored 'General case' 0 N--CA 1.43 -1.447 0 O-C-N 119.817 -1.802 . . . . 1.0 110.658 175.987 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 10.2 tt -49.14 -50.55 37.0 Favored 'General case' 0 N--CA 1.43 -1.429 0 C-N-CA 126.494 1.917 . . . . 1.0 113.371 172.272 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 37.4 tt0 -54.97 -57.93 9.68 Favored 'General case' 0 N--CA 1.431 -1.41 0 C-N-CA 126.706 2.002 . . . . 1.0 113.133 171.694 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 30.4 tt0 -50.58 -48.27 57.65 Favored 'General case' 0 CA--C 1.488 -1.414 0 C-N-CA 127.337 2.255 . . . . 1.0 114.595 178.364 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -65.85 -45.96 80.25 Favored 'General case' 0 N--CA 1.431 -1.421 0 C-N-CA 127.39 2.276 . . . . 1.0 114.377 174.919 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -63.19 -43.87 96.98 Favored 'General case' 0 N--CA 1.43 -1.46 0 O-C-N 120.03 -1.669 . . . . 1.0 112.97 177.453 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 15.5 m -55.46 -43.41 75.43 Favored 'General case' 0 N--CA 1.43 -1.472 0 C-N-CA 126.17 1.788 . . . . 1.0 114.087 170.017 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 2.2 pt20 -72.41 -28.55 63.05 Favored 'General case' 0 N--CA 1.43 -1.439 0 N-CA-C 114.893 1.442 . . . . 1.0 114.893 177.154 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 14.3 mm-40 -66.91 -57.37 7.09 Favored 'General case' 0 N--CA 1.43 -1.47 0 O-C-N 120.906 -1.122 . . . . 1.0 111.992 171.235 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -80.02 -46.21 17.01 Favored 'General case' 0 N--CA 1.43 -1.448 0 N-CA-C 115.723 1.749 . . . . 1.0 115.723 -172.323 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . 87.6 49.52 3.86 Favored Glycine 0 N--CA 1.43 -1.721 0 O-C-N 120.935 -1.103 . . . . 1.0 112.048 -168.37 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 19.3 tt0 -164.81 159.53 18.59 Favored 'General case' 0 N--CA 1.429 -1.513 0 N-CA-C 106.252 -1.759 . . . . 1.0 106.252 -176.268 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 45.9 m -72.16 99.09 2.26 Favored 'General case' 0 N--CA 1.431 -1.406 0 O-C-N 119.554 -1.966 . . . . 1.0 110.681 166.227 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 46.2 t -110.51 112.7 41.71 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.433 0 N-CA-C 105.643 -1.984 . . . . 1.0 105.643 178.066 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 7.5 t -141.42 176.44 8.86 Favored 'General case' 0 N--CA 1.431 -1.413 0 O-C-N 121.328 -0.857 . . . . 1.0 109.591 -171.043 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 5.7 m-85 -111.69 -14.99 13.53 Favored 'General case' 0 N--CA 1.43 -1.439 0 C-N-CA 125.147 1.379 . . . . 1.0 110.288 174.418 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 37.1 mmt180 . . . . . 0 C--O 1.26 1.649 0 O-C-N 120.619 -1.301 . . . . 1.0 111.554 -176.87 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 46.8 ttp . . . . . 0 CA--C 1.489 -1.394 0 CA-C-O 121.079 0.466 . . . . 1.0 111.878 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 1.4 t-20 -106.7 -172.25 2.05 Favored 'General case' 0 N--CA 1.43 -1.426 0 O-C-N 120.294 -1.504 . . . . 1.0 113.251 -166.024 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . 0.266 1.3 p-10 -61.54 -48.9 78.93 Favored 'General case' 0 N--CA 1.431 -1.395 0 N-CA-C 116.153 1.908 . . . . 1.0 116.153 -164.752 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 63.2 p -61.97 -37.53 85.11 Favored 'General case' 0 N--CA 1.43 -1.44 0 C-N-CA 124.855 1.262 . . . . 1.0 113.04 179.146 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 28.9 mt-10 -69.85 -49.61 50.72 Favored 'General case' 0 N--CA 1.43 -1.435 0 C-N-CA 126.501 1.92 . . . . 1.0 112.102 179.725 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 2.3 m-85 -60.14 -38.6 83.6 Favored 'General case' 0 N--CA 1.431 -1.392 0 C-N-CA 124.177 0.991 . . . . 1.0 112.93 172.815 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 25.2 t60 -65.76 -48.38 72.02 Favored 'General case' 0 N--CA 1.43 -1.459 0 C-N-CA 125.744 1.618 . . . . 1.0 111.792 177.684 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 41.8 ttp-105 -56.03 -57.04 13.81 Favored 'General case' 0 N--CA 1.431 -1.425 0 C-N-CA 124.808 1.243 . . . . 1.0 112.888 177.708 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 36.9 mt -57.74 -42.06 83.12 Favored 'General case' 0 N--CA 1.431 -1.412 0 C-N-CA 124.212 1.005 . . . . 1.0 113.235 178.147 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -57.23 -57.96 10.32 Favored 'General case' 0 N--CA 1.431 -1.376 0 C-N-CA 124.3 1.04 . . . . 1.0 113.123 173.006 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 14.6 t70 -54.43 -45.75 73.07 Favored 'General case' 0 CA--C 1.489 -1.396 0 C-N-CA 125.613 1.565 . . . . 1.0 113.877 -177.005 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 18.4 mt-30 -57.23 -55.2 37.88 Favored 'General case' 0 N--CA 1.431 -1.424 0 N-CA-C 115.194 1.553 . . . . 1.0 115.194 170.694 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 3.1 pp -70.9 -37.04 72.96 Favored 'General case' 0 N--CA 1.43 -1.463 0 O-C-N 119.738 -1.851 . . . . 1.0 115.789 -178.113 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 0.8 OUTLIER -43.91 -60.15 1.96 Allowed 'General case' 0 N--CA 1.429 -1.489 0 C-N-CA 128.155 2.582 . . . . 1.0 112.425 165.859 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 50.7 tp -62.01 -42.72 99.46 Favored 'General case' 0 N--CA 1.429 -1.478 0 C-N-CA 124.299 1.04 . . . . 1.0 113.611 178.396 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 87.4 m -55.44 -52.07 64.8 Favored 'General case' 0 N--CA 1.431 -1.41 0 C-N-CA 125.609 1.564 . . . . 1.0 112.986 176.61 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 78.0 mt -58.78 -52.26 62.26 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.462 0 C-N-CA 125.825 1.65 . . . . 1.0 112.27 175.71 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 2.1 tt0 -56.2 -49.93 72.66 Favored 'General case' 0 N--CA 1.43 -1.432 0 N-CA-C 114.194 1.183 . . . . 1.0 114.194 -177.729 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 34.1 tt0 -65.32 -48.54 72.72 Favored 'General case' 0 N--CA 1.43 -1.436 0 O-C-N 120.928 -1.108 . . . . 1.0 113.637 178.361 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 7.9 tpt180 -61.8 -49.83 74.76 Favored 'General case' 0 N--CA 1.43 -1.454 0 C-N-CA 124.045 0.938 . . . . 1.0 112.647 -176.843 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 11.2 mp -72.62 -30.2 64.13 Favored 'General case' 0 N--CA 1.43 -1.45 0 C-N-CA 124.494 1.118 . . . . 1.0 113.733 -177.756 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 7.9 t70 -66.48 -51.97 51.08 Favored 'General case' 0 N--CA 1.429 -1.509 0 O-C-N 120.371 -1.455 . . . . 1.0 113.506 171.356 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 2.0 t70 -69.82 -24.35 63.45 Favored 'General case' 0 N--CA 1.429 -1.494 0 O-C-N 120.15 -1.594 . . . . 1.0 113.597 -176.525 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 24' ' ' TRP . . . . . . . . . . . . . 59.3 t-105 -45.9 -54.01 8.9 Favored 'General case' 0 N--CA 1.429 -1.492 0 C-N-CA 128.201 2.6 . . . . 1.0 116.989 178.366 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 28.6 t0 66.27 173.6 0.24 Allowed 'General case' 0 N--CA 1.429 -1.492 0 C-N-CA 127.033 2.133 . . . . 1.0 112.884 -175.406 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -168.3 -151.83 7.31 Favored Glycine 0 N--CA 1.429 -1.801 0 O-C-N 119.053 -2.279 . . . . 1.0 112.574 -172.599 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 36.7 t70 -83.45 -47.23 11.61 Favored 'General case' 0 N--CA 1.43 -1.427 0 N-CA-C 107.697 -1.223 . . . . 1.0 107.697 161.736 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 83.2 p -87.62 167.61 13.75 Favored 'General case' 0 N--CA 1.429 -1.506 0 C-N-CA 124.807 1.243 . . . . 1.0 110.988 173.566 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . 0.457 ' H ' ' HG2' ' A' ' 44' ' ' GLU . 2.9 t70 -110.09 179.21 4.17 Favored 'General case' 0 N--CA 1.43 -1.453 0 O-C-N 120.763 -1.211 . . . . 1.0 109.583 -173.016 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -157.61 129.24 0.95 Allowed 'Isoleucine or valine' 0 N--CA 1.43 -1.46 0 CA-C-O 123.117 1.437 . . . . 1.0 108.933 -161.874 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 26.7 m-20 -132.72 105.31 7.1 Favored 'General case' 0 N--CA 1.429 -1.489 0 C-N-CA 126.707 2.003 . . . . 1.0 110.343 170.041 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 10.4 t -85.23 142.44 29.41 Favored 'General case' 0 N--CA 1.43 -1.469 0 O-C-N 118.92 -2.362 . . . . 1.0 110.809 170.811 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 2.2 tp10 -113.5 137.88 50.92 Favored 'General case' 0 N--CA 1.428 -1.546 0 C-N-CA 124.13 0.972 . . . . 1.0 109.9 178.708 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 5.1 tp -117.44 121.03 66.63 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.428 0 C-N-CA 126.516 1.926 . . . . 1.0 107.079 178.759 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 32.0 m120 -124.77 -176.33 3.51 Favored 'General case' 0 N--CA 1.43 -1.45 0 C-N-CA 126.1 1.76 . . . . 1.0 108.52 168.31 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -65.52 91.08 0.13 Allowed Glycine 0 N--CA 1.43 -1.703 0 O-C-N 120.105 -1.622 . . . . 1.0 116.047 -171.0 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 85.65 2.93 86.62 Favored Glycine 0 N--CA 1.429 -1.815 0 C-N-CA 125.115 1.341 . . . . 1.0 113.898 -176.258 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 33.4 t -124.53 125.38 70.07 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.449 0 C-N-CA 124.045 0.938 . . . . 1.0 109.983 -168.88 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 27.7 mt -115.73 130.63 56.92 Favored 'General case' 0 N--CA 1.43 -1.462 0 CA-C-O 122.623 1.202 . . . . 1.0 108.239 165.242 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 5.2 p -120.87 119.44 32.67 Favored 'General case' 0 N--CA 1.429 -1.482 0 N-CA-C 106.995 -1.483 . . . . 1.0 106.995 170.773 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 33.5 mt -92.82 113.09 27.19 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.455 0 N-CA-C 106.8 -1.556 . . . . 1.0 106.8 -177.203 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -99.35 128.04 45.43 Favored 'General case' 0 N--CA 1.43 -1.464 0 N-CA-C 108.434 -0.95 . . . . 1.0 108.434 -175.979 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 43' ' ' PHE . . . . . . . . . . . . . 5.4 p90 -116.14 151.06 36.38 Favored 'General case' 0 N--CA 1.43 -1.435 0 N-CA-C 107.394 -1.336 . . . . 1.0 107.394 171.386 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . 0.457 ' HG2' ' H ' ' A' ' 29' ' ' ASP . 0.2 OUTLIER -71.18 -13.42 61.92 Favored 'General case' 0 N--CA 1.43 -1.444 0 N-CA-C 116.334 1.976 . . . . 1.0 116.334 -153.986 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 19.7 t-20 -64.95 -19.56 66.02 Favored 'General case' 0 N--CA 1.43 -1.447 0 C-N-CA 127.457 2.303 . . . . 1.0 113.219 172.909 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 102.32 13.81 29.85 Favored Glycine 0 N--CA 1.429 -1.796 0 O-C-N 120.37 -1.456 . . . . 1.0 114.186 170.145 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 3.5 m -112.3 174.02 6.08 Favored 'General case' 0 N--CA 1.43 -1.458 0 C-N-CA 124.473 1.109 . . . . 1.0 109.036 172.083 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 20.9 pttm -156.9 148.92 22.85 Favored 'General case' 0 N--CA 1.431 -1.393 0 O-C-N 120.938 -1.101 . . . . 1.0 113.378 -160.863 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 49' ' ' ILE . . . . . 0.415 HD13 HG23 ' A' ' 64' ' ' THR . 7.5 mm -97.13 138.44 22.07 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.454 0 N-CA-C 106.355 -1.72 . . . . 1.0 106.355 171.171 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 4.1 mm -122.77 115.89 47.21 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.473 0 CA-C-N 119.598 1.09 . . . . 1.0 110.233 -175.953 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 2.1 mt -129.4 126.22 63.19 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.501 0 O-C-N 120.536 -1.352 . . . . 1.0 110.61 176.868 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 52' ' ' ASN . . . . . 0.55 ' H ' ' HD1' ' A' ' 61' ' ' TRP . 15.1 p30 -151.2 165.47 33.82 Favored 'General case' 0 N--CA 1.429 -1.509 0 CA-C-O 122.971 1.367 . . . . 1.0 108.592 176.923 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 40.1 ptt85 -148.78 152.44 36.55 Favored 'General case' 0 N--CA 1.431 -1.41 0 CA-C-N 114.474 -1.239 . . . . 1.0 108.877 -172.67 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 68.8 mm-40 -116.4 107.99 15.48 Favored 'General case' 0 N--CA 1.429 -1.478 0 N-CA-C 107.026 -1.472 . . . . 1.0 107.026 171.46 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 15.5 tt0 -58.95 -41.61 89.45 Favored Pre-proline 0 N--CA 1.43 -1.435 0 N-CA-C 116.112 1.893 . . . . 1.0 116.112 -172.504 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 83.7 Cg_exo -69.25 -18.49 39.39 Favored 'Trans proline' 0 N--CA 1.433 -2.052 0 CA-C-N 126.173 3.24 . . . . 1.0 117.79 178.185 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . 0.381 3.9 pp -96.72 -14.41 22.05 Favored 'General case' 0 N--CA 1.431 -1.414 0 N-CA-C 116.744 2.127 . . . . 1.0 116.744 -170.766 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 5.9 m170 73.23 52.96 0.13 Allowed 'General case' 0 N--CA 1.43 -1.436 0 C-N-CA 125.003 1.321 . . . . 1.0 114.536 174.095 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 34.0 tt0 -162.05 158.26 24.66 Favored 'General case' 0 N--CA 1.43 -1.438 0 C-N-CA 124.515 1.126 . . . . 1.0 108.079 172.45 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 55.0 t -119.38 152.76 21.87 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.48 0 C-N-CA 126.106 1.762 . . . . 1.0 110.408 178.997 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 61' ' ' TRP . . . . . 0.55 ' HD1' ' H ' ' A' ' 52' ' ' ASN . 0.0 OUTLIER -104.84 152.59 22.42 Favored 'General case' 0 N--CA 1.43 -1.448 0 C-N-CA 125.463 1.505 . . . . 1.0 109.471 176.026 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -145.12 97.02 2.94 Favored 'General case' 0 N--CA 1.431 -1.401 0 O-C-N 120.804 -1.185 . . . . 1.0 110.548 -176.874 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -122.6 149.18 44.33 Favored 'General case' 0 N--CA 1.431 -1.416 0 O-C-N 119.708 -1.87 . . . . 1.0 115.993 179.508 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 64' ' ' THR . . . . . 0.415 HG23 HD13 ' A' ' 49' ' ' ILE . 5.9 m -151.24 -94.69 0.06 Allowed 'General case' 0 N--CA 1.429 -1.482 0 C-N-CA 125.504 1.522 . . . . 1.0 111.269 175.041 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 10.7 tmtt? -99.59 -44.26 6.2 Favored 'General case' 0 N--CA 1.43 -1.448 0 C-N-CA 125.217 1.407 . . . . 1.0 110.387 -172.555 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 33.3 mm-40 -70.33 -23.57 62.85 Favored 'General case' 0 N--CA 1.43 -1.469 0 N-CA-C 113.831 1.048 . . . . 1.0 113.831 -174.403 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 136.75 -39.62 1.62 Allowed Glycine 0 N--CA 1.43 -1.757 0 O-C-N 121.398 -0.814 . . . . 1.0 111.9 166.774 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 140.95 123.86 1.99 Allowed Glycine 0 N--CA 1.43 -1.718 0 CA-C-O 122.279 0.933 . . . . 1.0 113.434 -179.842 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 21.5 m-30 -115.55 170.09 8.68 Favored 'General case' 0 N--CA 1.431 -1.424 0 C-N-CA 126.383 1.873 . . . . 1.0 107.189 176.744 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -115.29 161.02 19.07 Favored 'General case' 0 N--CA 1.43 -1.451 0 O-C-N 120.366 -1.459 . . . . 1.0 110.032 168.2 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 71' ' ' PHE . . . . . . . . . . . . 0.279 28.7 t80 -140.1 126.16 19.75 Favored 'General case' 0 N--CA 1.431 -1.413 0 C-N-CA 123.836 0.854 . . . . 1.0 109.889 -151.437 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 35.0 m-20 -136.73 156.51 48.42 Favored 'General case' 0 N--CA 1.43 -1.453 0 CA-C-O 121.994 0.902 . . . . 1.0 111.48 179.401 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 67.9 tp -84.69 136.72 33.61 Favored 'General case' 0 N--CA 1.43 -1.454 0 O-C-N 120.411 -1.431 . . . . 1.0 111.757 173.007 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 72.4 mmtt -89.19 -86.17 0.19 Allowed 'General case' 0 N--CA 1.43 -1.455 0 C-N-CA 124.868 1.267 . . . . 1.0 110.282 161.907 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -138.09 -55.31 0.05 OUTLIER Glycine 0 N--CA 1.428 -1.856 0 O-C-N 120.723 -1.235 . . . . 1.0 112.732 175.451 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 78.7 m-20 -97.2 -20.15 18.12 Favored 'General case' 0 N--CA 1.43 -1.467 0 C-N-CA 124.663 1.185 . . . . 1.0 110.755 173.742 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 26.6 tt0 -133.98 121.33 21.47 Favored 'General case' 0 N--CA 1.43 -1.441 0 N-CA-C 107.168 -1.419 . . . . 1.0 107.168 -151.673 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 78' ' ' TRP . . . . . . . . . . . . . 48.7 m95 -83.72 107.14 15.96 Favored 'General case' 0 N--CA 1.431 -1.403 0 N-CA-C 106.626 -1.62 . . . . 1.0 106.626 167.251 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER -93.2 154.28 3.25 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.467 0 CA-C-O 123.425 1.583 . . . . 1.0 107.142 178.885 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 59.2 m -84.08 125.59 32.26 Favored 'General case' 0 N--CA 1.431 -1.422 0 O-C-N 120.65 -1.281 . . . . 1.0 108.153 173.191 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 38.5 t70 -69.57 -53.77 17.29 Favored 'General case' 0 N--CA 1.43 -1.46 0 C-N-CA 126.38 1.872 . . . . 1.0 110.621 -173.551 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -76.46 137.23 39.56 Favored 'General case' 0 N--CA 1.428 -1.535 0 C-N-CA 125.961 1.704 . . . . 1.0 108.515 177.655 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 48.9 m 73.11 -59.63 0.56 Allowed 'General case' 0 N--CA 1.429 -1.52 0 C-N-CA 125.966 1.707 . . . . 1.0 113.161 -170.846 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 112.09 92.28 2.05 Favored Glycine 0 N--CA 1.429 -1.767 0 N-CA-C 109.008 -1.637 . . . . 1.0 109.008 -177.522 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -153.22 -154.04 0.51 Allowed 'General case' 0 N--CA 1.429 -1.485 0 CA-C-N 118.67 1.235 . . . . 1.0 109.513 -170.409 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 51.7 m -150.38 131.57 14.48 Favored 'General case' 0 N--CA 1.429 -1.489 0 O-C-N 120.671 -1.268 . . . . 1.0 109.501 -157.451 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . 0.26 0.0 OUTLIER -36.53 -91.63 0.0 OUTLIER 'General case' 0 N--CA 1.43 -1.462 0 N-CA-C 121.45 3.87 . . . . 1.0 121.45 178.827 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 88' ' ' TRP . . . . . . . . . . . . . 91.6 m95 -63.68 -27.87 69.52 Favored 'General case' 0 N--CA 1.429 -1.509 0 O-C-N 120.009 -1.682 . . . . 1.0 113.146 -173.198 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 3.2 t70 -68.9 -44.25 73.59 Favored 'General case' 0 N--CA 1.431 -1.41 0 C-N-CA 126.125 1.77 . . . . 1.0 112.601 175.857 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 45.1 tp -66.05 -45.15 82.42 Favored 'General case' 0 N--CA 1.43 -1.469 0 O-C-N 120.44 -1.413 . . . . 1.0 111.037 177.57 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 26.3 tp -55.92 -43.14 77.07 Favored 'General case' 0 N--CA 1.43 -1.475 0 C-N-CA 124.528 1.131 . . . . 1.0 113.472 175.868 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 34.6 tt0 -60.53 -47.49 85.93 Favored 'General case' 0 N--CA 1.431 -1.412 0 C-N-CA 126.254 1.821 . . . . 1.0 112.889 173.036 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 24.0 tt0 -59.18 -54.32 48.23 Favored 'General case' 0 N--CA 1.429 -1.48 0 C-N-CA 126.652 1.981 . . . . 1.0 113.45 177.538 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -54.05 -41.89 68.61 Favored 'General case' 0 N--CA 1.429 -1.48 0 C-N-CA 127.972 2.509 . . . . 1.0 114.264 175.328 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -73.94 -51.72 15.17 Favored 'General case' 0 N--CA 1.43 -1.436 0 N-CA-C 114.781 1.4 . . . . 1.0 114.781 178.546 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 1.6 t -61.16 -26.35 67.64 Favored 'General case' 0 N--CA 1.43 -1.464 0 O-C-N 119.236 -2.165 . . . . 1.0 114.1 175.809 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 7.5 tp-100 -62.65 -70.0 0.23 Allowed 'General case' 0 N--CA 1.43 -1.453 0 C-N-CA 126.31 1.844 . . . . 1.0 112.431 168.139 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 18.4 mt-30 -76.98 -48.31 18.37 Favored 'General case' 0 N--CA 1.43 -1.434 0 N-CA-C 116.411 2.004 . . . . 1.0 116.411 -175.369 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -73.5 -36.5 65.77 Favored 'General case' 0 N--CA 1.431 -1.414 0 O-C-N 120.059 -1.651 . . . . 1.0 112.067 -177.464 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . 93.1 28.3 12.08 Favored Glycine 0 N--CA 1.43 -1.719 0 C-N-CA 123.927 0.775 . . . . 1.0 113.956 171.981 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 27.7 mt-10 -145.91 168.92 19.67 Favored 'General case' 0 N--CA 1.431 -1.421 0 O-C-N 121.821 -0.811 . . . . 1.0 111.401 -172.749 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 6.8 m -78.91 78.92 5.33 Favored 'General case' 0 N--CA 1.431 -1.399 0 CA-C-O 122.792 1.282 . . . . 1.0 110.61 173.554 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 47.4 t -93.05 93.36 4.13 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.436 0 C-N-CA 126.687 1.995 . . . . 1.0 106.73 174.571 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 7.9 t -140.47 166.37 24.89 Favored 'General case' 0 N--CA 1.429 -1.48 0 CA-C-N 115.324 -0.853 . . . . 1.0 110.609 -175.367 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -120.3 -12.79 8.97 Favored 'General case' 0 N--CA 1.43 -1.444 0 C-N-CA 125.061 1.345 . . . . 1.0 109.714 175.935 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 75.6 mtm180 . . . . . 0 C--O 1.26 1.617 0 O-C-N 120.519 -1.363 . . . . 1.0 111.839 -174.174 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 90.6 mtp . . . . . 0 CA--C 1.489 -1.377 0 N-CA-C 113.189 0.811 . . . . 1.0 113.189 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 7.3 m120 -59.18 -45.61 90.6 Favored 'General case' 0 N--CA 1.429 -1.481 0 C-N-CA 127.495 2.318 . . . . 1.0 114.117 -178.034 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 3.1 m-20 -59.33 -54.42 47.0 Favored 'General case' 0 N--CA 1.431 -1.391 0 C-N-CA 125.612 1.565 . . . . 1.0 111.656 176.581 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 23.1 t -57.7 -45.21 85.99 Favored 'General case' 0 N--CA 1.431 -1.411 0 C-N-CA 126.344 1.857 . . . . 1.0 113.558 177.01 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 88.0 tt0 -54.74 -60.51 3.26 Favored 'General case' 0 N--CA 1.431 -1.402 0 C-N-CA 126.08 1.752 . . . . 1.0 113.723 176.051 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 1.1 t80 -67.31 -25.21 65.91 Favored 'General case' 0 N--CA 1.43 -1.444 0 N-CA-C 115.4 1.63 . . . . 1.0 115.4 179.934 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 16.7 t60 -64.75 -46.01 84.03 Favored 'General case' 0 N--CA 1.43 -1.444 0 C-N-CA 125.935 1.694 . . . . 1.0 113.42 171.355 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 18.4 mmm180 -61.59 -48.89 78.88 Favored 'General case' 0 N--CA 1.431 -1.425 0 C-N-CA 124.958 1.303 . . . . 1.0 112.576 174.625 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 90.6 mt -57.07 -41.02 78.0 Favored 'General case' 0 N--CA 1.43 -1.431 0 C-N-CA 124.379 1.072 . . . . 1.0 113.133 174.449 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -58.88 -53.33 59.58 Favored 'General case' 0 N--CA 1.431 -1.413 0 C-N-CA 125.948 1.699 . . . . 1.0 113.349 176.304 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -56.04 -41.81 75.57 Favored 'General case' 0 N--CA 1.431 -1.399 0 N-CA-C 114.003 1.112 . . . . 1.0 114.003 176.432 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 97.1 mm-40 -63.0 -51.07 68.25 Favored 'General case' 0 N--CA 1.431 -1.415 0 N-CA-C 114.614 1.338 . . . . 1.0 114.614 174.961 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 3.6 pp -70.57 -39.72 73.74 Favored 'General case' 0 N--CA 1.429 -1.5 0 O-C-N 120.135 -1.603 . . . . 1.0 114.517 -179.925 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 0.2 OUTLIER -50.83 -49.89 57.78 Favored 'General case' 0 N--CA 1.43 -1.472 0 C-N-CA 125.789 1.636 . . . . 1.0 113.682 168.78 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 45.2 tp -62.51 -47.45 83.89 Favored 'General case' 0 N--CA 1.43 -1.461 0 O-C-N 121.402 -0.811 . . . . 1.0 112.673 177.167 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 20.2 m -64.75 -50.31 67.36 Favored 'General case' 0 N--CA 1.43 -1.43 0 C-N-CA 124.544 1.138 . . . . 1.0 114.069 -177.376 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 79.9 mt -54.62 -49.37 67.79 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.474 0 O-C-N 119.781 -1.825 . . . . 1.0 114.593 169.447 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 22.8 tt0 -59.35 -47.28 86.02 Favored 'General case' 0 N--CA 1.429 -1.495 0 O-C-N 120.555 -1.341 . . . . 1.0 112.175 177.006 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 3.5 tt0 -56.53 -40.63 75.4 Favored 'General case' 0 N--CA 1.43 -1.453 0 C-N-CA 125.053 1.341 . . . . 1.0 113.801 175.012 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 49.8 tpt85 -57.92 -51.05 71.23 Favored 'General case' 0 N--CA 1.429 -1.476 0 O-C-N 119.309 -2.119 . . . . 1.0 113.255 172.06 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 4.6 mm? -72.71 -47.15 49.5 Favored 'General case' 0 N--CA 1.431 -1.387 0 N-CA-C 114.329 1.233 . . . . 1.0 114.329 -176.924 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 19.0 t70 -74.4 -49.15 23.73 Favored 'General case' 0 N--CA 1.43 -1.448 0 C-N-CA 125.605 1.562 . . . . 1.0 114.092 -175.012 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 13.6 t70 -84.45 -39.75 18.56 Favored 'General case' 0 N--CA 1.43 -1.452 0 O-C-N 120.446 -1.408 . . . . 1.0 113.124 -170.944 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 24' ' ' TRP . . . . . . . . . . . . . 4.5 t90 -85.67 106.48 16.98 Favored 'General case' 0 N--CA 1.43 -1.44 0 O-C-N 119.803 -1.811 . . . . 1.0 108.982 172.38 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 1.4 t70 -80.95 -172.05 3.51 Favored 'General case' 0 N--CA 1.431 -1.418 0 CA-C-O 123.179 1.466 . . . . 1.0 113.645 -165.018 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -166.39 -171.05 32.09 Favored Glycine 0 N--CA 1.43 -1.745 0 O-C-N 119.815 -1.803 . . . . 1.0 111.637 -172.191 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 1.7 t70 -83.28 -39.12 21.24 Favored 'General case' 0 N--CA 1.43 -1.461 0 O-C-N 121.429 -1.042 . . . . 1.0 110.789 178.501 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 22.6 m -81.92 160.33 23.42 Favored 'General case' 0 N--CA 1.429 -1.482 0 CA-C-O 122.279 1.038 . . . . 1.0 111.709 174.36 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 1.8 t70 -76.59 175.85 8.89 Favored 'General case' 0 N--CA 1.43 -1.434 0 C-N-CA 125.205 1.402 . . . . 1.0 111.057 176.094 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 10.2 tp -159.74 115.22 0.16 Allowed 'Isoleucine or valine' 0 N--CA 1.43 -1.44 0 CA-C-O 123.54 1.638 . . . . 1.0 111.005 -167.254 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 36.9 m-20 -125.26 102.68 7.56 Favored 'General case' 0 N--CA 1.43 -1.459 0 O-C-N 120.648 -1.282 . . . . 1.0 109.696 169.129 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 36.7 m -94.14 125.14 38.59 Favored 'General case' 0 N--CA 1.429 -1.482 0 O-C-N 119.18 -2.2 . . . . 1.0 111.093 166.289 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -90.36 131.93 35.87 Favored 'General case' 0 N--CA 1.429 -1.493 0 C-N-CA 125.074 1.35 . . . . 1.0 110.906 -176.298 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 3.3 mm -105.56 105.77 19.29 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.489 0 C-N-CA 126.479 1.912 . . . . 1.0 106.238 -178.836 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -132.89 63.81 1.63 Allowed 'General case' 0 N--CA 1.429 -1.475 0 O-C-N 121.392 -0.818 . . . . 1.0 111.613 -176.129 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . 33.46 67.4 0.22 Allowed Glycine 0 N--CA 1.43 -1.748 0 C-N-CA 128.671 3.034 . . . . 1.0 119.559 169.467 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 114.89 -22.67 12.4 Favored Glycine 0 N--CA 1.431 -1.645 0 N-CA-C 111.031 -0.827 . . . . 1.0 111.031 -173.933 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 72.8 t -109.63 137.22 42.81 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.424 0 C-N-CA 124.676 1.19 . . . . 1.0 108.269 173.889 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 42.8 mt -119.57 129.75 54.8 Favored 'General case' 0 N--CA 1.43 -1.464 0 O-C-N 120.812 -1.18 . . . . 1.0 108.923 154.557 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -122.95 118.14 27.15 Favored 'General case' 0 N--CA 1.429 -1.48 0 CA-C-O 122.91 1.338 . . . . 1.0 108.237 177.103 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 81.7 mt -97.3 128.38 48.62 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.439 0 O-C-N 120.638 -1.289 . . . . 1.0 108.398 -172.763 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 69.5 p -129.62 122.19 28.58 Favored 'General case' 0 N--CA 1.429 -1.517 0 CA-C-O 122.018 0.913 . . . . 1.0 113.205 175.271 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 43' ' ' PHE . . . . . . . . . . . . . 5.2 p90 -120.49 167.73 12.07 Favored 'General case' 0 N--CA 1.431 -1.412 0 C-N-CA 125.003 1.321 . . . . 1.0 109.544 166.138 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 40.4 mt-10 -52.4 -36.1 53.37 Favored 'General case' 0 N--CA 1.431 -1.418 0 N-CA-C 118.63 2.826 . . . . 1.0 118.63 -171.308 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 74.1 m-20 -67.47 -4.22 10.75 Favored 'General case' 0 N--CA 1.429 -1.516 0 O-C-N 120.229 -1.545 . . . . 1.0 115.095 177.495 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 75.54 22.46 75.29 Favored Glycine 0 N--CA 1.432 -1.597 0 O-C-N 120.073 -1.642 . . . . 1.0 115.536 160.881 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 53.5 m -73.65 -47.06 42.77 Favored 'General case' 0 N--CA 1.43 -1.447 0 C-N-CA 124.622 1.169 . . . . 1.0 112.956 -175.175 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 86.0 mttt 75.54 107.55 0.08 Allowed 'General case' 0 N--CA 1.429 -1.479 0 C-N-CA 126.889 2.076 . . . . 1.0 114.768 170.697 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 2.7 mm -102.18 136.23 35.35 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.429 0 N-CA-C 107.367 -1.346 . . . . 1.0 107.367 -177.095 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 9.3 mm -126.18 105.25 14.18 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.437 0 C-N-CA 124.075 0.95 . . . . 1.0 109.359 -169.587 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 3.5 mt -126.88 128.25 70.63 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.416 0 O-C-N 120.249 -1.532 . . . . 1.0 109.936 -170.823 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 51.8 t-20 -161.87 170.84 18.74 Favored 'General case' 0 N--CA 1.43 -1.469 0 N-CA-C 105.197 -2.149 . . . . 1.0 105.197 -167.856 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -156.61 138.03 13.93 Favored 'General case' 0 N--CA 1.43 -1.465 0 O-C-N 121.185 -0.947 . . . . 1.0 113.194 -163.674 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 86.9 mm-40 -99.33 105.21 17.18 Favored 'General case' 0 N--CA 1.431 -1.416 0 C-N-CA 125.71 1.604 . . . . 1.0 109.096 166.574 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . 0.272 9.7 tt0 -65.64 -52.46 43.3 Favored Pre-proline 0 N--CA 1.431 -1.379 0 N-CA-C 116.891 2.182 . . . . 1.0 116.891 -164.419 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 51.7 Cg_exo -68.57 -21.0 40.33 Favored 'Trans proline' 0 C--N 1.299 -2.071 0 CA-C-N 126.3 3.286 . . . . 1.0 115.342 -177.591 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 32.3 mt -74.96 -25.52 58.92 Favored 'General case' 0 N--CA 1.429 -1.495 0 CA-C-N 119.507 1.048 . . . . 1.0 112.019 -174.955 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 25.5 m170 79.38 30.42 0.3 Allowed 'General case' 0 N--CA 1.431 -1.423 0 C-N-CA 128.056 2.543 . . . . 1.0 113.018 -178.767 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 65.1 mt-30 -120.02 132.63 55.53 Favored 'General case' 0 N--CA 1.43 -1.427 0 O-C-N 120.271 -1.518 . . . . 1.0 110.292 176.283 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 8.0 t -90.44 151.57 3.47 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.404 0 N-CA-C 106.515 -1.661 . . . . 1.0 106.515 163.178 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 61' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -111.38 145.65 38.52 Favored 'General case' 0 N--CA 1.43 -1.439 0 O-C-N 120.28 -1.512 . . . . 1.0 107.769 168.866 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 2.6 pt? -138.12 111.25 7.86 Favored 'General case' 0 N--CA 1.432 -1.361 0 O-C-N 120.966 -1.083 . . . . 1.0 108.299 173.471 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . 0.453 ' HA ' ' HA2' ' A' ' 68' ' ' GLY . . . -101.6 144.08 30.78 Favored 'General case' 0 N--CA 1.429 -1.48 0 CA-C-O 123.626 1.679 . . . . 1.0 112.291 169.808 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 64' ' ' THR . . . . . . . . . . . . . 39.1 p -150.61 -165.82 2.37 Favored 'General case' 0 N--CA 1.43 -1.431 0 CA-C-N 113.034 -1.894 . . . . 1.0 107.991 -145.973 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 11.7 mmtt -65.13 -43.37 92.17 Favored 'General case' 0 N--CA 1.43 -1.47 0 N-CA-C 115.025 1.491 . . . . 1.0 115.025 168.583 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 29.6 mp0 -79.12 -25.56 42.94 Favored 'General case' 0 N--CA 1.43 -1.462 0 O-C-N 120.208 -1.558 . . . . 1.0 115.075 -170.208 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 159.69 -48.5 0.4 Allowed Glycine 0 N--CA 1.43 -1.735 0 O-C-N 120.37 -1.456 . . . . 1.0 114.557 176.001 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . 0.453 ' HA2' ' HA ' ' A' ' 63' ' ' ALA . . . 120.39 121.36 2.87 Favored Glycine 0 N--CA 1.43 -1.725 0 CA-C-O 122.569 1.094 . . . . 1.0 114.901 -179.575 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 23.0 m-30 -122.37 171.09 9.31 Favored 'General case' 0 N--CA 1.429 -1.493 0 C-N-CA 125.499 1.52 . . . . 1.0 108.879 -177.253 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 70' ' ' HIS . . . . . 0.426 ' CE1' ' OD2' ' A' ' 81' ' ' ASP . 4.5 p80 -122.57 161.73 23.15 Favored 'General case' 0 N--CA 1.43 -1.434 0 O-C-N 120.293 -1.505 . . . . 1.0 109.384 169.102 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 71' ' ' PHE . . . . . . . . . . . . 0.286 37.3 t80 -139.43 122.29 16.59 Favored 'General case' 0 N--CA 1.431 -1.398 0 C-N-CA 124.116 0.967 . . . . 1.0 111.57 -145.953 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 11.9 m-20 -129.16 148.86 51.13 Favored 'General case' 0 N--CA 1.43 -1.426 0 C-N-CA 125.329 1.452 . . . . 1.0 113.044 -177.312 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 3.0 tm? -84.42 114.64 22.05 Favored 'General case' 0 N--CA 1.43 -1.457 0 C-N-CA 127.041 2.136 . . . . 1.0 111.699 -179.592 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 76.7 tttt -89.48 -52.6 4.94 Favored 'General case' 0 N--CA 1.43 -1.47 0 O-C-N 120.959 -1.088 . . . . 1.0 110.931 174.463 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -164.65 -78.79 0.04 OUTLIER Glycine 0 N--CA 1.43 -1.76 0 O-C-N 120.688 -1.258 . . . . 1.0 114.069 177.052 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 50.9 m-20 -96.03 -5.25 41.5 Favored 'General case' 0 N--CA 1.43 -1.45 0 O-C-N 120.366 -1.667 . . . . 1.0 111.357 -176.634 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 5.0 mt-10 -159.05 161.27 36.49 Favored 'General case' 0 CA--C 1.488 -1.404 0 N-CA-C 101.428 -3.545 . . . . 1.0 101.428 -176.286 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 78' ' ' TRP . . . . . . . . . . . . . 23.6 m95 -94.44 142.15 27.76 Favored 'General case' 0 N--CA 1.43 -1.439 0 N-CA-C 104.409 -2.441 . . . . 1.0 104.409 175.066 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 0.6 OUTLIER -93.71 149.93 4.14 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.399 0 N-CA-C 105.374 -2.084 . . . . 1.0 105.374 169.844 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 80' ' ' CYS . . . . . 0.417 ' HB2' ' HB2' ' A' ' 85' ' ' GLU . 90.0 m -88.61 114.39 25.18 Favored 'General case' 0 N--CA 1.43 -1.474 0 N-CA-C 106.383 -1.71 . . . . 1.0 106.383 169.972 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 81' ' ' ASP . . . . . 0.426 ' OD2' ' CE1' ' A' ' 70' ' ' HIS . 21.1 t70 -61.54 -55.2 33.58 Favored 'General case' 0 N--CA 1.431 -1.414 0 C-N-CA 127.6 2.36 . . . . 1.0 113.949 -162.536 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -51.07 -61.34 2.29 Favored 'General case' 0 N--CA 1.43 -1.451 0 C-N-CA 126.675 1.99 . . . . 1.0 115.603 -165.878 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 68.4 m -85.01 -31.96 23.19 Favored 'General case' 0 N--CA 1.431 -1.396 0 O-C-N 120.558 -1.339 . . . . 1.0 111.95 174.934 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 97.51 79.93 1.5 Allowed Glycine 0 N--CA 1.43 -1.7 0 N-CA-C 109.699 -1.36 . . . . 1.0 109.699 -169.215 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 85' ' ' GLU . . . . . 0.417 ' HB2' ' HB2' ' A' ' 80' ' ' CYS . 36.8 mm-40 -142.32 -161.14 1.19 Allowed 'General case' 0 N--CA 1.428 -1.554 0 N-CA-C 106.967 -1.494 . . . . 1.0 106.967 -174.439 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 89.5 m -137.96 142.8 40.51 Favored 'General case' 0 N--CA 1.429 -1.495 0 O-C-N 119.727 -1.858 . . . . 1.0 109.863 -161.233 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 1.1 t80 -38.63 -94.37 0.0 OUTLIER 'General case' 0 N--CA 1.43 -1.461 0 C-N-CA 128.005 2.522 . . . . 1.0 117.807 177.055 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 88' ' ' TRP . . . . . 0.446 ' HB2' ' HG2' ' A' ' 106' ' ' ARG . 19.1 m95 -76.12 -26.53 56.45 Favored 'General case' 0 N--CA 1.43 -1.462 0 O-C-N 120.308 -1.495 . . . . 1.0 111.331 -166.968 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -59.85 -50.66 72.91 Favored 'General case' 0 N--CA 1.43 -1.461 0 C-N-CA 125.857 1.663 . . . . 1.0 113.554 172.258 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 46.3 tp -68.5 -43.67 76.36 Favored 'General case' 0 N--CA 1.43 -1.462 0 O-C-N 119.652 -1.905 . . . . 1.0 111.077 179.0 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 10.3 tt -50.53 -49.85 54.74 Favored 'General case' 0 N--CA 1.43 -1.427 0 C-N-CA 125.636 1.574 . . . . 1.0 113.449 172.749 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 16.8 tt0 -55.57 -49.08 73.67 Favored 'General case' 0 N--CA 1.43 -1.465 0 C-N-CA 127.018 2.127 . . . . 1.0 113.281 173.943 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 51.0 mt-30 -60.36 -48.3 82.34 Favored 'General case' 0 N--CA 1.431 -1.393 0 O-C-N 120.766 -1.209 . . . . 1.0 113.743 175.944 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -58.78 -49.33 78.06 Favored 'General case' 0 N--CA 1.43 -1.438 0 C-N-CA 125.378 1.471 . . . . 1.0 113.171 174.277 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -59.94 -45.91 91.1 Favored 'General case' 0 N--CA 1.429 -1.509 0 C-N-CA 126.143 1.777 . . . . 1.0 114.115 177.576 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 96.4 m -60.93 -36.47 79.41 Favored 'General case' 0 N--CA 1.431 -1.399 0 C-N-CA 125.713 1.605 . . . . 1.0 112.526 178.25 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -69.05 -59.62 2.92 Favored 'General case' 0 N--CA 1.428 -1.528 0 C-N-CA 124.388 1.075 . . . . 1.0 113.317 170.243 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 5.4 pt20 -76.54 -19.64 57.71 Favored 'General case' 0 N--CA 1.431 -1.406 0 N-CA-C 116.016 1.858 . . . . 1.0 116.016 -166.134 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -97.92 -35.98 10.31 Favored 'General case' 0 N--CA 1.431 -1.408 0 C-N-CA 124.793 1.237 . . . . 1.0 112.224 169.579 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . 106.95 10.76 27.63 Favored Glycine 0 N--CA 1.429 -1.77 0 N-CA-C 116.222 1.249 . . . . 1.0 116.222 170.048 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 6.7 pt-20 -149.34 160.98 42.95 Favored 'General case' 0 N--CA 1.43 -1.425 0 N-CA-C 105.655 -1.979 . . . . 1.0 105.655 -177.416 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 18.4 m -65.8 111.43 3.25 Favored 'General case' 0 N--CA 1.429 -1.482 0 CA-C-N 120.804 1.638 . . . . 1.0 112.177 -178.595 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 60.7 t -94.86 107.68 19.78 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.415 0 CA-C-O 122.993 1.378 . . . . 1.0 109.394 -178.005 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 70.0 m -80.2 106.15 12.0 Favored 'General case' 0 N--CA 1.43 -1.456 0 C-N-CA 124.622 1.169 . . . . 1.0 111.336 -176.516 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -140.58 -12.02 1.02 Allowed 'General case' 0 N--CA 1.43 -1.458 0 C-N-CA 123.133 0.573 . . . . 1.0 109.875 168.625 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 106' ' ' ARG . . . . . 0.446 ' HG2' ' HB2' ' A' ' 88' ' ' TRP . 0.0 OUTLIER . . . . . 0 C--O 1.261 1.69 0 C-N-CA 126.592 1.957 . . . . 1.0 110.882 179.212 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 66.6 mtt . . . . . 0 CA--C 1.49 -1.347 0 CA-C-O 121.44 0.638 . . . . 1.0 111.829 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 17.9 t-20 -114.7 56.35 0.73 Allowed 'General case' 0 N--CA 1.43 -1.434 0 O-C-N 120.532 -1.355 . . . . 1.0 110.238 -178.314 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -64.0 -30.79 71.84 Favored 'General case' 0 CA--C 1.489 -1.402 0 C-N-CA 126.095 1.758 . . . . 1.0 114.614 -176.136 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 48.0 p -65.45 -46.87 78.17 Favored 'General case' 0 N--CA 1.43 -1.441 0 O-C-N 120.483 -1.386 . . . . 1.0 113.882 174.971 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 40.2 tt0 -68.03 -44.69 75.9 Favored 'General case' 0 N--CA 1.431 -1.422 0 O-C-N 120.606 -1.308 . . . . 1.0 112.723 176.668 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 28.3 t80 -50.4 -49.38 54.76 Favored 'General case' 0 N--CA 1.43 -1.439 0 N-CA-C 114.123 1.157 . . . . 1.0 114.123 168.856 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 1.2 t60 -61.03 -38.6 86.69 Favored 'General case' 0 N--CA 1.429 -1.498 0 O-C-N 120.649 -1.282 . . . . 1.0 114.382 175.048 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 1.2 mpt_? -56.26 -56.94 14.81 Favored 'General case' 0 N--CA 1.43 -1.426 0 CA-C-N 120.629 1.558 . . . . 1.0 112.185 172.816 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 80.4 mt -63.96 -41.57 97.54 Favored 'General case' 0 N--CA 1.429 -1.492 0 N-CA-C 114.135 1.161 . . . . 1.0 114.135 -179.161 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -67.18 -41.31 86.11 Favored 'General case' 0 N--CA 1.43 -1.474 0 C-N-CA 125.446 1.498 . . . . 1.0 114.774 -179.472 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -66.41 -38.76 88.19 Favored 'General case' 0 N--CA 1.431 -1.409 0 O-C-N 120.305 -1.497 . . . . 1.0 112.025 172.346 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 3.6 mt-30 -56.38 -54.09 49.63 Favored 'General case' 0 N--CA 1.43 -1.442 0 N-CA-C 115.829 1.788 . . . . 1.0 115.829 170.142 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 4.3 pp -63.91 -39.31 93.88 Favored 'General case' 0 N--CA 1.429 -1.479 0 N-CA-C 114.469 1.285 . . . . 1.0 114.469 179.387 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 7.3 m0 -49.71 -49.5 47.55 Favored 'General case' 0 N--CA 1.429 -1.481 0 N-CA-C 114.552 1.315 . . . . 1.0 114.552 168.759 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 41.9 tp -61.54 -51.52 68.23 Favored 'General case' 0 N--CA 1.429 -1.507 0 C-N-CA 124.21 1.004 . . . . 1.0 113.618 176.251 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 17.0 m -57.07 -43.08 81.75 Favored 'General case' 0 N--CA 1.43 -1.464 0 C-N-CA 125.613 1.565 . . . . 1.0 113.978 177.384 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 87.9 mt -59.12 -49.9 81.67 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.504 0 O-C-N 120.573 -1.33 . . . . 1.0 113.162 173.144 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 72.5 tt0 -63.02 -48.58 78.14 Favored 'General case' 0 N--CA 1.43 -1.473 0 O-C-N 120.594 -1.316 . . . . 1.0 112.715 -179.86 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 27.0 mm-40 -48.44 -59.72 3.25 Favored 'General case' 0 N--CA 1.428 -1.537 0 C-N-CA 126.569 1.948 . . . . 1.0 114.316 172.527 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 3.1 tpm_? -62.79 -37.82 88.19 Favored 'General case' 0 N--CA 1.43 -1.451 0 N-CA-C 113.8 1.037 . . . . 1.0 113.8 -176.627 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 4.3 mm? -70.65 -44.63 66.71 Favored 'General case' 0 N--CA 1.43 -1.456 0 O-C-N 120.482 -1.386 . . . . 1.0 113.7 177.084 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 25.5 t70 -68.24 -39.3 82.32 Favored 'General case' 0 N--CA 1.429 -1.475 0 O-C-N 120.775 -1.203 . . . . 1.0 113.542 -178.54 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 35.8 t70 -64.84 -26.59 68.4 Favored 'General case' 0 N--CA 1.43 -1.475 0 C-N-CA 125.841 1.656 . . . . 1.0 113.624 178.681 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 24' ' ' TRP . . . . . . . . . . . . . 0.1 OUTLIER -99.46 -145.84 0.33 Allowed 'General case' 0 N--CA 1.429 -1.48 0 N-CA-C 115.074 1.509 . . . . 1.0 115.074 -167.939 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . 0.306 0.9 OUTLIER 55.35 -157.44 0.23 Allowed 'General case' 0 N--CA 1.43 -1.449 0 C-N-CA 128.819 2.848 . . . . 1.0 116.221 -175.282 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 155.67 -44.85 0.54 Allowed Glycine 0 N--CA 1.432 -1.613 0 O-C-N 120.464 -1.397 . . . . 1.0 112.247 -179.019 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -77.68 -30.87 52.2 Favored 'General case' 0 N--CA 1.432 -1.368 0 CA-C-O 122.165 0.983 . . . . 1.0 111.595 -178.51 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 63.4 m -112.64 166.26 11.51 Favored 'General case' 0 N--CA 1.43 -1.435 0 C-N-CA 124.652 1.181 . . . . 1.0 110.136 174.742 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 29.8 t70 -93.5 141.22 28.71 Favored 'General case' 0 N--CA 1.43 -1.446 0 N-CA-C 106.904 -1.517 . . . . 1.0 106.904 167.421 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 5.8 tp -141.99 124.06 13.56 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.463 0 C-N-CA 126.376 1.871 . . . . 1.0 106.01 -169.558 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 13.7 t70 -140.48 128.55 22.16 Favored 'General case' 0 N--CA 1.43 -1.467 0 O-C-N 120.611 -1.306 . . . . 1.0 110.058 169.044 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 43.3 t -95.1 131.81 40.69 Favored 'General case' 0 N--CA 1.43 -1.43 0 O-C-N 120.018 -1.676 . . . . 1.0 108.074 173.509 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 23.3 mt-10 -107.62 140.27 40.9 Favored 'General case' 0 N--CA 1.429 -1.506 0 O-C-N 120.99 -1.069 . . . . 1.0 108.762 -170.242 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 3.1 tp -114.58 109.38 28.27 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.44 0 N-CA-C 105.617 -1.994 . . . . 1.0 105.617 167.011 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 77.5 m-20 -125.73 126.1 44.06 Favored 'General case' 0 N--CA 1.43 -1.427 0 N-CA-C 106.889 -1.523 . . . . 1.0 106.889 168.522 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . 67.42 -103.68 0.99 Allowed Glycine 0 N--CA 1.43 -1.728 0 C-N-CA 125.039 1.304 . . . . 1.0 112.607 -174.963 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -139.73 25.44 2.7 Favored Glycine 0 N--CA 1.43 -1.738 0 C-N-CA 124.186 0.898 . . . . 1.0 111.408 171.839 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 46.9 t -112.23 130.53 65.75 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.516 0 N-CA-C 106.97 -1.493 . . . . 1.0 106.97 179.063 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 23.9 mt -99.73 120.34 39.57 Favored 'General case' 0 N--CA 1.429 -1.499 0 CA-C-O 123.208 1.48 . . . . 1.0 107.883 172.141 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 1.6 p -113.76 122.33 46.77 Favored 'General case' 0 N--CA 1.43 -1.454 0 N-CA-C 106.995 -1.483 . . . . 1.0 106.995 179.63 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 61.7 mt -93.89 112.62 27.09 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.431 0 N-CA-C 105.787 -1.931 . . . . 1.0 105.787 -177.794 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 27.2 p -121.77 126.41 48.8 Favored 'General case' 0 N--CA 1.43 -1.448 0 CA-C-O 122.441 1.115 . . . . 1.0 113.221 -167.919 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 43' ' ' PHE . . . . . . . . . . . . . 3.0 p90 -120.77 167.76 12.14 Favored 'General case' 0 N--CA 1.43 -1.443 0 CA-C-O 122.749 1.261 . . . . 1.0 111.59 178.675 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -56.61 -33.01 65.85 Favored 'General case' 0 N--CA 1.43 -1.435 0 C-N-CA 127.953 2.501 . . . . 1.0 117.037 -170.077 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 70.9 m-80 -67.09 -15.8 63.94 Favored 'General case' 0 N--CA 1.431 -1.425 0 N-CA-C 115.037 1.495 . . . . 1.0 115.037 175.427 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 88.2 13.13 64.43 Favored Glycine 0 N--CA 1.431 -1.64 0 O-C-N 119.676 -1.89 . . . . 1.0 115.475 167.447 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 56.8 m -98.65 149.89 22.33 Favored 'General case' 0 N--CA 1.429 -1.504 0 N-CA-C 107.336 -1.357 . . . . 1.0 107.336 167.693 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -128.49 150.88 49.97 Favored 'General case' 0 N--CA 1.429 -1.5 0 O-C-N 121.378 -0.826 . . . . 1.0 110.063 -168.236 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 3.1 mm -105.17 133.31 49.77 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.508 0 N-CA-C 105.527 -2.027 . . . . 1.0 105.527 166.546 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 50' ' ' ILE . . . . . 0.478 ' HB ' ' HB3' ' A' ' 63' ' ' ALA . 5.7 mm -116.64 117.74 56.47 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.484 0 CA-C-N 119.733 1.151 . . . . 1.0 109.617 -173.158 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 3.2 mt -126.93 116.27 44.13 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.432 0 CA-C-O 124.047 1.88 . . . . 1.0 112.179 -175.469 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 52' ' ' ASN . . . . . 0.636 ' H ' ' HD1' ' A' ' 61' ' ' TRP . 56.2 t30 -141.82 170.63 15.35 Favored 'General case' 0 N--CA 1.43 -1.449 0 C-N-CA 128.354 2.662 . . . . 1.0 106.27 -179.274 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -154.29 130.89 10.66 Favored 'General case' 0 N--CA 1.431 -1.408 0 CA-C-O 122.834 1.302 . . . . 1.0 109.289 -170.365 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 28.9 mm-40 -89.73 129.87 36.08 Favored 'General case' 0 N--CA 1.429 -1.477 0 N-CA-C 106.531 -1.655 . . . . 1.0 106.531 175.921 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 67.6 mt-10 -63.75 -47.99 80.56 Favored Pre-proline 0 N--CA 1.431 -1.42 0 N-CA-C 116.687 2.106 . . . . 1.0 116.687 -179.606 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 97.3 Cg_endo -74.52 153.39 44.26 Favored 'Trans proline' 0 C--N 1.299 -2.036 0 CA-C-N 126.531 3.368 . . . . 1.0 111.388 163.403 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . 0.388 5.4 mp 72.57 143.05 0.06 Allowed 'General case' 0 N--CA 1.43 -1.457 0 CA-C-O 124.754 2.216 . . . . 1.0 113.445 -168.203 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 21.2 m170 -88.93 44.32 1.2 Allowed 'General case' 0 N--CA 1.43 -1.446 0 C-N-CA 125.318 1.447 . . . . 1.0 112.904 -175.899 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 11.7 pt20 -140.0 145.44 37.81 Favored 'General case' 0 N--CA 1.43 -1.456 0 O-C-N 120.045 -1.66 . . . . 1.0 110.53 -172.077 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 86.7 t -111.88 156.08 13.05 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.457 0 N-CA-C 107.023 -1.473 . . . . 1.0 107.023 -178.679 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 61' ' ' TRP . . . . . 0.636 ' HD1' ' H ' ' A' ' 52' ' ' ASN . 0.0 OUTLIER -102.06 152.35 21.08 Favored 'General case' 0 N--CA 1.43 -1.455 0 O-C-N 120.054 -1.653 . . . . 1.0 113.011 174.784 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 75.6 mt -127.91 107.54 9.94 Favored 'General case' 0 CA--C 1.488 -1.409 0 N-CA-C 106.994 -1.484 . . . . 1.0 106.994 166.175 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . 0.478 ' HB3' ' HB ' ' A' ' 50' ' ' ILE . . . -95.19 145.14 25.25 Favored 'General case' 0 N--CA 1.429 -1.476 0 CA-C-O 122.801 1.286 . . . . 1.0 111.16 163.288 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 64' ' ' THR . . . . . . . . . . . . . 69.2 p -150.3 -168.1 3.01 Favored 'General case' 0 N--CA 1.43 -1.462 0 C-N-CA 126.182 1.793 . . . . 1.0 108.617 -150.583 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 7.1 tmtm? -62.12 -46.82 87.33 Favored 'General case' 0 N--CA 1.431 -1.411 0 C-N-CA 125.889 1.676 . . . . 1.0 112.435 174.693 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 48.9 tt0 -78.04 -24.51 47.75 Favored 'General case' 0 N--CA 1.429 -1.519 0 N-CA-C 114.516 1.302 . . . . 1.0 114.516 -170.718 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 151.06 -53.14 0.49 Allowed Glycine 0 N--CA 1.43 -1.725 0 O-C-N 120.893 -1.129 . . . . 1.0 110.89 176.963 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 134.83 162.06 9.67 Favored Glycine 0 N--CA 1.43 -1.736 0 CA-C-O 122.818 1.232 . . . . 1.0 115.839 174.448 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 4.7 m-85 -135.32 161.99 33.85 Favored 'General case' 0 N--CA 1.43 -1.442 0 C-N-CA 126.415 1.886 . . . . 1.0 107.148 -173.318 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 25.0 p80 -114.98 159.72 20.43 Favored 'General case' 0 N--CA 1.43 -1.433 0 O-C-N 119.797 -1.815 . . . . 1.0 108.586 156.025 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 37.3 p90 -136.96 141.47 42.61 Favored 'General case' 0 N--CA 1.43 -1.471 0 N-CA-C 114.694 1.368 . . . . 1.0 114.694 -168.755 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 8.9 m-20 -121.63 175.81 6.03 Favored 'General case' 0 N--CA 1.429 -1.491 0 C-N-CA 126.448 1.899 . . . . 1.0 110.391 -170.495 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 27.1 tp -113.82 110.25 19.84 Favored 'General case' 0 N--CA 1.429 -1.521 0 O-C-N 119.718 -1.864 . . . . 1.0 113.072 -174.616 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 12.2 mmmt -68.41 -42.46 78.96 Favored 'General case' 0 N--CA 1.431 -1.379 0 O-C-N 120.497 -1.377 . . . . 1.0 112.641 168.45 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . 165.08 -86.9 0.1 Allowed Glycine 0 N--CA 1.43 -1.764 0 N-CA-C 110.074 -1.211 . . . . 1.0 110.074 176.997 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 11.6 t0 -91.82 29.65 1.52 Allowed 'General case' 0 N--CA 1.43 -1.46 0 O-C-N 120.988 -1.301 . . . . 1.0 111.96 176.659 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 2.1 pt-20 -169.07 124.61 0.89 Allowed 'General case' 0 N--CA 1.429 -1.484 0 C-N-CA 126.33 1.852 . . . . 1.0 106.523 -173.772 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 78' ' ' TRP . . . . . . . . . . . . . 89.9 m95 -80.46 130.67 35.3 Favored 'General case' 0 N--CA 1.43 -1.462 0 N-CA-C 106.339 -1.726 . . . . 1.0 106.339 162.627 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -124.55 141.12 45.73 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.436 0 O-C-N 119.313 -2.117 . . . . 1.0 109.866 -173.777 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 21.2 m -81.64 121.17 26.01 Favored 'General case' 0 N--CA 1.429 -1.492 0 O-C-N 120.243 -1.535 . . . . 1.0 113.21 -172.572 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 30.0 t70 -83.11 58.33 4.38 Favored 'General case' 0 N--CA 1.43 -1.465 0 O-C-N 119.769 -1.832 . . . . 1.0 112.467 -173.172 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 15.6 tpt85 -170.45 101.29 0.26 Allowed 'General case' 0 N--CA 1.43 -1.437 0 O-C-N 120.433 -1.417 . . . . 1.0 110.053 178.039 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 4.3 t 79.48 -50.28 0.4 Allowed 'General case' 0 N--CA 1.43 -1.463 0 C-N-CA 126.695 1.998 . . . . 1.0 116.121 169.039 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -153.79 96.15 0.16 Allowed Glycine 0 N--CA 1.43 -1.732 0 O-C-N 120.214 -1.554 . . . . 1.0 110.015 -172.593 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 5.5 pt-20 -82.43 102.71 11.48 Favored 'General case' 0 N--CA 1.428 -1.539 0 N-CA-C 117.99 2.589 . . . . 1.0 117.99 -162.834 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 10.4 m -165.66 126.71 1.89 Allowed 'General case' 0 N--CA 1.43 -1.458 0 O-C-N 119.543 -1.973 . . . . 1.0 113.339 172.333 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 3.0 t80 -57.09 -84.34 0.01 OUTLIER 'General case' 0 N--CA 1.43 -1.438 0 N-CA-C 118.018 2.599 . . . . 1.0 118.018 177.192 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 88' ' ' TRP . . . . . . . . . . . . . 46.7 m95 -61.38 -27.81 68.79 Favored 'General case' 0 N--CA 1.431 -1.424 0 C-N-CA 125.876 1.67 . . . . 1.0 113.324 -167.295 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -77.27 -45.03 27.69 Favored 'General case' 0 N--CA 1.429 -1.492 0 C-N-CA 126.685 1.994 . . . . 1.0 112.896 179.558 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 25.6 tp -71.36 -38.89 71.56 Favored 'General case' 0 N--CA 1.429 -1.489 0 O-C-N 118.875 -2.391 . . . . 1.0 112.734 176.951 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 17.7 tp -51.58 -44.98 62.96 Favored 'General case' 0 N--CA 1.431 -1.391 0 C-N-CA 126.608 1.963 . . . . 1.0 114.483 168.027 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 38.5 tt0 -56.66 -47.18 80.37 Favored 'General case' 0 N--CA 1.431 -1.407 0 C-N-CA 126.318 1.847 . . . . 1.0 113.93 170.168 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 38.1 tt0 -57.05 -50.77 71.73 Favored 'General case' 0 N--CA 1.43 -1.448 0 C-N-CA 125.63 1.572 . . . . 1.0 114.427 176.938 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -56.56 -48.49 77.21 Favored 'General case' 0 N--CA 1.429 -1.478 0 C-N-CA 126.148 1.779 . . . . 1.0 114.121 173.969 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -65.69 -48.77 70.91 Favored 'General case' 0 N--CA 1.431 -1.415 0 O-C-N 120.339 -1.476 . . . . 1.0 113.682 179.45 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 94.0 m -47.13 -51.45 18.05 Favored 'General case' 0 N--CA 1.43 -1.465 0 C-N-CA 127.38 2.272 . . . . 1.0 113.97 173.986 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 8.4 pt20 -72.98 -37.02 67.19 Favored 'General case' 0 N--CA 1.431 -1.421 0 N-CA-C 114.692 1.368 . . . . 1.0 114.692 -179.173 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 41.7 mt-30 -71.22 -42.08 69.37 Favored 'General case' 0 N--CA 1.431 -1.411 0 N-CA-C 115.655 1.724 . . . . 1.0 115.655 178.741 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -82.82 -41.21 19.36 Favored 'General case' 0 N--CA 1.431 -1.421 0 N-CA-C 113.622 0.971 . . . . 1.0 113.622 -179.604 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . 89.59 42.69 5.39 Favored Glycine 0 N--CA 1.431 -1.669 0 O-C-N 120.667 -1.271 . . . . 1.0 112.984 -177.991 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 4.3 tp10 -158.92 164.85 35.27 Favored 'General case' 0 N--CA 1.43 -1.468 0 N-CA-C 103.252 -2.869 . . . . 1.0 103.252 -177.291 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 90.4 m -76.88 87.21 3.45 Favored 'General case' 0 N--CA 1.431 -1.383 0 CA-C-N 120.533 1.515 . . . . 1.0 109.339 169.666 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 18.0 t -95.45 84.01 1.53 Allowed 'Isoleucine or valine' 0 N--CA 1.43 -1.426 0 CA-C-O 124.297 1.999 . . . . 1.0 108.73 -179.265 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 71.5 p -96.72 168.07 10.73 Favored 'General case' 0 N--CA 1.431 -1.403 0 C-N-CA 126.783 2.033 . . . . 1.0 111.114 -177.6 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 20.2 m-85 -104.57 -27.05 12.1 Favored 'General case' 0 N--CA 1.429 -1.479 0 O-C-N 120.768 -1.207 . . . . 1.0 109.278 162.134 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 16.5 mmm-85 . . . . . 0 C--O 1.259 1.602 0 C-N-CA 124.354 1.061 . . . . 1.0 111.409 -170.957 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 20.9 mmt . . . . . 0 CA--C 1.49 -1.344 0 CA-C-O 121.937 0.875 . . . . 1.0 110.646 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 29.2 m-80 -114.01 44.18 1.7 Allowed 'General case' 0 N--CA 1.43 -1.468 0 O-C-N 119.996 -1.69 . . . . 1.0 109.782 -179.477 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 28.3 p-10 -69.71 -56.23 7.77 Favored 'General case' 0 CA--C 1.488 -1.408 0 C-N-CA 125.586 1.554 . . . . 1.0 113.777 -176.357 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 33.4 m -59.46 -45.07 92.67 Favored 'General case' 0 N--CA 1.431 -1.403 0 C-N-CA 124.698 1.199 . . . . 1.0 112.417 174.146 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 8.4 mm-40 -52.5 -63.29 1.19 Allowed 'General case' 0 N--CA 1.429 -1.482 0 C-N-CA 126.491 1.916 . . . . 1.0 113.137 178.297 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 7.6 m-85 -62.12 -27.59 69.04 Favored 'General case' 0 N--CA 1.43 -1.462 0 N-CA-C 115.838 1.792 . . . . 1.0 115.838 177.089 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 1.9 t-80 -61.52 -52.6 63.8 Favored 'General case' 0 N--CA 1.429 -1.475 0 N-CA-C 114.441 1.274 . . . . 1.0 114.441 171.792 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 35.4 mtm180 -69.63 -39.14 77.33 Favored 'General case' 0 N--CA 1.431 -1.375 0 O-C-N 120.474 -1.391 . . . . 1.0 113.973 -179.793 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 66.7 mt -58.55 -41.7 86.19 Favored 'General case' 0 N--CA 1.431 -1.42 0 C-N-CA 125.05 1.34 . . . . 1.0 113.223 173.648 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -62.99 -45.91 90.17 Favored 'General case' 0 N--CA 1.429 -1.483 0 C-N-CA 125.312 1.445 . . . . 1.0 112.668 176.293 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 8.2 t70 -53.69 -57.53 10.48 Favored 'General case' 0 N--CA 1.43 -1.463 0 C-N-CA 124.42 1.088 . . . . 1.0 113.242 174.846 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 16.7 pt20 -64.1 -37.49 87.64 Favored 'General case' 0 N--CA 1.429 -1.478 0 N-CA-C 116.267 1.951 . . . . 1.0 116.267 -177.907 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 3.3 pp -65.06 -43.54 91.89 Favored 'General case' 0 N--CA 1.43 -1.44 0 O-C-N 120.174 -1.578 . . . . 1.0 113.376 174.928 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 23.1 m0 -52.62 -50.67 62.65 Favored 'General case' 0 N--CA 1.431 -1.413 0 N-CA-C 115.329 1.603 . . . . 1.0 115.329 173.222 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 25.3 mt -59.06 -48.4 81.75 Favored 'General case' 0 N--CA 1.429 -1.483 0 CA-C-O 121.944 0.878 . . . . 1.0 112.854 176.456 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 47.7 m -66.6 -45.82 77.94 Favored 'General case' 0 N--CA 1.43 -1.436 0 N-CA-C 114.456 1.28 . . . . 1.0 114.456 -175.748 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 96.7 mt -58.03 -45.9 88.07 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.462 0 O-C-N 119.988 -1.695 . . . . 1.0 112.143 172.677 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 8.0 tt0 -58.91 -48.3 81.94 Favored 'General case' 0 N--CA 1.43 -1.442 0 O-C-N 121.626 -0.671 . . . . 1.0 112.59 176.705 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 33.7 tt0 -58.47 -44.87 89.48 Favored 'General case' 0 N--CA 1.431 -1.41 0 C-N-CA 125.161 1.384 . . . . 1.0 114.107 177.92 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -53.52 -52.52 59.37 Favored 'General case' 0 N--CA 1.43 -1.453 0 C-N-CA 124.184 0.994 . . . . 1.0 112.344 174.656 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 35.4 mt -69.99 -51.04 35.71 Favored 'General case' 0 N--CA 1.431 -1.412 0 N-CA-C 113.658 0.985 . . . . 1.0 113.658 -176.429 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 23.0 t70 -62.9 -41.92 99.61 Favored 'General case' 0 N--CA 1.429 -1.495 0 N-CA-C 115.146 1.536 . . . . 1.0 115.146 -178.174 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 23.6 t70 -74.01 -26.1 60.26 Favored 'General case' 0 N--CA 1.43 -1.438 0 O-C-N 120.182 -1.574 . . . . 1.0 113.066 -179.04 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 24' ' ' TRP . . . . . . . . . . . . . 67.7 t-105 -72.26 136.64 46.37 Favored 'General case' 0 N--CA 1.43 -1.471 0 O-C-N 119.742 -1.849 . . . . 1.0 112.63 177.569 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 34.3 t70 -138.95 150.26 45.69 Favored 'General case' 0 N--CA 1.43 -1.445 0 N-CA-C 106.926 -1.509 . . . . 1.0 106.926 179.273 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -163.91 -121.88 0.58 Allowed Glycine 0 N--CA 1.43 -1.757 0 O-C-N 121.29 -0.881 . . . . 1.0 111.599 -174.822 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 4.2 t0 -92.0 -32.25 15.29 Favored 'General case' 0 N--CA 1.43 -1.471 0 C-N-CA 125.357 1.463 . . . . 1.0 108.614 172.293 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 18.3 p -95.14 166.94 11.67 Favored 'General case' 0 N--CA 1.429 -1.482 0 C-N-CA 126.499 1.92 . . . . 1.0 111.591 179.335 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 2.6 t70 -132.03 178.91 6.42 Favored 'General case' 0 N--CA 1.43 -1.453 0 C-N-CA 124.677 1.191 . . . . 1.0 109.272 177.018 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 9.3 tp -157.21 134.02 2.2 Favored 'Isoleucine or valine' 0 N--CA 1.428 -1.542 0 C-N-CA 125.43 1.492 . . . . 1.0 107.072 -154.632 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 2.1 t70 -143.81 106.67 4.48 Favored 'General case' 0 N--CA 1.429 -1.495 0 O-C-N 120.241 -1.537 . . . . 1.0 109.445 162.783 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 71.2 m -90.68 132.62 35.68 Favored 'General case' 0 N--CA 1.431 -1.42 0 O-C-N 120.513 -1.367 . . . . 1.0 111.171 175.571 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 35.2 tt0 -107.27 132.01 53.57 Favored 'General case' 0 N--CA 1.43 -1.474 0 C-N-CA 126.365 1.866 . . . . 1.0 109.769 -168.138 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 2.8 tp -117.2 109.03 26.37 Favored 'Isoleucine or valine' 0 N--CA 1.428 -1.535 0 CA-C-O 124.547 2.118 . . . . 1.0 108.236 -172.314 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 3.5 t-20 -108.29 79.35 1.25 Allowed 'General case' 0 N--CA 1.429 -1.483 0 C-N-CA 125.575 1.55 . . . . 1.0 108.288 173.98 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . 75.52 -80.17 1.04 Allowed Glycine 0 N--CA 1.429 -1.771 0 O-C-N 120.326 -1.484 . . . . 1.0 114.998 173.291 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -142.66 37.35 1.54 Allowed Glycine 0 N--CA 1.43 -1.766 0 N-CA-C 108.987 -1.645 . . . . 1.0 108.987 173.384 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 69.7 t -133.67 117.77 28.02 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.404 0 N-CA-C 104.519 -2.4 . . . . 1.0 104.519 176.383 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -110.08 137.32 48.0 Favored 'General case' 0 N--CA 1.431 -1.42 0 CA-C-O 123.728 1.728 . . . . 1.0 111.781 177.042 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -133.06 125.2 29.1 Favored 'General case' 0 N--CA 1.429 -1.479 0 N-CA-C 106.142 -1.799 . . . . 1.0 106.142 -170.174 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 86.1 mt -99.89 134.07 40.6 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.481 0 N-CA-C 107.534 -1.284 . . . . 1.0 107.534 -169.192 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -131.7 126.67 35.13 Favored 'General case' 0 N--CA 1.431 -1.414 0 N-CA-C 112.643 0.609 . . . . 1.0 112.643 174.944 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 43' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -108.15 167.51 9.95 Favored 'General case' 0 N--CA 1.431 -1.405 0 C-N-CA 125.482 1.513 . . . . 1.0 109.437 174.278 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 70.3 mt-10 -55.86 -26.19 45.79 Favored 'General case' 0 N--CA 1.429 -1.484 0 N-CA-C 117.059 2.244 . . . . 1.0 117.059 179.644 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 27.7 t-20 -63.87 -18.15 63.88 Favored 'General case' 0 N--CA 1.43 -1.442 0 C-N-CA 126.374 1.869 . . . . 1.0 112.828 176.363 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 96.32 -6.32 65.82 Favored Glycine 0 N--CA 1.431 -1.652 0 O-C-N 120.311 -1.493 . . . . 1.0 111.313 176.345 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -79.18 166.36 22.29 Favored 'General case' 0 N--CA 1.431 -1.424 0 C-N-CA 128.033 2.533 . . . . 1.0 111.265 -177.914 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 10.5 ptpt -157.17 148.14 21.67 Favored 'General case' 0 N--CA 1.431 -1.417 0 O-C-N 120.672 -1.267 . . . . 1.0 113.599 -162.434 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 9.2 mm -123.6 142.83 38.89 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.445 0 N-CA-C 105.703 -1.962 . . . . 1.0 105.703 175.672 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 50' ' ' ILE . . . . . 0.551 HG23 ' HB3' ' A' ' 63' ' ' ALA . 4.1 tp -126.5 129.06 71.77 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.509 0 CA-C-N 120.753 1.615 . . . . 1.0 110.076 175.606 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 3.3 mt -124.99 124.84 68.52 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.464 0 C-N-CA 127.689 2.396 . . . . 1.0 111.139 -177.263 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 52' ' ' ASN . . . . . 0.526 ' H ' ' HD1' ' A' ' 61' ' ' TRP . 40.9 t30 -160.04 173.14 16.29 Favored 'General case' 0 N--CA 1.43 -1.456 0 C-N-CA 128.802 2.841 . . . . 1.0 104.564 -173.901 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -153.35 147.99 26.23 Favored 'General case' 0 N--CA 1.429 -1.48 0 O-C-N 119.629 -1.92 . . . . 1.0 113.333 -154.455 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 34.1 mm-40 -121.13 97.63 5.61 Favored 'General case' 0 N--CA 1.43 -1.453 0 C-N-CA 125.361 1.465 . . . . 1.0 112.002 -172.51 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 18.9 tt0 -69.6 -39.89 12.83 Favored Pre-proline 0 N--CA 1.431 -1.416 0 N-CA-C 116.574 2.064 . . . . 1.0 116.574 -174.988 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 52.7 Cg_exo -71.16 -22.62 25.59 Favored 'Trans proline' 0 N--CA 1.433 -2.072 0 CA-C-N 126.228 3.26 . . . . 1.0 114.844 174.794 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 33.2 mt -94.04 -30.92 14.44 Favored 'General case' 0 N--CA 1.431 -1.412 0 C-N-CA 122.895 0.478 . . . . 1.0 111.312 -168.581 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 3.4 m170 85.67 56.5 0.01 OUTLIER 'General case' 0 N--CA 1.43 -1.425 0 C-N-CA 127.581 2.352 . . . . 1.0 110.102 176.826 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 6.5 pt20 -156.23 157.66 36.22 Favored 'General case' 0 N--CA 1.43 -1.449 0 O-C-N 120.409 -1.432 . . . . 1.0 109.71 -178.468 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 79.2 t -121.06 151.43 24.12 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.511 0 N-CA-C 105.63 -1.989 . . . . 1.0 105.63 173.045 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 61' ' ' TRP . . . . . 0.526 ' HD1' ' H ' ' A' ' 52' ' ' ASN . 0.0 OUTLIER -102.21 151.76 21.83 Favored 'General case' 0 N--CA 1.43 -1.467 0 CA-C-N 121.122 1.783 . . . . 1.0 114.275 177.291 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 61.5 mt -123.28 101.72 7.53 Favored 'General case' 0 N--CA 1.43 -1.428 0 N-CA-C 107.03 -1.47 . . . . 1.0 107.03 166.503 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . 0.551 ' HB3' HG23 ' A' ' 50' ' ' ILE . . . -102.05 112.91 25.73 Favored 'General case' 0 N--CA 1.43 -1.435 0 O-C-N 121.05 -1.032 . . . . 1.0 110.517 170.889 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 64' ' ' THR . . . . . . . . . . . . . 77.1 p -119.62 -122.44 0.29 Allowed 'General case' 0 N--CA 1.43 -1.472 0 C-N-CA 126.749 2.02 . . . . 1.0 113.652 -156.782 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 13.7 tmtt? -96.69 -66.33 0.91 Allowed 'General case' 0 N--CA 1.43 -1.426 0 C-N-CA 126.047 1.739 . . . . 1.0 110.726 -170.678 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 20.0 tt0 -77.62 -24.0 49.69 Favored 'General case' 0 N--CA 1.429 -1.487 0 O-C-N 121.26 -0.9 . . . . 1.0 112.694 -176.773 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 172.08 -60.39 0.16 Allowed Glycine 0 N--CA 1.431 -1.68 0 O-C-N 120.398 -1.439 . . . . 1.0 110.18 178.855 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 88.1 170.18 45.74 Favored Glycine 0 N--CA 1.431 -1.678 0 C-N-CA 123.766 0.698 . . . . 1.0 112.521 -177.893 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -166.23 171.79 11.85 Favored 'General case' 0 N--CA 1.429 -1.475 0 C-N-CA 125.986 1.715 . . . . 1.0 110.065 179.398 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 70' ' ' HIS . . . . . 0.445 ' HA ' ' HA ' ' A' ' 61' ' ' TRP . 10.7 p80 -75.68 159.33 31.26 Favored 'General case' 0 N--CA 1.431 -1.393 0 N-CA-C 115.736 1.754 . . . . 1.0 115.736 -178.161 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 47.2 p90 -121.01 137.02 54.85 Favored 'General case' 0 N--CA 1.429 -1.48 0 N-CA-C 114.427 1.269 . . . . 1.0 114.427 -179.912 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 3.3 m-20 -127.56 172.58 10.6 Favored 'General case' 0 N--CA 1.43 -1.462 0 C-N-CA 126.642 1.977 . . . . 1.0 108.364 -174.246 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 19.2 mt -101.01 116.24 32.37 Favored 'General case' 0 N--CA 1.43 -1.442 0 O-C-N 119.837 -1.789 . . . . 1.0 111.893 178.228 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 39.7 mmtm -67.74 -47.71 68.51 Favored 'General case' 0 N--CA 1.429 -1.495 0 O-C-N 120.743 -1.223 . . . . 1.0 111.491 151.889 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . 179.69 -81.81 0.06 OUTLIER Glycine 0 N--CA 1.431 -1.696 0 O-C-N 120.176 -1.578 . . . . 1.0 114.159 176.502 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -89.7 -8.3 52.66 Favored 'General case' 0 N--CA 1.43 -1.474 0 C-N-CA 125.386 1.474 . . . . 1.0 109.173 170.383 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 16.0 mt-10 -124.39 123.01 39.24 Favored 'General case' 0 N--CA 1.429 -1.485 0 N-CA-C 103.797 -2.668 . . . . 1.0 103.797 -172.227 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 78' ' ' TRP . . . . . . . . . . . . . 81.4 m95 -86.31 135.35 33.57 Favored 'General case' 0 N--CA 1.43 -1.464 0 N-CA-C 105.508 -2.034 . . . . 1.0 105.508 164.317 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -129.7 153.17 38.42 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.472 0 O-C-N 119.98 -1.7 . . . . 1.0 107.936 -171.551 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 64.3 m -85.91 147.24 26.35 Favored 'General case' 0 N--CA 1.43 -1.43 0 O-C-N 120.46 -1.4 . . . . 1.0 112.591 -177.48 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 28.3 t70 -63.77 -39.94 95.49 Favored 'General case' 0 N--CA 1.431 -1.404 0 O-C-N 119.7 -1.875 . . . . 1.0 115.679 -174.242 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 12.3 ptm180 -130.5 177.22 7.52 Favored 'General case' 0 N--CA 1.43 -1.436 0 O-C-N 120.699 -1.251 . . . . 1.0 112.016 174.839 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 83' ' ' SER . . . . . . . . . . . . 0.408 9.5 p 72.3 -55.96 0.66 Allowed 'General case' 0 N--CA 1.43 -1.444 0 C-N-CA 128.554 2.742 . . . . 1.0 117.418 171.145 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -168.48 93.95 0.11 Allowed Glycine 0 N--CA 1.431 -1.684 0 N-CA-C 109.712 -1.355 . . . . 1.0 109.712 178.73 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 10.5 pt-20 -72.33 96.69 1.9 Allowed 'General case' 0 N--CA 1.431 -1.407 0 N-CA-C 118.064 2.616 . . . . 1.0 118.064 -166.053 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 57.4 m -167.33 125.92 1.32 Allowed 'General case' 0 N--CA 1.429 -1.49 0 O-C-N 119.347 -2.096 . . . . 1.0 110.836 171.6 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . 0.294 0.1 OUTLIER -51.03 -86.14 0.0 OUTLIER 'General case' 0 N--CA 1.429 -1.475 0 N-CA-C 117.195 2.294 . . . . 1.0 117.195 173.539 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 88' ' ' TRP . . . . . . . . . . . . . 22.3 m95 -58.96 -39.95 83.23 Favored 'General case' 0 N--CA 1.431 -1.422 0 CA-C-N 121.2 1.818 . . . . 1.0 113.584 -173.27 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 9.3 t70 -67.69 -39.96 84.41 Favored 'General case' 0 N--CA 1.43 -1.455 0 N-CA-C 114.388 1.255 . . . . 1.0 114.388 -176.82 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 30.3 tp -76.03 -41.61 50.38 Favored 'General case' 0 N--CA 1.43 -1.438 0 O-C-N 119.098 -2.251 . . . . 1.0 112.483 177.363 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -48.01 -47.38 33.35 Favored 'General case' 0 CA--C 1.489 -1.394 0 C-N-CA 127.495 2.318 . . . . 1.0 113.376 166.835 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 1.3 tp10 -56.52 -51.9 66.77 Favored 'General case' 0 N--CA 1.43 -1.426 0 C-N-CA 127.105 2.162 . . . . 1.0 113.29 170.387 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 7.2 tt0 -52.47 -51.06 61.27 Favored 'General case' 0 N--CA 1.43 -1.464 0 O-C-N 120.668 -1.27 . . . . 1.0 112.866 174.539 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -53.19 -48.73 67.83 Favored 'General case' 0 N--CA 1.43 -1.432 0 N-CA-C 115.034 1.494 . . . . 1.0 115.034 172.706 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -64.45 -53.5 47.3 Favored 'General case' 0 N--CA 1.429 -1.495 0 O-C-N 120.135 -1.603 . . . . 1.0 113.255 178.989 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 96' ' ' THR . . . . . 0.602 HG22 ' H ' ' A' ' 103' ' ' VAL . 47.5 p -59.4 -38.04 79.56 Favored 'General case' 0 CA--C 1.488 -1.431 0 C-N-CA 126.543 1.937 . . . . 1.0 114.051 179.439 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 5.8 pt20 -78.65 -27.19 45.23 Favored 'General case' 0 N--CA 1.429 -1.476 0 N-CA-C 114.871 1.434 . . . . 1.0 114.871 177.944 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 12.4 mm100 -74.67 -38.74 62.35 Favored 'General case' 0 N--CA 1.431 -1.421 0 O-C-N 120.22 -1.55 . . . . 1.0 112.129 170.718 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -79.86 -46.31 17.08 Favored 'General case' 0 N--CA 1.43 -1.45 0 N-CA-C 114.928 1.455 . . . . 1.0 114.928 179.669 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . 122.5 0.1 10.25 Favored Glycine 0 N--CA 1.431 -1.659 0 N-CA-C 116.475 1.35 . . . . 1.0 116.475 174.433 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 11.2 pt-20 -153.56 174.33 14.58 Favored 'General case' 0 N--CA 1.429 -1.499 0 CA-C-N 119.355 1.577 . . . . 1.0 110.223 -178.813 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 16.9 m -74.2 121.62 21.52 Favored 'General case' 0 N--CA 1.43 -1.452 0 O-C-N 120.736 -1.228 . . . . 1.0 112.738 177.928 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 103' ' ' VAL . . . . . 0.602 ' H ' HG22 ' A' ' 96' ' ' THR . 40.5 t -120.87 134.92 62.71 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.458 0 N-CA-C 102.284 -3.228 . . . . 1.0 102.284 -175.195 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 43.7 p -106.73 129.02 54.68 Favored 'General case' 0 N--CA 1.43 -1.457 0 N-CA-C 115.218 1.562 . . . . 1.0 115.218 -166.336 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -139.69 -35.8 0.52 Allowed 'General case' 0 N--CA 1.43 -1.434 0 C-N-CA 127.155 2.182 . . . . 1.0 108.938 167.959 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 2.9 tmm_? . . . . . 0 C--O 1.26 1.609 0 C-N-CA 125.737 1.615 . . . . 1.0 112.859 -167.59 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 13.4 tpt . . . . . 0 CA--C 1.491 -1.304 0 CA-C-O 120.752 0.311 . . . . 1.0 110.441 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 43.1 m-80 -68.19 -49.06 63.31 Favored 'General case' 0 N--CA 1.43 -1.453 0 C-N-CA 124.61 1.164 . . . . 1.0 112.34 -176.34 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -57.04 -48.97 77.25 Favored 'General case' 0 N--CA 1.43 -1.432 0 C-N-CA 126.806 2.042 . . . . 1.0 113.857 172.93 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 27.8 t -50.88 -52.9 37.23 Favored 'General case' 0 N--CA 1.431 -1.401 0 C-N-CA 125.722 1.609 . . . . 1.0 114.099 172.579 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 49.7 tt0 -62.86 -52.42 63.17 Favored 'General case' 0 N--CA 1.431 -1.395 0 C-N-CA 124.765 1.226 . . . . 1.0 113.976 -178.452 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -63.46 -35.31 80.03 Favored 'General case' 0 N--CA 1.43 -1.441 0 O-C-N 120.673 -1.267 . . . . 1.0 114.362 178.626 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 9.0 t-160 -66.49 -37.79 85.86 Favored 'General case' 0 N--CA 1.43 -1.432 0 O-C-N 120.198 -1.564 . . . . 1.0 113.791 172.755 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 1.5 mmm180 -68.56 -43.93 75.56 Favored 'General case' 0 N--CA 1.43 -1.432 0 O-C-N 120.055 -1.653 . . . . 1.0 113.687 175.73 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 67.1 mt -56.52 -46.26 80.67 Favored 'General case' 0 N--CA 1.43 -1.45 0 C-N-CA 124.666 1.186 . . . . 1.0 112.558 172.251 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -54.51 -55.69 26.47 Favored 'General case' 0 N--CA 1.43 -1.442 0 C-N-CA 124.477 1.111 . . . . 1.0 113.498 171.6 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 18.7 t70 -46.16 -48.15 17.51 Favored 'General case' 0 N--CA 1.43 -1.45 0 C-N-CA 126.491 1.917 . . . . 1.0 114.093 178.284 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 12.5 mm100 -55.72 -60.6 3.21 Favored 'General case' 0 N--CA 1.43 -1.456 0 N-CA-C 114.522 1.305 . . . . 1.0 114.522 172.944 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 2.5 pp -74.49 -37.68 63.09 Favored 'General case' 0 N--CA 1.43 -1.459 0 N-CA-C 116.585 2.068 . . . . 1.0 116.585 -175.497 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 11.9 m0 -55.6 -47.06 77.11 Favored 'General case' 0 N--CA 1.431 -1.411 0 C-N-CA 127.753 2.421 . . . . 1.0 112.109 171.663 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 47.8 tp -59.73 -45.25 92.75 Favored 'General case' 0 N--CA 1.43 -1.451 0 O-C-N 121.057 -1.027 . . . . 1.0 113.468 172.142 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 25.5 m -56.28 -46.34 79.78 Favored 'General case' 0 N--CA 1.431 -1.383 0 N-CA-C 114.853 1.427 . . . . 1.0 114.853 175.387 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 67.6 mt -64.75 -46.21 92.82 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.437 0 O-C-N 120.431 -1.418 . . . . 1.0 112.206 178.263 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 58.1 tt0 -53.41 -58.41 7.22 Favored 'General case' 0 N--CA 1.43 -1.443 0 C-N-CA 125.047 1.339 . . . . 1.0 111.939 174.765 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 23.7 mt-10 -55.68 -55.43 32.26 Favored 'General case' 0 N--CA 1.43 -1.446 0 C-N-CA 125.789 1.635 . . . . 1.0 115.138 176.748 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 7.2 tpm_? -52.31 -49.18 64.74 Favored 'General case' 0 N--CA 1.43 -1.445 0 C-N-CA 124.578 1.151 . . . . 1.0 113.056 -177.456 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . 0.422 HD23 HG21 ' A' ' 41' ' ' ILE . 12.8 tp -81.51 -36.51 29.15 Favored 'General case' 0 N--CA 1.43 -1.432 0 N-CA-C 113.991 1.108 . . . . 1.0 113.991 -176.335 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 27.4 t70 -64.17 -34.36 77.9 Favored 'General case' 0 N--CA 1.431 -1.42 0 O-C-N 119.994 -1.691 . . . . 1.0 114.51 176.567 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 10.1 t70 -67.87 -26.81 66.21 Favored 'General case' 0 N--CA 1.43 -1.431 0 O-C-N 120.185 -1.572 . . . . 1.0 113.388 172.752 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 24' ' ' TRP . . . . . . . . . . . . . 0.2 OUTLIER -75.92 148.84 37.93 Favored 'General case' 0 N--CA 1.43 -1.426 0 O-C-N 120.154 -1.591 . . . . 1.0 114.003 -167.512 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 2.3 t70 -129.1 133.78 47.8 Favored 'General case' 0 N--CA 1.429 -1.491 0 O-C-N 120.528 -1.358 . . . . 1.0 108.972 -175.099 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -166.64 -149.16 5.85 Favored Glycine 0 N--CA 1.431 -1.652 0 O-C-N 120.536 -1.352 . . . . 1.0 112.521 -171.439 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 10.9 t70 -77.03 -41.65 41.72 Favored 'General case' 0 N--CA 1.431 -1.421 0 N-CA-C 107.88 -1.156 . . . . 1.0 107.88 168.439 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 47.1 m -65.2 141.62 58.6 Favored 'General case' 0 N--CA 1.43 -1.471 0 C-N-CA 125.275 1.43 . . . . 1.0 114.236 174.083 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 20.0 t70 -110.97 147.3 35.0 Favored 'General case' 0 N--CA 1.429 -1.517 0 N-CA-C 105.993 -1.854 . . . . 1.0 105.993 171.5 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 48.6 mm -135.02 115.7 19.07 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.457 0 C-N-CA 125.555 1.542 . . . . 1.0 108.528 -160.895 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -121.83 110.22 15.63 Favored 'General case' 0 N--CA 1.43 -1.472 0 C-N-CA 124.461 1.104 . . . . 1.0 109.188 158.718 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 10.3 t -77.13 143.73 38.94 Favored 'General case' 0 N--CA 1.429 -1.507 0 O-C-N 118.625 -2.547 . . . . 1.0 110.204 164.952 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 52.2 mt-10 -101.74 140.07 36.53 Favored 'General case' 0 N--CA 1.431 -1.415 0 C-N-CA 124.37 1.068 . . . . 1.0 109.302 172.211 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 2.5 tp -122.1 107.33 19.56 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.488 0 CA-C-O 124.327 2.013 . . . . 1.0 108.372 177.293 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 35.1 m120 -117.79 68.57 0.76 Allowed 'General case' 0 N--CA 1.43 -1.434 0 CA-C-N 114.425 -1.261 . . . . 1.0 109.651 176.499 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . 73.17 -86.55 0.58 Allowed Glycine 0 N--CA 1.43 -1.713 0 C-N-CA 125.363 1.459 . . . . 1.0 114.334 173.088 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -120.34 27.31 6.7 Favored Glycine 0 N--CA 1.429 -1.79 0 C-N-CA 125.332 1.444 . . . . 1.0 111.866 175.019 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 66.4 t -128.34 129.11 69.03 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.449 0 N-CA-C 107.661 -1.237 . . . . 1.0 107.661 169.628 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 46.3 mt -113.02 123.97 51.56 Favored 'General case' 0 N--CA 1.429 -1.481 0 CA-C-O 122.846 1.307 . . . . 1.0 108.655 166.754 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -121.84 116.33 24.24 Favored 'General case' 0 N--CA 1.43 -1.455 0 N-CA-C 106.348 -1.723 . . . . 1.0 106.348 179.385 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 41' ' ' ILE . . . . . 0.422 HG21 HD23 ' A' ' 21' ' ' LEU . 49.3 mt -94.04 116.1 34.45 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.411 0 O-C-N 119.625 -1.922 . . . . 1.0 108.644 -172.985 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 47.0 p -109.76 120.06 41.29 Favored 'General case' 0 N--CA 1.43 -1.438 0 N-CA-C 113.237 0.828 . . . . 1.0 113.237 -173.656 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 43' ' ' PHE . . . . . . . . . . . . 0.25 1.2 p90 -118.23 166.34 12.72 Favored 'General case' 0 N--CA 1.429 -1.492 0 CA-C-O 123.322 1.534 . . . . 1.0 114.093 179.487 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 1.1 pp20? -63.13 -31.4 72.54 Favored 'General case' 0 N--CA 1.43 -1.45 0 N-CA-C 117.517 2.414 . . . . 1.0 117.517 -159.179 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 59.5 m-80 -74.81 -0.36 18.08 Favored 'General case' 0 N--CA 1.431 -1.411 0 N-CA-C 114.905 1.446 . . . . 1.0 114.905 176.67 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 99.41 -1.3 57.19 Favored Glycine 0 N--CA 1.432 -1.613 0 O-C-N 120.673 -1.267 . . . . 1.0 113.255 166.849 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 3.4 p -96.52 164.47 12.6 Favored 'General case' 0 N--CA 1.428 -1.548 0 C-N-CA 127.028 2.131 . . . . 1.0 110.255 178.439 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 54.3 pttt -162.35 158.93 24.74 Favored 'General case' 0 N--CA 1.429 -1.479 0 CA-C-O 122.468 1.128 . . . . 1.0 113.655 -171.108 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 17.9 mm -103.7 140.14 22.71 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.412 0 C-N-CA 125.258 1.423 . . . . 1.0 107.232 179.073 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 50' ' ' ILE . . . . . 0.433 ' HB ' ' HB3' ' A' ' 63' ' ' ALA . 1.2 mm -122.39 108.04 20.89 Favored 'Isoleucine or valine' 0 N--CA 1.428 -1.53 0 CA-C-N 119.649 1.113 . . . . 1.0 110.299 -175.34 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 2.7 mt -122.82 98.6 5.82 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.463 0 CA-C-O 123.357 1.551 . . . . 1.0 111.828 179.117 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 2.3 m120 -108.81 148.0 31.23 Favored 'General case' 0 N--CA 1.429 -1.51 0 C-N-CA 127.896 2.478 . . . . 1.0 108.727 174.796 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 39.1 ttp180 -154.29 134.29 13.1 Favored 'General case' 0 N--CA 1.429 -1.496 0 CA-C-N 113.729 -1.578 . . . . 1.0 108.305 -167.055 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -89.55 129.47 36.01 Favored 'General case' 0 N--CA 1.431 -1.391 0 N-CA-C 106.687 -1.598 . . . . 1.0 106.687 163.617 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 37.8 tt0 -63.7 -51.25 67.05 Favored Pre-proline 0 N--CA 1.431 -1.393 0 CA-C-O 116.573 -1.68 . . . . 1.0 113.431 172.581 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 52.6 Cg_exo -67.29 -175.69 0.71 Allowed 'Trans proline' 0 N--CA 1.433 -2.055 0 CA-C-N 125.307 2.931 . . . . 1.0 114.707 162.707 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 15.0 mt 82.38 -30.07 0.1 Allowed 'General case' 0 N--CA 1.43 -1.452 0 C-N-CA 127.657 2.383 . . . . 1.0 114.934 169.439 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER 76.87 47.38 0.07 Allowed 'General case' 0 N--CA 1.432 -1.364 0 C-N-CA 126.247 1.819 . . . . 1.0 114.204 170.433 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 38.2 tt0 -160.36 152.12 19.92 Favored 'General case' 0 N--CA 1.429 -1.48 0 O-C-N 120.693 -1.254 . . . . 1.0 108.27 179.031 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 15.6 t -120.73 156.91 23.91 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.486 0 C-N-CA 124.819 1.248 . . . . 1.0 109.83 179.634 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 61' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -99.35 153.49 18.93 Favored 'General case' 0 N--CA 1.43 -1.427 0 O-C-N 120.567 -1.333 . . . . 1.0 111.419 170.198 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -137.45 90.9 2.55 Favored 'General case' 0 N--CA 1.43 -1.457 0 O-C-N 120.103 -1.623 . . . . 1.0 109.862 179.116 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . 0.433 ' HB3' ' HB ' ' A' ' 50' ' ' ILE . . . -104.37 139.92 38.65 Favored 'General case' 0 N--CA 1.429 -1.492 0 O-C-N 119.943 -1.723 . . . . 1.0 111.858 175.647 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 64' ' ' THR . . . . . . . . . . . . . 80.8 p -150.44 -130.28 0.05 OUTLIER 'General case' 0 N--CA 1.43 -1.468 0 C-N-CA 126.633 1.973 . . . . 1.0 105.783 -163.082 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 4.7 tmtt? -84.82 -39.64 18.11 Favored 'General case' 0 N--CA 1.43 -1.434 0 O-C-N 120.254 -1.529 . . . . 1.0 110.913 166.076 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 1.7 tp-100 -78.62 -25.14 45.05 Favored 'General case' 0 N--CA 1.43 -1.453 0 N-CA-C 114.937 1.458 . . . . 1.0 114.937 -150.785 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 169.76 -52.04 0.2 Allowed Glycine 0 N--CA 1.43 -1.729 0 O-C-N 121.076 -1.015 . . . . 1.0 113.16 174.632 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 116.48 93.53 1.79 Allowed Glycine 0 N--CA 1.43 -1.7 0 C-N-CA 125.255 1.407 . . . . 1.0 110.843 -173.691 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 69' ' ' TYR . . . . . 0.486 ' CD1' ' HG2' ' A' ' 82' ' ' ARG . 13.5 m-85 -122.07 143.26 49.63 Favored 'General case' 0 N--CA 1.43 -1.464 0 N-CA-C 107.962 -1.125 . . . . 1.0 107.962 -166.406 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 70' ' ' HIS . . . . . . . . . . . . 0.275 1.3 p80 -89.47 160.92 16.52 Favored 'General case' 0 N--CA 1.429 -1.482 0 O-C-N 119.376 -2.078 . . . . 1.0 113.746 178.636 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 71' ' ' PHE . . . . . . . . . . . . 0.27 11.9 t80 -139.34 125.0 19.45 Favored 'General case' 0 N--CA 1.429 -1.48 0 CA-C-N 115.333 -0.849 . . . . 1.0 111.076 -149.589 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -126.25 161.4 27.83 Favored 'General case' 0 N--CA 1.431 -1.402 0 C-N-CA 123.746 0.818 . . . . 1.0 109.974 178.089 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 57.3 tp -96.11 121.83 38.29 Favored 'General case' 0 N--CA 1.43 -1.434 0 O-C-N 119.599 -1.938 . . . . 1.0 110.403 176.391 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 20.0 mmmt -84.89 -48.56 9.2 Favored 'General case' 0 N--CA 1.43 -1.461 0 O-C-N 120.989 -1.069 . . . . 1.0 112.815 175.74 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -171.85 -69.77 0.04 OUTLIER Glycine 0 N--CA 1.429 -1.77 0 N-CA-C 110.843 -0.903 . . . . 1.0 110.843 179.007 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 20.2 p-10 -90.06 -26.92 20.03 Favored 'General case' 0 N--CA 1.43 -1.469 0 O-C-N 121.07 -1.253 . . . . 1.0 111.09 179.089 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 5.8 mt-10 -152.58 155.75 37.97 Favored 'General case' 0 N--CA 1.429 -1.492 0 N-CA-C 104.161 -2.533 . . . . 1.0 104.161 -164.417 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 78' ' ' TRP . . . . . . . . . . . . . 31.0 m95 -86.69 123.59 32.03 Favored 'General case' 0 N--CA 1.43 -1.456 0 N-CA-C 107.084 -1.45 . . . . 1.0 107.084 -178.311 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 3.3 mt -101.47 137.12 30.26 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.484 0 CA-C-O 123.893 1.806 . . . . 1.0 106.332 176.804 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 74.8 m -77.17 145.95 37.37 Favored 'General case' 0 N--CA 1.428 -1.527 0 CA-C-N 114.411 -1.268 . . . . 1.0 109.977 -175.593 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 37.6 t0 -73.44 -43.51 60.2 Favored 'General case' 0 N--CA 1.431 -1.416 0 O-C-N 120.469 -1.394 . . . . 1.0 111.953 -174.007 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 82' ' ' ARG . . . . . 0.486 ' HG2' ' CD1' ' A' ' 69' ' ' TYR . 0.1 OUTLIER -79.11 134.55 36.72 Favored 'General case' 0 N--CA 1.43 -1.463 0 O-C-N 119.977 -1.702 . . . . 1.0 110.378 176.911 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 8.0 t 65.58 -66.24 0.15 Allowed 'General case' 0 N--CA 1.43 -1.437 0 N-CA-C 116.215 1.932 . . . . 1.0 116.215 -179.951 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 130.48 89.49 0.52 Allowed Glycine 0 N--CA 1.43 -1.711 0 N-CA-C 107.474 -2.25 . . . . 1.0 107.474 -167.417 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 52.3 mt-10 -137.97 -168.33 2.33 Favored 'General case' 0 N--CA 1.431 -1.413 0 N-CA-C 105.162 -2.162 . . . . 1.0 105.162 -178.755 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 32.0 m -154.99 130.71 9.96 Favored 'General case' 0 N--CA 1.43 -1.471 0 O-C-N 119.346 -2.096 . . . . 1.0 111.102 -150.661 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 1.1 t80 -25.79 -92.56 0.0 OUTLIER 'General case' 0 N--CA 1.429 -1.492 0 N-CA-C 119.674 3.213 . . . . 1.0 119.674 174.7 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 88' ' ' TRP . . . . . . . . . . . . . 78.8 m95 -72.12 -26.8 62.26 Favored 'General case' 0 N--CA 1.429 -1.483 0 O-C-N 120.392 -1.442 . . . . 1.0 110.379 -169.819 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -68.42 -49.97 56.14 Favored 'General case' 0 N--CA 1.43 -1.454 0 C-N-CA 125.409 1.483 . . . . 1.0 113.139 178.413 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -70.14 -42.74 72.16 Favored 'General case' 0 N--CA 1.429 -1.48 0 CA-C-O 122.969 1.366 . . . . 1.0 111.73 -177.565 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 24.6 tp -53.76 -49.86 67.29 Favored 'General case' 0 N--CA 1.43 -1.459 0 C-N-CA 126.371 1.868 . . . . 1.0 112.946 173.996 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 1.9 tm-20 -58.21 -55.76 30.81 Favored 'General case' 0 N--CA 1.43 -1.443 0 C-N-CA 126.742 2.017 . . . . 1.0 114.816 173.71 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 3.6 pt20 -63.96 -43.42 95.83 Favored 'General case' 0 N--CA 1.43 -1.437 0 O-C-N 120.577 -1.327 . . . . 1.0 114.068 -177.452 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -62.79 -47.97 81.15 Favored 'General case' 0 N--CA 1.43 -1.442 0 O-C-N 120.635 -1.29 . . . . 1.0 113.057 175.098 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -63.43 -35.99 82.24 Favored 'General case' 0 N--CA 1.428 -1.536 0 O-C-N 120.312 -1.493 . . . . 1.0 113.399 176.98 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 91.5 m -57.75 -51.96 67.41 Favored 'General case' 0 N--CA 1.43 -1.456 0 C-N-CA 125.526 1.53 . . . . 1.0 112.474 173.149 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 5.0 pt20 -70.18 -31.34 68.77 Favored 'General case' 0 N--CA 1.43 -1.45 0 N-CA-C 114.75 1.389 . . . . 1.0 114.75 -179.847 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 51.0 mt-30 -66.26 -46.71 76.12 Favored 'General case' 0 N--CA 1.43 -1.468 0 O-C-N 119.741 -1.849 . . . . 1.0 114.806 169.876 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -77.98 -46.88 19.85 Favored 'General case' 0 N--CA 1.428 -1.534 0 N-CA-C 113.912 1.078 . . . . 1.0 113.912 -176.335 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . 99.58 24.7 9.84 Favored Glycine 0 N--CA 1.431 -1.691 0 C-N-CA 124.502 1.048 . . . . 1.0 113.422 -175.499 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 13.7 pt-20 -161.63 160.69 29.08 Favored 'General case' 0 N--CA 1.429 -1.482 0 N-CA-C 106.495 -1.669 . . . . 1.0 106.495 174.672 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 70.2 m -66.63 112.18 4.03 Favored 'General case' 0 N--CA 1.429 -1.5 0 CA-C-N 120.087 1.312 . . . . 1.0 112.43 -178.522 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 39.9 t -100.49 108.43 23.03 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.453 0 N-CA-C 107.302 -1.37 . . . . 1.0 107.302 173.867 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 44.0 p -141.31 127.72 19.95 Favored 'General case' 0 N--CA 1.43 -1.442 0 N-CA-C 113.792 1.034 . . . . 1.0 113.792 -169.483 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 5.2 t80 -93.85 -24.31 17.79 Favored 'General case' 0 N--CA 1.43 -1.458 0 C-N-CA 124.059 0.944 . . . . 1.0 109.759 167.366 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 18.3 mmm-85 . . . . . 0 C--O 1.261 1.661 0 O-C-N 120.971 -1.081 . . . . 1.0 110.385 -175.56 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 72.7 mtp . . . . . 0 CA--C 1.49 -1.348 0 N-CA-C 113.519 0.933 . . . . 1.0 113.519 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 23.6 t-20 -114.47 136.99 52.4 Favored 'General case' 0 N--CA 1.431 -1.397 0 O-C-N 120.996 -1.065 . . . . 1.0 112.892 -169.499 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 16.2 m-20 -61.69 -54.16 46.33 Favored 'General case' 0 N--CA 1.43 -1.447 0 C-N-CA 125.96 1.704 . . . . 1.0 113.924 176.451 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 53.9 m -65.56 -33.57 76.22 Favored 'General case' 0 N--CA 1.429 -1.496 0 O-C-N 120.462 -1.399 . . . . 1.0 113.247 -177.705 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 37.0 tt0 -60.33 -55.09 37.92 Favored 'General case' 0 N--CA 1.43 -1.448 0 C-N-CA 124.306 1.042 . . . . 1.0 112.488 170.471 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 19.8 t80 -50.56 -48.11 57.58 Favored 'General case' 0 N--CA 1.431 -1.425 0 N-CA-C 114.651 1.352 . . . . 1.0 114.651 170.829 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 7.5 t-80 -55.62 -55.72 28.75 Favored 'General case' 0 N--CA 1.43 -1.435 0 C-N-CA 125.979 1.712 . . . . 1.0 114.939 177.344 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 42.6 mtm105 -61.12 -54.37 45.38 Favored 'General case' 0 CA--C 1.49 -1.357 0 C-N-CA 124.86 1.264 . . . . 1.0 113.017 179.92 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 95.9 mt -59.9 -46.45 89.31 Favored 'General case' 0 N--CA 1.431 -1.393 0 O-C-N 121.249 -0.907 . . . . 1.0 113.299 -179.221 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -57.53 -43.46 84.36 Favored 'General case' 0 N--CA 1.43 -1.448 0 N-CA-C 113.779 1.029 . . . . 1.0 113.779 177.355 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 15.9 t0 -63.27 -46.96 84.4 Favored 'General case' 0 N--CA 1.43 -1.45 0 N-CA-C 113.297 0.851 . . . . 1.0 113.297 177.307 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 59.7 mt-30 -61.04 -48.61 80.97 Favored 'General case' 0 N--CA 1.432 -1.35 0 N-CA-C 116.357 1.984 . . . . 1.0 116.357 174.92 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 3.9 pp -67.39 -39.11 85.59 Favored 'General case' 0 N--CA 1.43 -1.474 0 O-C-N 119.917 -1.739 . . . . 1.0 113.996 179.626 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 5.6 m0 -48.69 -57.52 6.15 Favored 'General case' 0 N--CA 1.43 -1.459 0 C-N-CA 126.039 1.736 . . . . 1.0 114.195 166.983 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 51.6 tp -58.7 -41.82 87.17 Favored 'General case' 0 N--CA 1.431 -1.41 0 N-CA-C 113.819 1.044 . . . . 1.0 113.819 177.741 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 90.3 m -57.74 -55.44 34.83 Favored 'General case' 0 N--CA 1.43 -1.444 0 C-N-CA 125.819 1.647 . . . . 1.0 113.496 175.915 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 86.1 mt -59.76 -48.9 85.85 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.419 0 C-N-CA 125.557 1.543 . . . . 1.0 112.397 176.768 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 69.6 tt0 -54.92 -53.3 57.29 Favored 'General case' 0 N--CA 1.428 -1.525 0 C-N-CA 125.226 1.41 . . . . 1.0 113.776 178.666 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 34.8 tt0 -63.88 -43.78 95.02 Favored 'General case' 0 N--CA 1.429 -1.523 0 N-CA-C 114.484 1.29 . . . . 1.0 114.484 179.287 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 6.8 tpt180 -67.19 -35.31 79.38 Favored 'General case' 0 N--CA 1.43 -1.438 0 N-CA-C 114.562 1.319 . . . . 1.0 114.562 -179.559 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 94.6 mt -78.23 -35.87 47.76 Favored 'General case' 0 N--CA 1.43 -1.466 0 O-C-N 120.627 -1.295 . . . . 1.0 113.409 174.314 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 37.2 t70 -57.87 -33.12 68.35 Favored 'General case' 0 N--CA 1.43 -1.465 0 C-N-CA 125.155 1.382 . . . . 1.0 113.026 171.036 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 33.6 t70 -69.79 -18.66 63.49 Favored 'General case' 0 N--CA 1.431 -1.41 0 N-CA-C 114.382 1.253 . . . . 1.0 114.382 174.359 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 24' ' ' TRP . . . . . . . . . . . . . 28.8 t-105 -75.99 152.44 36.98 Favored 'General case' 0 N--CA 1.429 -1.488 0 O-C-N 119.225 -2.172 . . . . 1.0 114.184 -171.557 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 1.8 t0 -154.33 175.79 13.11 Favored 'General case' 0 N--CA 1.431 -1.419 0 N-CA-C 108.635 -0.876 . . . . 1.0 108.635 -174.059 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 160.03 -131.43 2.68 Favored Glycine 0 N--CA 1.43 -1.733 0 N-CA-C 110.911 -0.875 . . . . 1.0 110.911 -178.655 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -86.52 -34.47 19.97 Favored 'General case' 0 N--CA 1.429 -1.489 0 C-N-CA 125.523 1.529 . . . . 1.0 108.697 170.566 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 39.3 m -85.5 172.29 11.1 Favored 'General case' 0 N--CA 1.43 -1.434 0 C-N-CA 124.795 1.238 . . . . 1.0 112.918 -176.589 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 43.1 t0 -121.41 151.43 40.19 Favored 'General case' 0 N--CA 1.431 -1.408 0 C-N-CA 125.874 1.67 . . . . 1.0 106.92 176.116 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -159.84 117.72 0.2 Allowed 'Isoleucine or valine' 0 N--CA 1.43 -1.46 0 CA-C-O 122.355 1.074 . . . . 1.0 108.265 -167.863 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 23.8 t0 -136.21 134.82 38.55 Favored 'General case' 0 N--CA 1.428 -1.546 0 O-C-N 120.83 -1.169 . . . . 1.0 109.066 175.451 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 73.4 m -100.66 138.82 37.21 Favored 'General case' 0 N--CA 1.43 -1.47 0 O-C-N 119.531 -1.981 . . . . 1.0 111.423 179.793 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 52.6 mt-10 -109.81 134.44 52.03 Favored 'General case' 0 N--CA 1.43 -1.459 0 O-C-N 121.102 -0.999 . . . . 1.0 109.929 -172.09 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 2.3 tp -105.29 106.41 20.46 Favored 'Isoleucine or valine' 0 CA--C 1.488 -1.413 0 N-CA-C 105.25 -2.13 . . . . 1.0 105.25 169.304 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 55.2 t30 -135.55 107.5 7.11 Favored 'General case' 0 N--CA 1.43 -1.457 0 CA-C-N 114.777 -1.101 . . . . 1.0 109.899 -173.242 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . 67.11 31.44 77.7 Favored Glycine 0 N--CA 1.43 -1.756 0 O-C-N 120.413 -1.43 . . . . 1.0 114.944 174.179 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 81.64 4.54 90.34 Favored Glycine 0 N--CA 1.429 -1.794 0 O-C-N 121.231 -1.158 . . . . 1.0 114.775 -174.581 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 24.2 t -103.51 127.36 57.57 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.471 0 N-CA-C 107.963 -1.125 . . . . 1.0 107.963 175.353 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 12.3 mt -88.64 127.14 35.56 Favored 'General case' 0 N--CA 1.431 -1.385 0 CA-C-O 123.626 1.679 . . . . 1.0 107.084 161.601 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -130.09 115.04 16.51 Favored 'General case' 0 N--CA 1.429 -1.492 0 N-CA-C 105.759 -1.941 . . . . 1.0 105.759 -169.605 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 82.9 mt -94.14 110.78 24.1 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.485 0 N-CA-C 107.867 -1.16 . . . . 1.0 107.867 -168.625 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 9.8 p -112.65 126.6 55.55 Favored 'General case' 0 N--CA 1.431 -1.423 0 CA-C-O 121.662 0.744 . . . . 1.0 112.508 -170.319 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 43' ' ' PHE . . . . . . . . . . . . . 1.6 p90 -119.97 159.83 23.94 Favored 'General case' 0 N--CA 1.429 -1.489 0 O-C-N 120.558 -1.339 . . . . 1.0 110.405 174.048 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -66.03 -15.08 62.73 Favored 'General case' 0 N--CA 1.43 -1.475 0 N-CA-C 117.762 2.505 . . . . 1.0 117.762 -163.454 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 45.1 m-80 -71.8 -7.74 50.1 Favored 'General case' 0 N--CA 1.43 -1.429 0 C-N-CA 125.935 1.694 . . . . 1.0 113.845 173.472 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 88.76 41.42 6.0 Favored Glycine 0 N--CA 1.429 -1.819 0 O-C-N 120.942 -1.098 . . . . 1.0 114.668 165.888 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 17.0 m -150.99 168.92 23.08 Favored 'General case' 0 N--CA 1.43 -1.45 0 N-CA-C 106.058 -1.831 . . . . 1.0 106.058 179.597 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -156.96 153.27 27.78 Favored 'General case' 0 N--CA 1.43 -1.442 0 N-CA-C 114.295 1.22 . . . . 1.0 114.295 -168.202 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 5.0 mm -97.61 140.62 17.43 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.478 0 C-N-CA 125.825 1.65 . . . . 1.0 106.963 177.598 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 4.7 mm -115.85 118.16 57.9 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.468 0 C-N-CA 124.616 1.166 . . . . 1.0 110.176 -171.935 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 3.4 mt -128.68 120.87 53.55 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.479 0 CA-C-O 122.806 1.288 . . . . 1.0 112.476 -176.876 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 52' ' ' ASN . . . . . 0.461 ' H ' ' HD1' ' A' ' 61' ' ' TRP . 47.2 t30 -156.46 169.17 25.24 Favored 'General case' 0 N--CA 1.429 -1.488 0 N-CA-C 105.374 -2.084 . . . . 1.0 105.374 -178.739 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 29.6 ptt180 -140.57 127.22 20.3 Favored 'General case' 0 N--CA 1.431 -1.409 0 C-N-CA 124.777 1.231 . . . . 1.0 113.004 -159.315 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -110.46 108.2 18.13 Favored 'General case' 0 N--CA 1.43 -1.469 0 C-N-CA 125.212 1.405 . . . . 1.0 110.935 -174.641 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 86.8 mt-10 -64.82 -52.76 48.2 Favored Pre-proline 0 N--CA 1.43 -1.462 0 N-CA-C 118.363 2.727 . . . . 1.0 118.363 -169.497 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 31.9 Cg_exo -73.52 -10.62 23.89 Favored 'Trans proline' 0 N--CA 1.433 -2.033 0 CA-C-N 128.01 3.896 . . . . 1.0 114.01 -168.971 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 35.0 mt -94.1 -22.37 18.53 Favored 'General case' 0 N--CA 1.431 -1.425 0 C-N-CA 126.282 1.833 . . . . 1.0 109.159 177.535 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 32.3 m80 65.91 47.92 1.92 Allowed 'General case' 0 N--CA 1.429 -1.494 0 C-N-CA 126.614 1.965 . . . . 1.0 111.193 175.145 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 13.9 pt20 -144.01 149.33 36.55 Favored 'General case' 0 N--CA 1.429 -1.49 0 C-N-CA 124.31 1.044 . . . . 1.0 110.733 -178.769 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 4.2 t -100.2 153.23 4.6 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.5 0 N-CA-C 108.372 -0.973 . . . . 1.0 108.372 172.043 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 61' ' ' TRP . . . . . 0.461 ' HD1' ' H ' ' A' ' 52' ' ' ASN . 0.0 OUTLIER -102.73 155.3 18.41 Favored 'General case' 0 N--CA 1.43 -1.443 0 O-C-N 119.856 -1.777 . . . . 1.0 113.784 173.337 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 18.2 mt -125.52 94.93 4.28 Favored 'General case' 0 N--CA 1.432 -1.36 0 N-CA-C 106.16 -1.793 . . . . 1.0 106.16 164.207 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . 0.406 ' HA ' ' HA2' ' A' ' 68' ' ' GLY . . . -98.56 140.7 32.4 Favored 'General case' 0 N--CA 1.429 -1.49 0 CA-C-O 122.712 1.244 . . . . 1.0 110.113 171.812 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 64' ' ' THR . . . . . . . . . . . . . 6.3 t -153.47 -130.04 0.04 OUTLIER 'General case' 0 N--CA 1.431 -1.414 0 O-C-N 120.767 -1.208 . . . . 1.0 109.011 -169.883 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 3.4 tmtp? -72.01 -64.96 0.83 Allowed 'General case' 0 N--CA 1.429 -1.498 0 O-C-N 119.969 -1.707 . . . . 1.0 111.537 -179.871 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -128.24 -26.69 2.79 Favored 'General case' 0 N--CA 1.429 -1.507 0 O-C-N 121.41 -0.806 . . . . 1.0 112.011 179.139 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . -94.84 61.96 1.62 Allowed Glycine 0 N--CA 1.431 -1.668 0 O-C-N 121.062 -1.024 . . . . 1.0 113.486 -168.62 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . 0.406 ' HA2' ' HA ' ' A' ' 63' ' ' ALA . . . -75.17 83.81 0.84 Allowed Glycine 0 N--CA 1.43 -1.705 0 CA-C-O 122.609 1.116 . . . . 1.0 115.663 174.412 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 20.0 m-30 -113.96 148.28 37.16 Favored 'General case' 0 N--CA 1.43 -1.432 0 N-CA-C 107.454 -1.313 . . . . 1.0 107.454 -169.634 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 18.1 p-80 -86.52 157.77 19.69 Favored 'General case' 0 N--CA 1.43 -1.428 0 O-C-N 120.288 -1.507 . . . . 1.0 111.272 174.593 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 71' ' ' PHE . . . . . . . . . . . . 0.294 86.9 t80 -121.41 113.18 19.51 Favored 'General case' 0 N--CA 1.43 -1.447 0 C-N-CA 125.671 1.588 . . . . 1.0 107.951 -157.147 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 12.1 m-20 -146.99 157.57 43.66 Favored 'General case' 0 N--CA 1.428 -1.56 0 CA-C-N 119.501 1.046 . . . . 1.0 111.323 -175.532 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 27.5 tp -84.78 137.09 33.4 Favored 'General case' 0 N--CA 1.432 -1.366 0 O-C-N 120.465 -1.397 . . . . 1.0 113.711 -172.302 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 38.9 mmtm -106.14 -96.63 0.35 Allowed 'General case' 0 N--CA 1.429 -1.475 0 C-N-CA 125.143 1.377 . . . . 1.0 108.926 166.971 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -100.7 -96.28 2.22 Favored Glycine 0 N--CA 1.429 -1.774 0 O-C-N 120.946 -1.096 . . . . 1.0 112.989 178.637 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 44.2 t0 -98.19 17.02 19.55 Favored 'General case' 0 N--CA 1.431 -1.394 0 C-N-CA 125.409 1.484 . . . . 1.0 108.182 173.587 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 5.3 mm-40 -135.78 124.58 23.97 Favored 'General case' 0 N--CA 1.43 -1.472 0 N-CA-C 106.162 -1.792 . . . . 1.0 106.162 -167.834 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 78' ' ' TRP . . . . . . . . . . . . . 46.8 m95 -80.56 102.22 9.63 Favored 'General case' 0 N--CA 1.43 -1.472 0 N-CA-C 104.639 -2.356 . . . . 1.0 104.639 161.536 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 1.7 pt -89.22 158.04 2.99 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.474 0 O-C-N 119.184 -2.197 . . . . 1.0 108.122 179.313 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 89.6 m -81.63 116.04 21.18 Favored 'General case' 0 N--CA 1.432 -1.359 0 N-CA-C 106.409 -1.7 . . . . 1.0 106.409 170.974 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 6.1 t70 -69.91 -41.58 74.47 Favored 'General case' 0 N--CA 1.431 -1.412 0 C-N-CA 126.147 1.779 . . . . 1.0 112.538 -161.744 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 27.3 ttt180 -73.24 125.23 27.29 Favored 'General case' 0 N--CA 1.431 -1.389 0 C-N-CA 125.8 1.64 . . . . 1.0 109.514 172.345 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 83' ' ' SER . . . . . . . . . . . . 0.341 56.8 m 73.17 -42.44 0.53 Allowed 'General case' 0 N--CA 1.43 -1.462 0 C-N-CA 126.511 1.924 . . . . 1.0 115.717 -174.947 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 107.18 70.16 0.72 Allowed Glycine 0 N--CA 1.43 -1.752 0 O-C-N 120.629 -1.294 . . . . 1.0 114.38 166.564 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 64.1 mm-40 -120.27 -126.62 0.27 Allowed 'General case' 0 N--CA 1.429 -1.481 0 CA-C-N 117.953 0.877 . . . . 1.0 112.519 -169.383 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 92.7 m -158.59 140.22 13.54 Favored 'General case' 0 N--CA 1.43 -1.467 0 O-C-N 119.806 -1.808 . . . . 1.0 108.851 -168.527 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 0.8 OUTLIER -42.94 -92.46 0.0 OUTLIER 'General case' 0 N--CA 1.43 -1.47 0 C-N-CA 127.699 2.399 . . . . 1.0 115.704 172.366 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 88' ' ' TRP . . . . . . . . . . . . . 1.1 t-105 -75.57 -26.61 58.08 Favored 'General case' 0 N--CA 1.428 -1.535 0 O-C-N 120.517 -1.365 . . . . 1.0 111.01 -164.739 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 60.2 m-20 -63.8 -42.53 97.69 Favored 'General case' 0 N--CA 1.43 -1.442 0 O-C-N 120.175 -1.578 . . . . 1.0 114.586 173.531 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 33.3 tp -74.66 -41.74 59.76 Favored 'General case' 0 N--CA 1.428 -1.526 0 O-C-N 119.457 -2.027 . . . . 1.0 111.733 178.589 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 37.0 tp -55.06 -35.4 64.47 Favored 'General case' 0 N--CA 1.431 -1.415 0 C-N-CA 126.617 1.967 . . . . 1.0 114.371 169.947 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 3.0 tm-20 -61.9 -53.51 54.81 Favored 'General case' 0 N--CA 1.43 -1.428 0 C-N-CA 126.189 1.796 . . . . 1.0 111.222 167.466 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 6.5 tt0 -56.01 -46.33 78.82 Favored 'General case' 0 N--CA 1.43 -1.435 0 CA-C-N 120.808 1.64 . . . . 1.0 115.151 176.514 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -51.67 -58.19 7.07 Favored 'General case' 0 N--CA 1.43 -1.438 0 C-N-CA 127.104 2.162 . . . . 1.0 114.584 171.859 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -64.63 -42.61 95.36 Favored 'General case' 0 N--CA 1.429 -1.487 0 O-C-N 120.5 -1.375 . . . . 1.0 113.604 178.366 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 44.5 m -57.87 -48.35 80.07 Favored 'General case' 0 N--CA 1.43 -1.431 0 C-N-CA 126.561 1.945 . . . . 1.0 112.56 175.403 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 2.0 pt20 -70.3 -28.36 65.13 Favored 'General case' 0 N--CA 1.429 -1.485 0 O-C-N 120.185 -1.572 . . . . 1.0 114.043 -179.953 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 3.6 mm-40 -81.84 -36.65 28.04 Favored 'General case' 0 N--CA 1.429 -1.477 0 O-C-N 120.033 -1.667 . . . . 1.0 114.263 175.656 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -86.14 -34.57 20.54 Favored 'General case' 0 N--CA 1.43 -1.435 0 O-C-N 120.518 -1.364 . . . . 1.0 114.186 -179.817 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . 92.67 22.06 29.69 Favored Glycine 0 N--CA 1.429 -1.794 0 O-C-N 120.514 -1.366 . . . . 1.0 114.073 178.156 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 12.0 pt-20 -158.17 158.46 34.64 Favored 'General case' 0 N--CA 1.43 -1.436 0 N-CA-C 104.707 -2.331 . . . . 1.0 104.707 -172.631 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 39.7 m -74.02 112.68 10.38 Favored 'General case' 0 N--CA 1.43 -1.444 0 CA-C-N 121.318 1.872 . . . . 1.0 111.848 178.205 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 44.7 t -107.24 101.59 12.72 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.444 0 CA-C-O 122.623 1.201 . . . . 1.0 108.315 177.071 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 66.1 p -139.76 149.91 44.14 Favored 'General case' 0 N--CA 1.429 -1.494 0 O-C-N 120.939 -1.101 . . . . 1.0 113.823 -168.057 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 105' ' ' PHE . . . . . . . . . . . . 0.262 0.0 OUTLIER -106.74 -21.94 12.88 Favored 'General case' 0 N--CA 1.429 -1.49 0 C-N-CA 124.679 1.192 . . . . 1.0 110.602 158.76 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 5.2 mmm180 . . . . . 0 C--O 1.26 1.628 0 CA-C-O 117.659 -1.162 . . . . 1.0 111.118 -178.855 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 54.1 ttp . . . . . 0 CA--C 1.489 -1.386 0 CA-C-O 121.749 0.785 . . . . 1.0 109.119 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 1.8 p30 -170.5 -39.72 0.02 OUTLIER 'General case' 0 N--CA 1.43 -1.435 0 O-C-N 120.871 -1.143 . . . . 1.0 112.278 -173.389 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 3.8 m-20 -55.71 -48.67 74.75 Favored 'General case' 0 N--CA 1.431 -1.424 0 C-N-CA 126.605 1.962 . . . . 1.0 114.784 -173.079 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 19.2 m -52.36 -53.93 38.3 Favored 'General case' 0 N--CA 1.43 -1.456 0 C-N-CA 125.186 1.394 . . . . 1.0 113.905 178.418 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 45.0 mt-10 -57.48 -58.59 7.62 Favored 'General case' 0 N--CA 1.431 -1.425 0 C-N-CA 125.49 1.516 . . . . 1.0 112.082 176.414 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 6' ' ' PHE . . . . . 0.425 ' HB2' ' CD2' ' A' ' 58' ' ' HIS . 2.7 t80 -56.56 -39.44 73.45 Favored 'General case' 0 N--CA 1.43 -1.459 0 N-CA-C 116.481 2.03 . . . . 1.0 116.481 178.967 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 29.7 m170 -67.82 -44.16 77.92 Favored 'General case' 0 CA--C 1.489 -1.372 0 O-C-N 121.061 -1.024 . . . . 1.0 113.454 179.418 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -70.89 -41.6 71.11 Favored 'General case' 0 N--CA 1.431 -1.392 0 O-C-N 121.091 -1.006 . . . . 1.0 112.295 178.53 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 89.9 mt -62.49 -39.07 92.28 Favored 'General case' 0 N--CA 1.431 -1.421 0 O-C-N 119.682 -1.886 . . . . 1.0 113.554 174.157 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -59.74 -53.2 60.75 Favored 'General case' 0 N--CA 1.43 -1.473 0 C-N-CA 125.047 1.339 . . . . 1.0 112.776 172.53 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 40.1 t0 -47.44 -54.97 9.94 Favored 'General case' 0 N--CA 1.43 -1.473 0 C-N-CA 127.609 2.364 . . . . 1.0 112.965 177.098 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 42.4 mt-30 -55.23 -50.73 68.69 Favored 'General case' 0 N--CA 1.43 -1.46 0 N-CA-C 116.375 1.991 . . . . 1.0 116.375 173.705 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 1.8 pp -71.27 -38.35 71.85 Favored 'General case' 0 N--CA 1.429 -1.497 0 O-C-N 119.942 -1.724 . . . . 1.0 115.386 178.888 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 0.5 OUTLIER -45.78 -57.19 4.49 Favored 'General case' 0 N--CA 1.429 -1.489 0 C-N-CA 128.231 2.612 . . . . 1.0 113.45 168.195 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 3.0 pp -70.55 -30.34 67.04 Favored 'General case' 0 N--CA 1.43 -1.431 0 O-C-N 120.764 -1.21 . . . . 1.0 112.926 -179.193 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 97.3 m -64.27 -50.19 68.91 Favored 'General case' 0 N--CA 1.43 -1.45 0 C-N-CA 124.419 1.088 . . . . 1.0 112.815 174.516 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 82.7 mt -60.49 -47.53 92.29 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.477 0 O-C-N 120.621 -1.3 . . . . 1.0 111.706 175.422 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 3.8 tt0 -52.45 -57.23 10.52 Favored 'General case' 0 N--CA 1.43 -1.432 0 N-CA-C 114.611 1.337 . . . . 1.0 114.611 175.115 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 21.9 tt0 -75.64 -33.36 60.47 Favored 'General case' 0 N--CA 1.429 -1.504 0 N-CA-C 114.719 1.377 . . . . 1.0 114.719 -174.488 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 2.0 tpm_? -64.81 -44.28 90.39 Favored 'General case' 0 N--CA 1.43 -1.426 0 O-C-N 119.668 -1.895 . . . . 1.0 112.433 174.133 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 4.6 mm? -74.13 -31.41 62.74 Favored 'General case' 0 N--CA 1.431 -1.424 0 N-CA-C 113.18 0.807 . . . . 1.0 113.18 178.435 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 20.1 t70 -54.55 -53.57 52.71 Favored 'General case' 0 N--CA 1.431 -1.423 0 O-C-N 120.432 -1.418 . . . . 1.0 113.171 167.909 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 6.0 t70 -96.52 29.64 2.86 Favored 'General case' 0 N--CA 1.43 -1.435 0 CA-C-O 122.175 0.988 . . . . 1.0 112.721 -174.27 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 24' ' ' TRP . . . . . . . . . . . . . 54.6 t-105 -80.27 -177.71 6.25 Favored 'General case' 0 N--CA 1.43 -1.449 0 O-C-N 120.037 -1.664 . . . . 1.0 111.379 177.083 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 40.1 t0 -81.16 65.82 6.44 Favored 'General case' 0 N--CA 1.429 -1.499 0 O-C-N 119.857 -1.777 . . . . 1.0 111.199 179.525 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -179.84 138.74 3.52 Favored Glycine 0 N--CA 1.429 -1.789 0 N-CA-C 107.056 -2.418 . . . . 1.0 107.056 -179.844 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 3.9 t70 -108.74 -43.68 4.2 Favored 'General case' 0 N--CA 1.43 -1.474 0 N-CA-C 108.446 -0.946 . . . . 1.0 108.446 -179.705 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 67.8 m -85.57 159.92 19.76 Favored 'General case' 0 N--CA 1.43 -1.472 0 C-N-CA 126.041 1.737 . . . . 1.0 109.953 171.876 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . 0.683 ' HA ' ' H ' ' A' ' 44' ' ' GLU 0.3 15.9 t70 61.26 20.53 11.12 Favored 'General case' 0 N--CA 1.429 -1.497 0 C-N-CA 128.156 2.582 . . . . 1.0 116.572 176.854 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 10.0 tp -147.21 111.36 0.8 Allowed 'Isoleucine or valine' 0 N--CA 1.43 -1.458 0 O-C-N 120.148 -1.595 . . . . 1.0 107.814 173.219 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 38.2 t0 -153.31 108.68 3.23 Favored 'General case' 0 N--CA 1.43 -1.462 0 O-C-N 120.544 -1.347 . . . . 1.0 108.421 -175.514 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 11.8 t -86.31 143.86 27.67 Favored 'General case' 0 N--CA 1.429 -1.477 0 O-C-N 118.055 -2.903 . . . . 1.0 113.099 -174.855 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 91.7 mt-10 -92.77 136.94 32.8 Favored 'General case' 0 N--CA 1.431 -1.417 0 C-N-CA 125.735 1.614 . . . . 1.0 108.481 167.164 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 4.3 mp -129.66 105.94 12.91 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.444 0 N-CA-C 106.421 -1.696 . . . . 1.0 106.421 177.451 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 35.1 m120 -128.48 77.63 1.79 Allowed 'General case' 0 N--CA 1.43 -1.475 0 CA-C-N 114.768 -1.105 . . . . 1.0 111.045 -178.647 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . 62.49 26.77 68.57 Favored Glycine 0 N--CA 1.429 -1.806 0 N-CA-C 118.587 2.195 . . . . 1.0 118.587 161.255 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 130.92 -32.8 2.94 Favored Glycine 0 N--CA 1.431 -1.685 0 N-CA-C 109.785 -1.326 . . . . 1.0 109.785 -173.82 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 44.9 t -88.41 128.17 40.86 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.434 0 O-C-N 121.639 -0.918 . . . . 1.0 109.212 175.562 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 80.2 mt -114.9 130.26 56.87 Favored 'General case' 0 N--CA 1.43 -1.445 0 N-CA-C 108.089 -1.078 . . . . 1.0 108.089 169.12 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -122.98 114.98 21.14 Favored 'General case' 0 N--CA 1.43 -1.426 0 N-CA-C 106.188 -1.782 . . . . 1.0 106.188 174.926 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 58.7 mt -88.05 112.13 23.21 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.482 0 N-CA-C 105.25 -2.13 . . . . 1.0 105.25 -178.788 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 33.3 m -108.7 143.04 38.32 Favored 'General case' 0 N--CA 1.43 -1.446 0 CA-C-O 122.237 1.017 . . . . 1.0 109.916 -166.024 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 43' ' ' PHE . . . . . . . . . . . . . 53.0 m-85 -115.31 155.96 26.34 Favored 'General case' 0 N--CA 1.43 -1.433 0 C-N-CA 124.874 1.27 . . . . 1.0 108.127 -172.806 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . 0.683 ' H ' ' HA ' ' A' ' 29' ' ' ASP . 5.3 mm-40 -66.12 -23.16 66.44 Favored 'General case' 0 N--CA 1.429 -1.501 0 O-C-N 119.291 -2.131 . . . . 1.0 115.299 164.268 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 49.4 m-80 -65.92 -7.26 15.66 Favored 'General case' 0 N--CA 1.429 -1.48 0 C-N-CA 124.989 1.316 . . . . 1.0 114.128 164.963 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 94.99 -8.49 70.25 Favored Glycine 0 N--CA 1.431 -1.694 0 O-C-N 119.962 -1.711 . . . . 1.0 113.925 169.219 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 1.5 m -80.71 -170.33 2.59 Favored 'General case' 0 N--CA 1.43 -1.45 0 C-N-CA 126.626 1.971 . . . . 1.0 113.001 -171.635 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 44.7 pttt -168.6 126.49 1.07 Allowed 'General case' 0 N--CA 1.43 -1.439 0 O-C-N 119.922 -1.736 . . . . 1.0 114.497 -162.819 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 49' ' ' ILE . . . . . 0.45 HD13 HG23 ' A' ' 64' ' ' THR . 5.9 mm -100.23 107.41 20.92 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.45 0 N-CA-C 106.737 -1.579 . . . . 1.0 106.737 166.298 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 4.5 tp -106.18 117.6 52.24 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.506 0 O-C-N 120.036 -1.665 . . . . 1.0 110.886 -173.942 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 3.7 mt -128.55 131.65 68.58 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.408 0 C-N-CA 125.864 1.666 . . . . 1.0 109.943 -171.444 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 16.8 t30 -161.26 175.03 12.74 Favored 'General case' 0 N--CA 1.432 -1.374 0 N-CA-C 104.628 -2.36 . . . . 1.0 104.628 -172.267 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 60.7 ttp85 -151.22 138.4 19.27 Favored 'General case' 0 N--CA 1.43 -1.46 0 O-C-N 120.033 -1.667 . . . . 1.0 108.238 -162.27 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 1.6 tt0 -149.03 -45.35 0.14 Allowed 'General case' 0 CA--C 1.489 -1.394 0 O-C-N 121.154 -0.966 . . . . 1.0 109.339 -168.647 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 55.5 mt-10 -76.05 147.77 80.64 Favored Pre-proline 0 N--CA 1.43 -1.468 0 N-CA-C 114.277 1.214 . . . . 1.0 114.277 -164.553 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 47.8 Cg_endo -77.6 -174.61 2.29 Favored 'Trans proline' 0 C--N 1.299 -2.06 0 C-N-CA 122.811 2.341 . . . . 1.0 111.478 166.221 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . 0.505 ' O ' ' CD2' ' A' ' 58' ' ' HIS . 22.8 mt 79.34 -48.66 0.4 Allowed 'General case' 0 N--CA 1.431 -1.402 0 C-N-CA 128.89 2.876 . . . . 1.0 112.122 178.305 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 58' ' ' HIS . . . . . 0.505 ' CD2' ' O ' ' A' ' 57' ' ' LEU . 20.8 m170 143.82 88.33 0.0 OUTLIER 'General case' 0 N--CA 1.43 -1.452 1 C-N-CA 132.382 4.273 . . . . 1.0 108.014 172.382 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 8.1 tt0 -154.25 145.27 22.7 Favored 'General case' 0 N--CA 1.43 -1.458 0 CA-C-N 123.06 2.664 . . . . 1.0 111.922 168.302 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 2.2 t -127.93 160.16 37.97 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.466 0 C-N-CA 127.478 2.311 . . . . 1.0 111.723 -175.395 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 61' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -109.48 152.44 25.41 Favored 'General case' 0 N--CA 1.431 -1.424 0 C-N-CA 124.564 1.146 . . . . 1.0 110.987 177.222 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 2.3 pt? -154.24 124.08 6.73 Favored 'General case' 0 N--CA 1.43 -1.45 0 CA-C-O 122.655 1.216 . . . . 1.0 109.935 168.781 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . 0.454 ' HA ' ' HA2' ' A' ' 68' ' ' GLY . . . -124.24 130.48 52.59 Favored 'General case' 0 N--CA 1.429 -1.487 0 N-CA-C 115.042 1.497 . . . . 1.0 115.042 -178.813 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 64' ' ' THR . . . . . 0.45 HG23 HD13 ' A' ' 49' ' ' ILE . 8.6 m -123.97 -102.44 0.38 Allowed 'General case' 0 N--CA 1.432 -1.352 0 C-N-CA 124.467 1.107 . . . . 1.0 110.983 177.553 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 9.1 tmtm? -125.92 -40.63 2.01 Favored 'General case' 0 N--CA 1.429 -1.483 0 O-C-N 120.369 -1.457 . . . . 1.0 111.814 -163.648 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 5.2 tm0? -79.42 -23.96 42.84 Favored 'General case' 0 N--CA 1.428 -1.537 0 O-C-N 120.662 -1.274 . . . . 1.0 112.576 -172.872 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . -176.18 -62.58 0.06 OUTLIER Glycine 0 N--CA 1.43 -1.761 0 O-C-N 120.36 -1.462 . . . . 1.0 112.501 171.229 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . 0.454 ' HA2' ' HA ' ' A' ' 63' ' ' ALA . . . 107.61 109.59 3.37 Favored Glycine 0 N--CA 1.43 -1.703 0 C-N-CA 124.894 1.235 . . . . 1.0 110.732 -171.322 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 23.1 m-85 -121.64 170.83 9.33 Favored 'General case' 0 N--CA 1.431 -1.404 0 C-N-CA 125.027 1.331 . . . . 1.0 108.665 -169.096 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 5.6 p80 -115.85 161.08 19.29 Favored 'General case' 0 N--CA 1.43 -1.463 0 O-C-N 120.278 -1.514 . . . . 1.0 110.025 171.606 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 71' ' ' PHE . . . . . . . . . . . . 0.273 65.6 t80 -135.27 120.77 19.27 Favored 'General case' 0 N--CA 1.43 -1.431 0 C-N-CA 124.721 1.208 . . . . 1.0 109.829 -144.418 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 51.4 t0 -139.54 165.82 26.23 Favored 'General case' 0 N--CA 1.43 -1.436 0 CA-C-O 121.884 0.85 . . . . 1.0 110.424 -176.96 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 55.9 tp -103.03 121.59 42.88 Favored 'General case' 0 N--CA 1.43 -1.435 0 O-C-N 120.268 -1.52 . . . . 1.0 113.209 -167.48 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 29.6 mmtm -112.65 84.98 2.07 Favored 'General case' 0 N--CA 1.43 -1.439 0 O-C-N 120.9 -1.125 . . . . 1.0 109.305 170.926 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . 73.38 -95.52 0.77 Allowed Glycine 0 N--CA 1.43 -1.736 0 O-C-N 120.573 -1.33 . . . . 1.0 114.823 174.365 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 55.9 m-20 -104.31 -3.83 23.71 Favored 'General case' 0 N--CA 1.43 -1.425 0 C-N-CA 125.645 1.578 . . . . 1.0 112.975 -176.639 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 33.3 tt0 -150.24 132.39 15.37 Favored 'General case' 0 N--CA 1.429 -1.501 0 N-CA-C 106.317 -1.734 . . . . 1.0 106.317 -169.59 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 78' ' ' TRP . . . . . . . . . . . . . 33.7 m95 -79.93 127.29 32.08 Favored 'General case' 0 N--CA 1.43 -1.441 0 O-C-N 120.666 -1.271 . . . . 1.0 108.878 177.224 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 9.5 mt -103.14 135.86 38.56 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.513 0 C-N-CA 125.766 1.626 . . . . 1.0 107.016 177.565 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -81.39 134.63 35.58 Favored 'General case' 0 N--CA 1.43 -1.456 0 O-C-N 121.009 -1.057 . . . . 1.0 109.168 178.36 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 25.7 t70 -77.6 -20.74 53.47 Favored 'General case' 0 N--CA 1.431 -1.411 0 N-CA-C 115.359 1.615 . . . . 1.0 115.359 -162.684 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 4.3 mmp_? -82.71 -90.03 0.08 Allowed 'General case' 0 N--CA 1.43 -1.432 0 O-C-N 120.349 -1.469 . . . . 1.0 113.462 -174.868 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 31.7 p -72.06 -29.64 64.35 Favored 'General case' 0 N--CA 1.431 -1.39 0 O-C-N 120.069 -1.644 . . . . 1.0 114.16 -176.854 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 106.24 83.37 1.62 Allowed Glycine 0 N--CA 1.43 -1.747 0 N-CA-C 109.716 -1.354 . . . . 1.0 109.716 -171.851 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 5.0 mm-40 -140.66 -172.27 3.41 Favored 'General case' 0 N--CA 1.431 -1.422 0 N-CA-C 105.693 -1.966 . . . . 1.0 105.693 -170.854 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 30.1 m -145.84 131.99 19.4 Favored 'General case' 0 N--CA 1.43 -1.444 0 O-C-N 120.578 -1.326 . . . . 1.0 111.435 -155.077 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . . 1.1 t80 -21.83 -97.08 0.0 OUTLIER 'General case' 0 N--CA 1.43 -1.433 0 N-CA-C 120.418 3.488 . . . . 1.0 120.418 175.523 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 88' ' ' TRP . . . . . . . . . . . . . 29.9 m95 -71.69 -26.83 62.67 Favored 'General case' 0 N--CA 1.431 -1.419 0 O-C-N 120.247 -1.533 . . . . 1.0 110.889 -167.445 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 16.2 m-20 -79.25 -42.21 26.41 Favored 'General case' 0 N--CA 1.43 -1.456 0 C-N-CA 126.432 1.893 . . . . 1.0 112.747 -176.879 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -70.3 -39.94 74.55 Favored 'General case' 0 N--CA 1.43 -1.452 0 O-C-N 119.716 -1.865 . . . . 1.0 111.54 176.007 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 41.0 tp -53.74 -47.28 70.78 Favored 'General case' 0 N--CA 1.429 -1.484 0 C-N-CA 126.252 1.821 . . . . 1.0 113.589 170.345 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 30.2 tt0 -56.73 -56.19 24.68 Favored 'General case' 0 N--CA 1.43 -1.448 0 C-N-CA 125.08 1.352 . . . . 1.0 113.917 169.832 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 38.6 mt-30 -55.34 -42.91 74.48 Favored 'General case' 0 N--CA 1.43 -1.442 0 C-N-CA 125.168 1.387 . . . . 1.0 113.678 179.248 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -59.21 -55.34 36.2 Favored 'General case' 0 N--CA 1.428 -1.526 0 C-N-CA 127.055 2.142 . . . . 1.0 114.395 173.538 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -65.68 -40.64 92.58 Favored 'General case' 0 N--CA 1.429 -1.498 0 O-C-N 120.222 -1.549 . . . . 1.0 113.314 -179.377 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 31.8 m -56.23 -45.81 79.81 Favored 'General case' 0 N--CA 1.43 -1.426 0 C-N-CA 125.215 1.406 . . . . 1.0 114.335 168.257 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 9.0 pt20 -71.8 -22.27 61.59 Favored 'General case' 0 N--CA 1.431 -1.397 0 O-C-N 120.589 -1.319 . . . . 1.0 114.129 -178.465 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 2.4 mm-40 -72.79 -57.64 3.94 Favored 'General case' 0 N--CA 1.431 -1.381 0 O-C-N 121.441 -0.787 . . . . 1.0 112.83 166.549 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -77.09 -41.95 40.13 Favored 'General case' 0 N--CA 1.43 -1.461 0 N-CA-C 117.089 2.255 . . . . 1.0 117.089 -170.563 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . 83.99 43.27 7.22 Favored Glycine 0 N--CA 1.43 -1.704 0 O-C-N 120.86 -1.15 . . . . 1.0 111.907 -165.868 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 4.9 tp10 -161.28 154.53 21.36 Favored 'General case' 0 N--CA 1.431 -1.419 0 N-CA-C 107.409 -1.33 . . . . 1.0 107.409 -169.69 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 93.2 m -78.47 93.68 4.8 Favored 'General case' 0 N--CA 1.43 -1.449 0 O-C-N 118.953 -2.342 . . . . 1.0 110.594 168.821 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 47.9 t -105.48 90.29 1.53 Allowed 'Isoleucine or valine' 0 N--CA 1.43 -1.437 0 C-N-CA 125.844 1.658 . . . . 1.0 106.931 -179.398 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 59.5 p -143.07 178.23 7.83 Favored 'General case' 0 N--CA 1.43 -1.444 0 O-C-N 120.709 -1.245 . . . . 1.0 113.754 -172.678 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -108.93 -40.41 5.03 Favored 'General case' 0 N--CA 1.43 -1.452 0 O-C-N 120.633 -1.292 . . . . 1.0 110.646 177.577 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 24.9 ttp180 . . . . . 0 C--O 1.259 1.581 0 O-C-N 120.766 -1.209 . . . . 1.0 111.824 -165.549 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 2.3 mpt? . . . . . 0 CA--C 1.49 -1.333 0 N-CA-C 111.51 0.189 . . . . 1.0 111.51 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 4.3 p30 -152.33 153.36 33.51 Favored 'General case' 0 N--CA 1.43 -1.435 0 O-C-N 120.74 -1.225 . . . . 1.0 110.145 -179.817 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 1.1 p-10 -66.58 -30.49 70.8 Favored 'General case' 0 N--CA 1.43 -1.447 0 N-CA-C 114.978 1.473 . . . . 1.0 114.978 -176.67 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 8.5 t -63.52 -54.3 38.45 Favored 'General case' 0 N--CA 1.43 -1.47 0 O-C-N 120.492 -1.38 . . . . 1.0 113.368 174.019 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 53.9 mt-10 -63.38 -42.2 98.81 Favored 'General case' 0 N--CA 1.431 -1.385 0 O-C-N 120.615 -1.303 . . . . 1.0 113.624 176.625 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 6' ' ' PHE . . . . . 0.401 ' CD1' ' HA ' ' A' ' 58' ' ' HIS . 11.6 t80 -44.89 -55.37 5.5 Favored 'General case' 0 N--CA 1.429 -1.479 0 C-N-CA 125.666 1.586 . . . . 1.0 114.5 167.309 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 0.7 OUTLIER -70.08 -30.41 67.63 Favored 'General case' 0 N--CA 1.431 -1.402 0 N-CA-C 114.514 1.302 . . . . 1.0 114.514 -179.61 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 31.1 ttt85 -68.88 -48.78 62.55 Favored 'General case' 0 N--CA 1.43 -1.45 0 C-N-CA 125.816 1.646 . . . . 1.0 113.182 179.152 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 92.1 mt -64.7 -36.77 85.36 Favored 'General case' 0 N--CA 1.429 -1.516 0 C-N-CA 126.193 1.797 . . . . 1.0 112.366 173.589 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -57.78 -47.44 82.53 Favored 'General case' 0 N--CA 1.43 -1.464 0 C-N-CA 124.293 1.037 . . . . 1.0 113.107 171.914 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -56.57 -43.95 80.52 Favored 'General case' 0 N--CA 1.429 -1.522 0 C-N-CA 126.703 2.001 . . . . 1.0 113.4 175.131 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 19.1 mm-40 -54.99 -63.25 1.21 Allowed 'General case' 0 N--CA 1.431 -1.401 0 C-N-CA 124.879 1.272 . . . . 1.0 113.524 172.855 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 3.7 pp -69.86 -39.85 76.12 Favored 'General case' 0 N--CA 1.43 -1.435 0 O-C-N 120.23 -1.543 . . . . 1.0 114.969 -173.621 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 14' ' ' TRP . . . . . 0.432 ' HE1' ' CG2' ' A' ' 51' ' ' ILE . 9.3 m0 -55.02 -48.66 73.07 Favored 'General case' 0 N--CA 1.43 -1.428 0 N-CA-C 114.179 1.178 . . . . 1.0 114.179 172.032 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 41.1 tp -63.71 -39.41 94.24 Favored 'General case' 0 N--CA 1.43 -1.442 0 N-CA-C 113.05 0.759 . . . . 1.0 113.05 175.876 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 25.6 m -52.36 -50.81 61.61 Favored 'General case' 0 N--CA 1.429 -1.497 0 C-N-CA 125.377 1.471 . . . . 1.0 114.709 172.921 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 20.6 mt -66.71 -48.61 79.57 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.483 0 O-C-N 120.174 -1.579 . . . . 1.0 112.206 178.078 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 41.1 tt0 -53.85 -54.56 36.82 Favored 'General case' 0 N--CA 1.43 -1.461 0 C-N-CA 124.638 1.175 . . . . 1.0 112.294 178.114 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 33.9 tt0 -58.32 -49.71 76.23 Favored 'General case' 0 N--CA 1.431 -1.403 0 C-N-CA 126.45 1.9 . . . . 1.0 114.241 178.414 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 8.7 tpm_? -60.49 -44.76 95.61 Favored 'General case' 0 N--CA 1.43 -1.469 0 CA-C-N 119.817 1.19 . . . . 1.0 112.913 -178.964 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 98.1 mt -72.29 -41.14 66.97 Favored 'General case' 0 N--CA 1.43 -1.443 0 N-CA-C 114.594 1.331 . . . . 1.0 114.594 175.769 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 38.0 t70 -59.48 -36.75 76.63 Favored 'General case' 0 N--CA 1.429 -1.483 0 O-C-N 119.365 -2.084 . . . . 1.0 113.566 174.967 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 24.6 t0 -105.17 33.83 3.49 Favored 'General case' 0 N--CA 1.43 -1.475 0 O-C-N 120.181 -1.575 . . . . 1.0 111.261 174.225 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 24' ' ' TRP . . . . . . . . . . . . . 22.6 t-105 -83.41 -61.76 1.76 Allowed 'General case' 0 N--CA 1.429 -1.494 0 O-C-N 119.872 -1.768 . . . . 1.0 109.896 168.515 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 28.1 t70 70.07 -111.66 0.08 Allowed 'General case' 0 N--CA 1.43 -1.438 0 C-N-CA 125.051 1.34 . . . . 1.0 111.501 174.344 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 76.35 -115.7 4.51 Favored Glycine 0 N--CA 1.43 -1.761 0 O-C-N 120.025 -1.672 . . . . 1.0 114.147 172.921 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -101.89 -19.45 15.27 Favored 'General case' 0 N--CA 1.431 -1.419 0 C-N-CA 124.962 1.305 . . . . 1.0 109.788 172.159 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 54.0 p -80.71 173.63 12.41 Favored 'General case' 0 N--CA 1.429 -1.476 0 N-CA-C 115.949 1.833 . . . . 1.0 115.949 -170.262 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 4.7 t70 -130.53 150.77 51.59 Favored 'General case' 0 N--CA 1.431 -1.416 0 N-CA-C 106.31 -1.737 . . . . 1.0 106.31 161.952 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER -155.16 114.27 0.32 Allowed 'Isoleucine or valine' 0 N--CA 1.431 -1.404 0 C-N-CA 125.047 1.339 . . . . 1.0 108.45 -159.923 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 21.1 m-20 -120.35 107.2 12.65 Favored 'General case' 0 N--CA 1.43 -1.441 0 C-N-CA 125.39 1.476 . . . . 1.0 110.645 174.12 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 27.6 t -86.34 136.22 33.22 Favored 'General case' 0 N--CA 1.431 -1.382 0 O-C-N 119.762 -1.836 . . . . 1.0 109.85 165.904 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 79.1 mt-10 -112.22 135.53 52.78 Favored 'General case' 0 N--CA 1.429 -1.478 0 O-C-N 120.904 -1.122 . . . . 1.0 109.342 179.292 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 3.2 tp -111.03 105.48 18.89 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.419 0 CA-C-O 125.1 2.381 . . . . 1.0 107.766 176.297 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 76.6 m-20 -115.63 74.68 0.9 Allowed 'General case' 0 N--CA 1.431 -1.408 0 CA-C-N 113.102 -1.863 . . . . 1.0 109.11 -179.382 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . 76.34 -92.16 0.96 Allowed Glycine 0 N--CA 1.43 -1.733 0 O-C-N 120.663 -1.273 . . . . 1.0 114.588 174.42 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -120.75 20.51 8.7 Favored Glycine 0 N--CA 1.431 -1.695 0 C-N-CA 124.308 0.956 . . . . 1.0 111.054 174.156 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 40.8 t -121.43 123.96 70.8 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.459 0 N-CA-C 107.543 -1.28 . . . . 1.0 107.543 178.257 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 12.6 mt -111.93 130.1 55.96 Favored 'General case' 0 N--CA 1.43 -1.448 0 CA-C-O 122.865 1.317 . . . . 1.0 107.973 167.308 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 17.9 p -126.33 125.8 42.86 Favored 'General case' 0 N--CA 1.431 -1.425 0 N-CA-C 107.387 -1.338 . . . . 1.0 107.387 177.868 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 22.8 mt -106.11 122.77 60.21 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.416 0 N-CA-C 108.846 -0.798 . . . . 1.0 108.846 -177.166 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 39.6 p -116.69 128.21 55.13 Favored 'General case' 0 N--CA 1.43 -1.449 0 CA-C-O 121.177 0.513 . . . . 1.0 112.055 -173.229 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 43' ' ' PHE . . . . . . . . . . . . . 26.1 p90 -119.66 171.85 8.09 Favored 'General case' 0 N--CA 1.431 -1.415 0 C-N-CA 124.447 1.099 . . . . 1.0 111.333 175.504 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 37.3 mm-40 -51.21 -30.88 18.57 Favored 'General case' 0 N--CA 1.43 -1.431 0 N-CA-C 118.88 2.918 . . . . 1.0 118.88 -173.154 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 6.6 m120 -66.95 -17.88 65.12 Favored 'General case' 0 N--CA 1.431 -1.424 0 O-C-N 119.761 -1.837 . . . . 1.0 114.0 179.007 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 86.95 -0.26 86.14 Favored Glycine 0 N--CA 1.429 -1.776 0 O-C-N 120.505 -1.372 . . . . 1.0 113.463 179.449 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 48.2 m -88.48 158.08 18.45 Favored 'General case' 0 N--CA 1.429 -1.502 0 C-N-CA 125.428 1.491 . . . . 1.0 107.66 167.702 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 6.8 ptpt -154.76 159.58 40.74 Favored 'General case' 0 N--CA 1.43 -1.431 0 O-C-N 120.933 -1.104 . . . . 1.0 112.878 -167.294 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 8.9 mm -100.37 137.64 27.23 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.477 0 N-CA-C 106.587 -1.635 . . . . 1.0 106.587 177.107 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 50' ' ' ILE . . . . . 0.405 ' HB ' ' HB3' ' A' ' 63' ' ' ALA . 4.7 mm -126.21 116.7 46.44 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.472 0 C-N-CA 124.518 1.127 . . . . 1.0 109.692 -178.516 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 51' ' ' ILE . . . . . 0.432 ' CG2' ' HE1' ' A' ' 14' ' ' TRP . 3.3 mt -128.47 128.11 67.78 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.428 0 CA-C-O 122.424 1.107 . . . . 1.0 112.378 -179.629 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 52' ' ' ASN . . . . . 0.611 ' H ' ' HD1' ' A' ' 61' ' ' TRP . 20.4 t-20 -151.35 162.47 40.87 Favored 'General case' 0 N--CA 1.43 -1.471 0 C-N-CA 126.452 1.901 . . . . 1.0 105.995 174.379 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -129.09 145.87 51.18 Favored 'General case' 0 N--CA 1.43 -1.432 0 C-N-CA 125.829 1.651 . . . . 1.0 109.897 -174.498 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 2.2 tt0 -151.25 -38.9 0.12 Allowed 'General case' 0 N--CA 1.431 -1.419 0 O-C-N 120.878 -1.139 . . . . 1.0 111.323 -168.993 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 28.8 mm-40 -70.99 156.55 91.9 Favored Pre-proline 0 N--CA 1.43 -1.47 0 N-CA-C 114.417 1.265 . . . . 1.0 114.417 -168.83 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 39.1 Cg_endo -75.88 -25.86 10.13 Favored 'Trans proline' 0 C--N 1.3 -1.987 0 C-N-CA 121.916 1.744 . . . . 1.0 114.126 -165.626 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 49.4 mt -93.51 -112.87 0.1 Allowed 'General case' 0 N--CA 1.429 -1.496 0 CA-C-O 122.726 1.251 . . . . 1.0 111.018 -173.804 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 58' ' ' HIS . . . . . 0.401 ' HA ' ' CD1' ' A' ' 6' ' ' PHE . 39.3 m170 -125.85 70.1 1.2 Allowed 'General case' 0 N--CA 1.431 -1.394 0 C-N-CA 124.619 1.168 . . . . 1.0 109.171 174.827 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 9.6 mt-30 -141.06 125.44 17.59 Favored 'General case' 0 N--CA 1.431 -1.42 0 O-C-N 120.362 -1.461 . . . . 1.0 109.93 -175.683 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 88.6 t -124.32 156.41 32.0 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.509 0 O-C-N 120.942 -1.099 . . . . 1.0 108.825 -174.77 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 61' ' ' TRP . . . . . 0.611 ' HD1' ' H ' ' A' ' 52' ' ' ASN . 0.0 OUTLIER -92.6 152.22 19.7 Favored 'General case' 0 N--CA 1.43 -1.426 0 O-C-N 120.142 -1.599 . . . . 1.0 110.553 -178.201 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 2.2 tm? -137.27 98.26 3.68 Favored 'General case' 0 N--CA 1.429 -1.5 0 O-C-N 120.41 -1.432 . . . . 1.0 110.465 176.107 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . 0.405 ' HB3' ' HB ' ' A' ' 50' ' ' ILE . . . -103.95 139.61 38.86 Favored 'General case' 0 N--CA 1.431 -1.422 0 CA-C-O 123.314 1.531 . . . . 1.0 111.812 172.378 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 64' ' ' THR . . . . . 0.478 HG23 ' H ' ' A' ' 65' ' ' LYS . 0.0 OUTLIER -153.98 -80.16 0.09 Allowed 'General case' 0 N--CA 1.43 -1.436 0 C-N-CA 126.301 1.84 . . . . 1.0 107.066 -174.304 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . 0.478 ' H ' HG23 ' A' ' 64' ' ' THR . 3.6 tmtt? -116.65 -53.74 2.49 Favored 'General case' 0 N--CA 1.429 -1.494 0 C-N-CA 125.182 1.393 . . . . 1.0 113.376 176.831 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 50.7 mt-30 -72.43 -24.35 61.21 Favored 'General case' 0 N--CA 1.429 -1.499 0 N-CA-C 117.99 2.589 . . . . 1.0 117.99 -160.803 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 151.49 -9.93 0.7 Allowed Glycine 0 N--CA 1.43 -1.711 0 N-CA-C 116.714 1.446 . . . . 1.0 116.714 174.593 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 98.85 77.01 1.29 Allowed Glycine 0 N--CA 1.43 -1.731 0 CA-C-N 118.902 1.351 . . . . 1.0 110.77 -176.066 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 14.5 m-30 -102.22 122.14 43.61 Favored 'General case' 0 N--CA 1.43 -1.468 0 C-N-CA 124.345 1.058 . . . . 1.0 108.547 -175.589 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -86.5 157.25 19.82 Favored 'General case' 0 N--CA 1.431 -1.411 0 O-C-N 119.974 -1.704 . . . . 1.0 114.288 -179.271 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 49.6 p90 -129.37 138.45 51.53 Favored 'General case' 0 N--CA 1.429 -1.499 0 N-CA-C 113.296 0.85 . . . . 1.0 113.296 -165.558 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 23.5 t0 -126.99 159.54 33.77 Favored 'General case' 0 N--CA 1.43 -1.443 0 C-N-CA 126.34 1.856 . . . . 1.0 110.183 -176.779 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 7.0 tt -91.78 122.44 34.33 Favored 'General case' 0 N--CA 1.429 -1.495 0 O-C-N 120.471 -1.393 . . . . 1.0 112.664 -170.764 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 28.9 tptp -83.56 -56.59 3.65 Favored 'General case' 0 N--CA 1.43 -1.47 0 O-C-N 120.441 -1.412 . . . . 1.0 110.782 167.826 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -170.84 -79.65 0.05 OUTLIER Glycine 0 CA--C 1.487 -1.663 0 O-C-N 120.91 -1.119 . . . . 1.0 111.411 -179.805 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 7.6 m-20 -93.79 5.59 51.15 Favored 'General case' 0 N--CA 1.43 -1.451 0 C-N-CA 124.936 1.294 . . . . 1.0 111.139 178.93 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 7.7 pt-20 -165.59 145.33 6.57 Favored 'General case' 0 N--CA 1.431 -1.414 0 N-CA-C 104.383 -2.451 . . . . 1.0 104.383 -153.716 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 78' ' ' TRP . . . . . . . . . . . . . 27.4 m95 -111.79 139.1 47.54 Favored 'General case' 0 N--CA 1.431 -1.39 0 N-CA-C 107.633 -1.247 . . . . 1.0 107.633 178.254 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 40.4 mt -96.32 135.73 29.48 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.483 0 C-N-CA 127.247 2.219 . . . . 1.0 107.977 -179.379 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 75.8 m -82.5 122.19 27.73 Favored 'General case' 0 N--CA 1.431 -1.41 0 N-CA-C 108.154 -1.054 . . . . 1.0 108.154 171.684 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 16.3 t70 -66.68 -47.87 71.1 Favored 'General case' 0 N--CA 1.429 -1.485 0 N-CA-C 114.224 1.194 . . . . 1.0 114.224 -167.227 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 17.1 mmt180 -72.25 129.24 37.97 Favored 'General case' 0 N--CA 1.43 -1.455 0 O-C-N 120.899 -1.126 . . . . 1.0 109.55 177.804 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 83' ' ' SER . . . . . . . . . . . . 0.27 5.6 t 76.45 -47.64 0.55 Allowed 'General case' 0 N--CA 1.428 -1.532 0 C-N-CA 126.869 2.068 . . . . 1.0 114.124 -168.473 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 99.33 70.91 0.97 Allowed Glycine 0 N--CA 1.429 -1.773 0 O-C-N 120.69 -1.256 . . . . 1.0 111.024 176.68 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 5.5 mm-40 -128.97 -131.89 0.22 Allowed 'General case' 0 N--CA 1.431 -1.418 0 C-N-CA 124.156 0.983 . . . . 1.0 110.752 -166.35 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 93.9 m -153.76 133.61 13.1 Favored 'General case' 0 N--CA 1.431 -1.383 0 O-C-N 120.551 -1.343 . . . . 1.0 109.46 -157.34 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 87' ' ' PHE . . . . . . . . . . . . 0.309 0.0 OUTLIER -49.3 -83.11 0.01 OUTLIER 'General case' 0 N--CA 1.43 -1.446 0 N-CA-C 119.939 3.311 . . . . 1.0 119.939 -175.911 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 88' ' ' TRP . . . . . . . . . . . . . 7.9 m95 -65.83 -34.37 78.01 Favored 'General case' 0 N--CA 1.43 -1.443 0 O-C-N 119.84 -1.788 . . . . 1.0 113.367 -175.106 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -61.64 -41.97 98.25 Favored 'General case' 0 N--CA 1.431 -1.408 0 N-CA-C 114.409 1.263 . . . . 1.0 114.409 176.148 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 17.9 tp -67.82 -48.93 64.86 Favored 'General case' 0 N--CA 1.43 -1.454 0 O-C-N 120.647 -1.283 . . . . 1.0 111.054 175.808 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 58.0 tp -51.96 -46.33 64.76 Favored 'General case' 0 N--CA 1.429 -1.492 0 C-N-CA 126.268 1.827 . . . . 1.0 113.752 174.017 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 18.6 tt0 -53.32 -54.39 37.17 Favored 'General case' 0 N--CA 1.429 -1.501 0 C-N-CA 125.983 1.713 . . . . 1.0 111.873 171.639 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -59.23 -53.25 60.4 Favored 'General case' 0 N--CA 1.43 -1.429 0 N-CA-C 113.418 0.896 . . . . 1.0 113.418 -178.188 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -59.7 -43.92 93.88 Favored 'General case' 0 N--CA 1.43 -1.436 0 C-N-CA 125.841 1.656 . . . . 1.0 115.381 178.455 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -71.31 -40.31 70.87 Favored 'General case' 0 N--CA 1.429 -1.517 0 O-C-N 120.497 -1.377 . . . . 1.0 112.988 178.53 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 95.1 m -63.65 -37.02 85.76 Favored 'General case' 0 N--CA 1.43 -1.44 0 C-N-CA 126.415 1.886 . . . . 1.0 112.06 174.304 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -57.35 -54.54 45.67 Favored 'General case' 0 CA--C 1.489 -1.395 0 C-N-CA 127.108 2.163 . . . . 1.0 112.205 173.382 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 98' ' ' GLN . . . . . . . . . . . . . 2.3 pt20 -73.57 -33.73 64.79 Favored 'General case' 0 N--CA 1.43 -1.454 0 N-CA-C 115.217 1.562 . . . . 1.0 115.217 179.165 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -75.36 -41.24 56.94 Favored 'General case' 0 N--CA 1.43 -1.47 0 O-C-N 120.111 -1.618 . . . . 1.0 115.206 177.863 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . 85.87 24.41 41.84 Favored Glycine 0 N--CA 1.429 -1.791 0 C-N-CA 124.692 1.139 . . . . 1.0 112.763 -175.198 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 9.3 pt-20 -175.44 159.19 2.39 Favored 'General case' 0 N--CA 1.43 -1.462 0 C-N-CA 126.495 1.918 . . . . 1.0 106.117 -176.24 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 102' ' ' THR . . . . . . . . . . . . . 44.0 m -69.79 130.77 43.22 Favored 'General case' 0 N--CA 1.43 -1.456 0 O-C-N 120.792 -1.193 . . . . 1.0 113.271 -169.041 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 69.3 t -102.1 120.96 52.52 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.416 0 N-CA-C 107.771 -1.196 . . . . 1.0 107.771 173.768 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 19.7 m -107.03 141.94 37.46 Favored 'General case' 0 N--CA 1.429 -1.493 0 N-CA-C 115.103 1.52 . . . . 1.0 115.103 -160.285 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 2.6 p90 -127.28 -43.36 1.63 Allowed 'General case' 0 N--CA 1.43 -1.467 0 C-N-CA 125.509 1.524 . . . . 1.0 110.783 179.191 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 30.2 mtt-85 . . . . . 0 C--O 1.261 1.671 0 C-N-CA 124.465 1.106 . . . . 1.0 111.05 -179.907 . . . . . . . . 0 0 . 1 stop_ save_