data_2l0r_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 2l0r _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 ' 14' ' ' PHE . . . . . . . . . . . . . 1.8 t80 . . . . . 0 C--O 1.224 -0.271 0 N-CA-C 110.755 -0.091 . . . . 3.45 110.755 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 1.8 pt -71.94 -29.91 35.0 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.299 0 N-CA-C 113.349 0.87 . . . . 1.65 113.349 176.666 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 4.9 t60 -59.67 -57.65 12.02 Favored 'General case' 0 CA--C 1.533 0.297 0 N-CA-C 106.6 -1.63 . . . . 0.73 106.6 174.662 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 28.1 mt-10 -48.1 -45.09 32.41 Favored 'General case' 0 C--O 1.223 -0.311 0 C-N-CA 126.631 1.972 . . . . 2.65 110.368 174.55 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 1.4 t80 -59.23 -48.15 82.69 Favored 'General case' 0 CA--C 1.519 -0.239 0 C-N-CA 123.421 0.688 . . . . 3.16 110.184 179.857 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -51.34 -45.18 52.93 Favored Glycine 0 CA--C 1.523 0.553 0 N-CA-C 110.476 -1.05 . . . . 0.51 110.476 171.835 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 3.9 t60 -64.42 -34.05 77.29 Favored 'General case' 0 N--CA 1.45 -0.451 0 O-C-N 121.628 -0.925 . . . . 2.73 111.826 179.689 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -71.29 -30.09 65.84 Favored 'General case' 0 N--CA 1.454 -0.267 0 O-C-N 121.505 -0.747 . . . . 1.51 109.884 174.594 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 60.5 t -67.25 -39.94 83.98 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.299 0 O-C-N 120.951 -1.093 . . . . 1.74 109.641 174.55 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 15.3 t0 . . . . . 0 C--N 1.327 -0.376 0 C-N-CA 123.669 0.788 . . . . 2.02 111.468 175.465 . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 3.3 t0 . . . . . 0 N--CA 1.47 0.567 0 CA-C-O 121.696 0.76 . . . . 2.51 110.518 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 3.9 mm -54.5 -47.43 71.17 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.301 0 C-N-CA 125.372 1.469 . . . . 1.57 108.616 -172.099 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 26.0 t80 -65.98 -37.1 85.11 Favored 'General case' 0 N--CA 1.449 -0.511 0 O-C-N 121.7 -0.625 . . . . 0.51 112.315 176.792 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . 0.466 ' CA ' ' HE2' ' A' ' 49' ' ' LYS . 0.0 OUTLIER -64.27 -45.74 86.75 Favored 'General case' 0 CA--C 1.514 -0.432 0 C-N-CA 118.007 -1.477 . . . . 2.46 111.244 -172.735 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 5.4 tp10 -84.31 -66.22 0.92 Allowed 'General case' 0 N--CA 1.446 -0.626 0 N-CA-C 108.242 -1.022 . . . . 2.18 108.242 -177.919 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 9.2 mm-40 -69.94 -32.13 70.24 Favored 'General case' 0 CA--C 1.533 0.29 0 O-C-N 121.439 -0.788 . . . . 2.04 110.555 -169.052 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -68.89 37.04 0.29 Allowed Glycine 0 CA--C 1.529 0.931 0 C-N-CA 125.992 1.758 . . . . 0.3 114.546 172.154 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 76.7 p -140.03 17.71 2.46 Favored 'General case' 0 N--CA 1.448 -0.546 0 O-C-N 121.224 -1.162 . . . . 2.69 111.401 160.093 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 30.4 t-20 -131.67 -39.3 1.12 Allowed 'General case' 0 C--N 1.339 0.146 0 N-CA-C 112.099 0.407 . . . . 2.34 112.099 -162.533 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 24.6 mt -63.05 -35.87 81.68 Favored 'General case' 0 CA--C 1.533 0.299 0 O-C-N 121.745 -0.597 . . . . 1.55 110.972 -176.257 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 4.4 t 168.32 175.55 0.04 OUTLIER 'General case' 0 CA--C 1.534 0.351 0 C-N-CA 127.463 2.305 . . . . 1.86 107.673 -179.052 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 6.9 m -59.69 -37.57 79.2 Favored 'General case' 0 N--CA 1.454 -0.249 0 C-N-CA 124.425 1.09 . . . . 1.42 111.378 176.348 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -63.97 -28.41 69.8 Favored 'General case' 0 N--CA 1.463 0.204 0 C-N-CA 122.938 0.495 . . . . 1.49 111.258 173.233 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -68.01 -3.71 31.11 Favored Glycine 0 CA--C 1.523 0.592 0 O-C-N 121.39 -0.819 . . . . 0.58 111.715 172.707 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 1.8 ttt180 -129.87 6.11 5.05 Favored 'General case' 0 N--CA 1.451 -0.402 0 CA-C-N 118.574 1.187 . . . . 2.84 112.231 -174.994 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 58.2 p -75.05 -132.03 0.01 OUTLIER 'General case' 0 CA--C 1.536 0.41 0 N-CA-C 108.123 -1.066 . . . . 1.87 108.123 169.59 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 1.5 m-20 -73.05 155.94 39.26 Favored 'General case' 0 CA--C 1.527 0.079 0 O-C-N 120.283 -1.511 . . . . 1.87 108.447 176.238 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 35.8 tt0 -62.09 -33.48 74.51 Favored 'General case' 0 CA--C 1.534 0.345 0 C-N-CA 119.512 -0.875 . . . . 2.56 110.463 178.531 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -60.82 -21.08 62.79 Favored 'General case' 0 C--N 1.331 -0.236 0 O-C-N 121.117 -0.989 . . . . 1.54 113.596 176.9 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 4.9 mt-10 -85.49 -49.57 7.97 Favored 'General case' 0 CA--C 1.509 -0.615 0 O-C-N 121.331 -0.856 . . . . 1.9 110.919 171.254 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 49.8 t80 -41.11 -49.85 3.45 Favored 'General case' 0 CA--C 1.535 0.376 0 C-N-CA 123.874 0.87 . . . . 0.37 111.666 171.869 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 77.9 t80 -62.59 -47.54 83.36 Favored 'General case' 0 CA--C 1.533 0.3 0 C-N-CA 123.509 0.724 . . . . 0.45 111.314 175.674 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -59.93 -53.46 57.61 Favored 'General case' 0 CA--C 1.535 0.386 0 C-N-CA 124.15 0.98 . . . . 1.43 112.264 -175.672 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 8.0 pt-20 -66.06 -31.07 71.73 Favored 'General case' 0 N--CA 1.451 -0.412 0 O-C-N 120.575 -1.328 . . . . 3.24 112.079 173.527 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -59.33 -40.57 86.74 Favored 'General case' 0 N--CA 1.451 -0.391 0 CA-C-N 119.749 1.159 . . . . 1.41 109.122 174.452 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 23.1 t80 -58.6 -51.4 70.08 Favored 'General case' 0 C--O 1.23 0.055 0 C-N-CA 124.546 1.138 . . . . 3.38 110.92 175.002 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 26.0 ttt180 -46.39 -66.87 0.34 Allowed 'General case' 0 N--CA 1.464 0.247 0 C-N-CA 123.4 0.68 . . . . 2.55 109.548 175.147 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -55.89 -35.77 66.9 Favored 'General case' 0 N--CA 1.45 -0.458 0 C-N-CA 126.19 1.796 . . . . 1.49 109.491 -173.271 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 2.1 ttp -59.64 -37.96 80.09 Favored 'General case' 0 C--O 1.234 0.242 0 N-CA-C 112.283 0.475 . . . . 3.26 112.283 -176.489 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 11.0 p80 -100.01 2.14 43.16 Favored 'General case' 0 CA--C 1.53 0.208 0 N-CA-C 114.459 1.281 . . . . 1.26 114.459 -177.566 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 70.3 m -49.51 128.51 17.56 Favored 'General case' 0 N--CA 1.448 -0.54 0 CA-C-N 120.43 1.468 . . . . 1.52 112.797 -168.518 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 4.1 p -50.96 -45.51 60.79 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 112.97 -1.923 . . . . 1.85 108.88 172.9 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 22.5 t0 -69.22 99.02 1.09 Allowed 'General case' 0 N--CA 1.449 -0.493 0 N-CA-C 107.241 -1.392 . . . . 2.22 107.241 162.951 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 36.8 p-80 -62.86 -30.18 71.31 Favored 'General case' 0 N--CA 1.45 -0.444 0 CA-C-N 115.342 -0.845 . . . . 4.9 112.241 -178.346 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -59.32 -39.42 83.04 Favored 'General case' 0 C--N 1.326 -0.453 0 O-C-N 121.83 -0.543 . . . . 1.53 110.189 174.402 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 2.6 tt0 -52.91 -35.92 58.83 Favored 'General case' 0 N--CA 1.466 0.326 0 CA-C-O 121.643 0.735 . . . . 2.99 110.483 176.817 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 18.6 mtp180 -67.57 -48.19 67.59 Favored 'General case' 0 CA--C 1.519 -0.248 0 N-CA-C 109.262 -0.644 . . . . 3.1 109.262 179.561 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 1.5 mm? -62.89 -23.82 67.52 Favored 'General case' 0 N--CA 1.452 -0.338 0 CA-C-O 117.702 -1.142 . . . . 1.5 112.31 177.848 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 2.5 mptm? -62.09 -44.43 96.68 Favored 'General case' 0 C--O 1.225 -0.234 0 CA-C-N 120.822 1.646 . . . . 1.88 108.349 170.282 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 96.7 t -61.29 -57.94 9.84 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.486 0 CA-C-O 117.467 -1.254 . . . . 1.51 110.962 176.107 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 57.0 mt-30 -55.51 -49.24 73.11 Favored 'General case' 0 N--CA 1.466 0.36 0 CA-C-N 121.603 2.001 . . . . 2.37 111.7 -176.355 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 76.6 tttt -53.92 -49.69 68.08 Favored 'General case' 0 N--CA 1.446 -0.645 0 C-N-CA 123.74 0.816 . . . . 2.57 110.92 179.963 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 3.0 m-20 -83.54 -9.0 59.23 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 118.918 -0.563 . . . . 1.68 111.727 -175.327 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -160.87 73.95 2.7 Favored Pre-proline 0 C--O 1.238 0.466 0 C-N-CA 124.991 1.317 . . . . 1.22 109.669 -170.628 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 84.9 Cg_endo -77.08 22.48 0.56 Allowed 'Trans proline' 0 CA--C 1.537 0.647 0 C-N-CA 123.521 2.814 . . . . 1.44 112.707 -173.41 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 4.7 ptmt -141.61 -43.15 0.36 Allowed 'General case' 0 N--CA 1.451 -0.423 0 C-N-CA 125.799 1.64 . . . . 3.37 109.397 -175.829 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 4.4 m -57.61 -46.09 84.52 Favored 'General case' 0 CA--C 1.517 -0.306 0 CA-C-N 119.924 1.238 . . . . 1.48 111.265 172.247 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 22.5 t80 -56.85 -49.25 76.04 Favored 'General case' 0 CA--C 1.505 -0.78 0 C-N-CA 119.835 -0.746 . . . . 2.91 109.55 177.432 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 55.3 tt0 -58.76 -28.59 66.05 Favored 'General case' 0 N--CA 1.439 -1.0 0 CA-C-N 114.9 -1.045 . . . . 1.77 110.844 178.721 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 18.4 t80 -67.13 -53.31 31.81 Favored 'General case' 0 N--CA 1.454 -0.231 0 CA-C-N 119.367 0.985 . . . . 1.24 109.615 -178.812 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 2.0 mp -63.99 -30.27 49.56 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.246 0 N-CA-C 108.315 -0.994 . . . . 1.79 108.315 177.284 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -73.73 -25.17 60.06 Favored 'General case' 0 CA--C 1.538 0.509 0 O-C-N 121.735 -0.603 . . . . 2.41 111.196 179.642 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 34.2 t0 . . . . . 0 CA--C 1.507 -0.674 0 N-CA-C 106.335 -1.728 . . . . 2.76 106.335 172.45 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--O 1.227 -0.127 0 CA-C-O 120.958 0.408 . . . . 4.98 110.297 . . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER -63.58 -36.01 74.79 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.488 0 N-CA-C 112.838 0.681 . . . . 1.93 112.838 177.664 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 2.5 t60 -57.23 -57.34 13.04 Favored 'General case' 0 C--N 1.341 0.235 0 N-CA-C 107.115 -1.439 . . . . 0.62 107.115 177.659 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 38.7 mt-10 -59.67 -40.37 87.55 Favored 'General case' 0 N--CA 1.452 -0.362 0 C-N-CA 123.712 0.805 . . . . 2.17 110.479 -178.248 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -53.15 -48.74 67.7 Favored 'General case' 0 CA--C 1.518 -0.26 0 CA-C-N 118.849 0.749 . . . . 4.56 110.319 175.842 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -48.72 -47.09 30.89 Favored Glycine 0 CA--C 1.525 0.7 0 N-CA-C 110.715 -0.954 . . . . 0.61 110.715 174.913 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 2.3 t-160 -65.05 -44.5 88.84 Favored 'General case' 0 C--O 1.224 -0.282 0 O-C-N 122.149 -0.618 . . . . 2.6 111.682 179.493 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -61.72 -32.76 73.0 Favored 'General case' 0 N--CA 1.453 -0.302 0 O-C-N 120.915 -1.116 . . . . 1.98 109.933 -179.385 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 78.8 t -71.91 -36.35 57.59 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.306 0 O-C-N 121.519 -0.738 . . . . 2.5 109.292 176.267 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 8.9 t0 . . . . . 0 N--CA 1.453 -0.288 0 C-N-CA 123.491 0.717 . . . . 2.03 111.401 173.793 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 4.9 t0 . . . . . 0 CA--C 1.53 0.2 0 CA-C-O 121.72 0.771 . . . . 2.39 109.935 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 7.6 mm -48.92 -57.83 1.47 Allowed 'Isoleucine or valine' 0 CA--C 1.531 0.216 0 C-N-CA 125.897 1.679 . . . . 1.56 110.079 179.499 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 21.6 t80 -60.0 -29.76 68.69 Favored 'General case' 0 N--CA 1.451 -0.41 0 C-N-CA 124.038 0.935 . . . . 0.52 111.962 179.82 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -69.14 -45.09 70.98 Favored 'General case' 0 N--CA 1.453 -0.315 0 O-C-N 120.289 -1.507 . . . . 2.09 110.956 -175.597 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 3.9 tp10 -86.84 -60.62 1.93 Allowed 'General case' 0 CA--C 1.532 0.266 0 CA-C-O 122.253 1.025 . . . . 2.48 109.349 -178.088 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 22.1 mm-40 -72.6 -28.79 62.99 Favored 'General case' 0 C--O 1.235 0.313 0 O-C-N 121.519 -0.738 . . . . 2.55 110.358 -171.348 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . 0.411 ' HA2' ' CD1' ' A' ' 66' ' ' PHE . . . -70.89 39.92 0.53 Allowed Glycine 0 CA--C 1.534 1.234 0 C-N-CA 124.838 1.209 . . . . 0.37 113.743 169.829 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 24.3 m -151.82 36.47 0.56 Allowed 'General case' 0 CA--C 1.529 0.161 0 C-N-CA 125.638 1.575 . . . . 2.84 108.746 159.779 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 1.3 m-80 -141.65 -47.25 0.37 Allowed 'General case' 0 CA--C 1.515 -0.381 0 O-C-N 122.052 -0.405 . . . . 2.54 112.074 -172.893 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 23.7 mt -63.81 -34.04 77.03 Favored 'General case' 0 C--N 1.332 -0.156 0 C-N-CA 120.294 -0.562 . . . . 1.61 111.227 -172.201 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER 177.82 169.43 0.7 Allowed 'General case' 0 C--N 1.331 -0.208 0 C-N-CA 124.937 1.295 . . . . 1.76 107.775 -173.575 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 39.4 m -61.56 -36.8 81.66 Favored 'General case' 0 N--CA 1.456 -0.146 0 O-C-N 121.81 -0.556 . . . . 1.34 110.677 168.767 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 4.7 m-85 -67.36 -7.58 25.98 Favored 'General case' 0 N--CA 1.465 0.316 0 CA-C-N 118.359 0.527 . . . . 1.92 112.164 172.87 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -82.59 -8.82 85.59 Favored Glycine 0 N--CA 1.441 -1.024 0 CA-C-O 118.024 -1.431 . . . . 0.53 110.934 173.569 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 4.8 ttt-85 -116.39 -9.15 11.54 Favored 'General case' 0 CA--C 1.529 0.166 0 CA-C-N 119.897 1.849 . . . . 3.9 112.283 -177.3 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 22.3 p -72.35 -136.51 0.01 OUTLIER 'General case' 0 CA--C 1.536 0.437 0 C-N-CA 123.366 0.666 . . . . 2.02 109.376 177.601 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -65.87 146.47 54.7 Favored 'General case' 0 N--CA 1.454 -0.264 0 O-C-N 119.784 -1.822 . . . . 2.16 108.187 178.182 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 61.6 tt0 -55.7 -34.28 64.94 Favored 'General case' 0 CA--C 1.533 0.301 0 CA-C-O 121.651 0.739 . . . . 2.92 110.564 178.21 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -59.44 -36.76 76.53 Favored 'General case' 0 N--CA 1.452 -0.36 0 C-N-CA 123.334 0.654 . . . . 1.49 112.523 176.45 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 9.1 mt-10 -72.27 -43.53 64.16 Favored 'General case' 0 N--CA 1.455 -0.224 0 O-C-N 121.402 -0.811 . . . . 2.45 109.989 177.461 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 66' ' ' PHE . . . . . 0.411 ' CD1' ' HA2' ' A' ' 52' ' ' GLY . 43.6 t80 -50.58 -50.91 52.5 Favored 'General case' 0 N--CA 1.454 -0.257 0 C-N-CA 124.089 0.955 . . . . 0.35 111.086 173.543 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 63.2 t80 -61.56 -46.78 88.43 Favored 'General case' 0 N--CA 1.454 -0.249 0 C-N-CA 123.308 0.643 . . . . 0.65 110.521 178.3 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -59.42 -48.45 81.61 Favored 'General case' 0 CA--C 1.536 0.418 0 O-C-N 121.615 -0.678 . . . . 1.67 111.36 -176.646 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 5.6 mm-40 -58.23 -45.35 87.85 Favored 'General case' 0 CA--C 1.52 -0.191 0 C-N-CA 123.324 0.65 . . . . 4.03 110.406 172.737 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -56.21 -39.66 72.83 Favored 'General case' 0 N--CA 1.453 -0.281 0 CA-C-N 118.927 0.785 . . . . 1.41 109.97 -179.555 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 1.4 t80 -60.58 -48.79 80.22 Favored 'General case' 0 CA--C 1.531 0.246 0 C-N-CA 124.475 1.11 . . . . 3.95 110.716 174.187 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 3.3 tmm_? -51.98 -54.51 28.87 Favored 'General case' 0 CA--C 1.535 0.388 0 C-N-CA 124.669 1.188 . . . . 3.61 110.595 178.042 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -62.77 -33.83 75.99 Favored 'General case' 0 C--N 1.326 -0.431 0 C-N-CA 126.463 1.905 . . . . 1.64 110.665 179.659 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -53.37 -45.94 69.43 Favored 'General case' 0 C--N 1.331 -0.217 0 C-N-CA 123.556 0.742 . . . . 3.3 111.888 -175.671 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 14.8 p80 -96.97 -19.03 19.07 Favored 'General case' 0 C--O 1.225 -0.201 0 CA-C-O 116.341 -1.79 . . . . 2.54 114.481 -179.778 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 10.0 m -18.9 117.42 0.02 OUTLIER 'General case' 0 C--N 1.345 0.376 0 C-N-CA 126.962 2.105 . . . . 2.23 113.237 -176.856 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 1.8 p -45.46 -44.32 12.19 Favored 'General case' 0 N--CA 1.45 -0.467 0 C-N-CA 126.097 1.759 . . . . 2.43 110.06 -178.808 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 59.1 t0 -75.68 107.46 7.86 Favored 'General case' 0 N--CA 1.451 -0.376 0 C-N-CA 118.097 -1.441 . . . . 1.91 109.161 169.182 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 3.4 p-80 -41.31 -36.97 0.89 Allowed 'General case' 0 CA--C 1.531 0.244 0 C-N-CA 124.202 1.001 . . . . 5.72 112.821 170.493 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -58.24 -45.88 86.95 Favored 'General case' 0 N--CA 1.45 -0.468 0 C-N-CA 122.841 0.456 . . . . 1.92 110.985 -178.822 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 9.2 mt-10 -59.49 -35.28 73.83 Favored 'General case' 0 N--CA 1.455 -0.219 0 CA-C-N 118.396 0.544 . . . . 2.52 110.921 -179.532 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 5.6 mtp180 -64.57 -50.52 66.94 Favored 'General case' 0 C--N 1.328 -0.346 0 N-CA-C 108.651 -0.87 . . . . 3.76 108.651 178.575 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 1.4 mm? -62.05 -25.11 67.49 Favored 'General case' 0 N--CA 1.449 -0.485 0 CA-C-O 118.113 -0.946 . . . . 1.73 111.836 174.715 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 21.5 mmtp -68.26 -39.44 82.21 Favored 'General case' 0 CA--C 1.514 -0.416 0 CA-C-N 121.071 1.759 . . . . 4.0 109.221 176.528 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 72.0 t -61.41 -65.97 0.45 Allowed 'Isoleucine or valine' 0 C--O 1.218 -0.57 0 CA-C-O 117.39 -1.29 . . . . 1.89 109.656 168.616 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 2.0 mt-30 -48.03 -45.64 32.31 Favored 'General case' 0 N--CA 1.469 0.494 0 CA-C-N 121.281 1.855 . . . . 2.95 112.531 -173.906 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 11.4 tttt -60.67 -59.58 5.17 Favored 'General case' 0 N--CA 1.45 -0.459 0 C-N-CA 125.111 1.365 . . . . 4.47 110.428 177.812 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 64.8 m-20 -84.85 14.56 4.68 Favored 'General case' 0 CA--C 1.532 0.287 0 CA-C-O 118.791 -0.623 . . . . 1.59 110.951 -175.559 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -170.1 71.45 0.62 Allowed Pre-proline 0 N--CA 1.448 -0.552 0 C-N-CA 126.011 1.725 . . . . 1.23 109.024 -178.473 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 94.2 Cg_endo -81.56 52.51 4.29 Favored 'Trans proline' 0 N--CA 1.459 -0.541 0 C-N-CA 124.001 3.134 . . . . 1.82 110.721 -175.756 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -170.47 -44.81 0.02 OUTLIER 'General case' 0 CA--C 1.534 0.365 0 C-N-CA 126.55 1.94 . . . . 4.0 109.376 174.646 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 5.6 m -52.17 -47.91 65.26 Favored 'General case' 0 N--CA 1.467 0.406 0 CA-C-N 119.082 0.856 . . . . 1.67 111.862 177.951 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 13.0 t80 -57.69 -47.6 81.89 Favored 'General case' 0 CA--C 1.513 -0.462 0 O-C-N 121.684 -0.635 . . . . 2.98 110.643 177.451 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 2.3 tt0 -57.55 -29.01 64.05 Favored 'General case' 0 N--CA 1.443 -0.794 0 CA-C-N 114.874 -1.057 . . . . 1.89 110.6 -178.512 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 1.9 t80 -60.83 -60.81 3.21 Favored 'General case' 0 N--CA 1.456 -0.14 0 C-N-CA 124.558 1.143 . . . . 1.38 110.078 -178.562 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 3.6 mp -58.88 -42.19 85.06 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.227 0 N-CA-C 108.501 -0.926 . . . . 1.86 108.501 178.07 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 1.1 m-20 -56.54 -40.02 74.39 Favored 'General case' 0 CA--C 1.534 0.35 0 CA-C-N 117.812 0.278 . . . . 2.21 111.577 -179.833 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.231 0.099 0 C-N-CA 125.416 1.486 . . . . 2.65 108.796 -178.5 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 17.3 t80 . . . . . 0 N--CA 1.455 -0.187 0 CA-C-O 121.548 0.689 . . . . 4.42 109.779 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 1.7 pt -67.86 -32.19 55.4 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.208 0 O-C-N 121.269 -0.894 . . . . 1.99 112.833 175.624 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER -57.18 -54.36 47.65 Favored 'General case' 0 C--N 1.341 0.206 0 N-CA-C 106.693 -1.595 . . . . 0.71 106.693 175.752 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 33.3 mt-10 -52.2 -47.64 65.48 Favored 'General case' 0 N--CA 1.454 -0.27 0 C-N-CA 125.278 1.431 . . . . 2.6 109.766 -179.555 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -52.8 -50.84 62.8 Favored 'General case' 0 C--O 1.227 -0.107 0 C-N-CA 123.344 0.658 . . . . 4.76 111.558 174.824 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -49.13 -46.17 33.9 Favored Glycine 0 CA--C 1.526 0.732 0 N-CA-C 110.632 -0.987 . . . . 0.49 110.632 176.676 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 2.0 t-160 -62.59 -46.47 88.13 Favored 'General case' 0 N--CA 1.45 -0.45 0 O-C-N 122.061 -0.67 . . . . 2.59 111.028 178.316 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -61.25 -28.97 69.55 Favored 'General case' 0 N--CA 1.455 -0.224 0 C-N-CA 123.376 0.67 . . . . 2.1 110.856 -178.636 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 80.4 t -65.92 -41.26 89.57 Favored 'Isoleucine or valine' 0 C--O 1.234 0.264 0 O-C-N 121.037 -1.039 . . . . 1.95 110.069 176.61 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 N--CA 1.453 -0.302 0 CA-C-N 116.715 -0.221 . . . . 2.47 111.591 178.232 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 26.6 t70 . . . . . 0 N--CA 1.468 0.456 0 CA-C-O 121.073 0.463 . . . . 2.63 112.047 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 8.1 mm -48.34 -53.17 6.67 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.392 0 C-N-CA 126.732 2.013 . . . . 2.02 109.421 175.179 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 32.3 t80 -64.42 -34.24 77.74 Favored 'General case' 0 C--O 1.224 -0.256 0 O-C-N 121.93 -0.481 . . . . 0.53 112.15 176.069 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . 0.41 ' HA ' ' HE2' ' A' ' 49' ' ' LYS . 10.3 mmpt? -63.11 -46.45 87.26 Favored 'General case' 0 N--CA 1.453 -0.288 0 O-C-N 120.94 -1.1 . . . . 2.02 110.784 -176.285 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 1.2 mm-40 -81.07 -67.12 0.81 Allowed 'General case' 0 N--CA 1.451 -0.378 0 CA-C-O 122.379 1.085 . . . . 2.9 109.717 179.012 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . 0.469 ' OE2' ' HE3' ' A' ' 91' ' ' LYS . 45.1 mm-40 -75.98 -22.79 55.51 Favored 'General case' 0 N--CA 1.451 -0.389 0 CA-C-N 115.589 -0.732 . . . . 3.39 110.952 -165.442 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . 0.408 ' HA2' ' CD1' ' A' ' 66' ' ' PHE . . . -71.99 35.45 0.63 Allowed Glycine 0 CA--C 1.531 1.065 0 C-N-CA 123.784 0.707 . . . . 0.43 113.284 168.008 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 30.0 t -152.1 36.27 0.54 Allowed 'General case' 0 N--CA 1.448 -0.551 0 O-C-N 120.899 -1.354 . . . . 2.92 108.269 156.794 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 4.6 t-20 -134.88 -50.52 0.77 Allowed 'General case' 0 CA--C 1.519 -0.217 0 C-N-CA 122.67 0.388 . . . . 2.59 110.837 -168.545 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 16.0 mt -64.21 -35.03 79.46 Favored 'General case' 0 C--N 1.334 -0.091 0 CA-C-O 120.798 0.332 . . . . 1.76 111.266 -174.3 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER 178.2 165.94 0.76 Allowed 'General case' 0 CA--C 1.531 0.238 0 C-N-CA 124.845 1.258 . . . . 1.62 108.067 -174.81 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 9.0 m -59.11 -36.51 75.3 Favored 'General case' 0 N--CA 1.455 -0.204 0 C-N-CA 123.803 0.841 . . . . 1.33 110.881 170.557 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -59.78 -34.05 72.5 Favored 'General case' 0 C--O 1.223 -0.314 0 C-N-CA 123.825 0.85 . . . . 1.62 109.575 172.367 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -63.18 -11.55 39.81 Favored Glycine 0 C--O 1.223 -0.551 0 O-C-N 121.482 -0.761 . . . . 0.56 112.384 176.663 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 3.1 tmt_? -111.7 -3.79 14.9 Favored 'General case' 0 N--CA 1.452 -0.37 0 CA-C-N 118.515 1.158 . . . . 4.05 112.48 -176.857 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 56.3 p -72.27 -137.75 0.01 OUTLIER 'General case' 0 CA--C 1.538 0.481 0 N-CA-C 108.596 -0.89 . . . . 1.9 108.596 175.944 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 98.5 m-20 -69.76 149.84 47.55 Favored 'General case' 0 CA--C 1.528 0.119 0 O-C-N 119.717 -1.864 . . . . 1.93 108.73 178.199 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 45.0 tt0 -58.6 -27.76 64.96 Favored 'General case' 0 CA--C 1.538 0.516 0 CA-C-O 121.682 0.754 . . . . 3.1 111.222 -179.55 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -62.96 -36.61 84.02 Favored 'General case' 0 N--CA 1.452 -0.339 0 C-N-CA 124.163 0.985 . . . . 1.82 112.826 174.562 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 4.2 mt-10 -75.81 -48.47 21.51 Favored 'General case' 0 CA--C 1.511 -0.55 0 O-C-N 121.322 -0.861 . . . . 1.92 109.175 177.766 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 66' ' ' PHE . . . . . 0.408 ' CD1' ' HA2' ' A' ' 52' ' ' GLY . 41.2 t80 -40.23 -51.73 2.68 Favored 'General case' 0 CA--C 1.535 0.403 0 C-N-CA 123.969 0.908 . . . . 0.35 111.694 171.609 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 59.5 t80 -60.98 -42.99 99.42 Favored 'General case' 0 CA--C 1.538 0.483 0 C-N-CA 122.95 0.5 . . . . 0.56 111.828 175.989 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -60.76 -49.33 77.92 Favored 'General case' 0 CA--C 1.538 0.486 0 O-C-N 120.999 -1.063 . . . . 1.45 111.836 -178.993 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 2.9 mp0 -58.28 -40.69 82.57 Favored 'General case' 0 CA--C 1.519 -0.219 0 O-C-N 121.437 -0.789 . . . . 4.51 110.644 171.863 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -56.01 -42.29 76.22 Favored 'General case' 0 N--CA 1.449 -0.485 0 C-N-CA 120.294 -0.563 . . . . 1.82 109.594 177.934 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -60.09 -51.47 69.5 Favored 'General case' 0 CA--C 1.528 0.114 0 CA-C-N 119.187 0.903 . . . . 4.81 112.09 174.88 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 20.9 ttt180 -45.85 -67.46 0.28 Allowed 'General case' 0 N--CA 1.467 0.387 0 CA-C-N 118.555 0.616 . . . . 2.48 109.569 175.489 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -59.12 -35.25 73.13 Favored 'General case' 0 CA--C 1.509 -0.605 0 C-N-CA 125.603 1.561 . . . . 1.85 111.314 -173.054 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 1.8 tmt? -59.06 -38.55 79.64 Favored 'General case' 0 N--CA 1.445 -0.683 0 CA-C-O 119.783 -0.151 . . . . 3.72 111.164 -177.256 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 23.1 p80 -91.13 -35.95 14.27 Favored 'General case' 0 N--CA 1.454 -0.237 0 CA-C-O 116.467 -1.73 . . . . 1.27 111.915 179.353 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 20.4 m -10.36 117.46 0.01 OUTLIER 'General case' 0 C--N 1.344 0.328 0 C-N-CA 128.532 2.733 . . . . 1.64 115.251 -169.359 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 6.9 p -46.66 -44.01 18.12 Favored 'General case' 0 N--CA 1.452 -0.347 0 C-N-CA 125.814 1.645 . . . . 2.07 110.346 176.585 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 10.5 t0 -68.33 102.68 1.44 Allowed 'General case' 0 N--CA 1.448 -0.558 0 CA-C-O 121.669 0.747 . . . . 2.21 109.243 166.04 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 34.4 p-80 -50.23 -35.54 27.22 Favored 'General case' 0 N--CA 1.455 -0.21 0 CA-C-N 115.832 -0.622 . . . . 5.51 111.986 175.145 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -59.47 -48.28 82.24 Favored 'General case' 0 N--CA 1.448 -0.538 0 CA-C-O 118.278 -0.868 . . . . 2.07 110.399 179.757 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 1.4 tt0 -46.69 -42.6 16.78 Favored 'General case' 0 N--CA 1.465 0.298 0 CA-C-N 119.066 0.848 . . . . 3.37 110.161 177.1 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -63.18 -51.88 64.6 Favored 'General case' 0 CA--C 1.516 -0.351 0 N-CA-C 109.504 -0.554 . . . . 4.19 109.504 -179.982 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 1.4 mm? -65.72 -18.38 65.29 Favored 'General case' 0 N--CA 1.45 -0.431 0 CA-C-O 117.628 -1.177 . . . . 1.55 113.059 178.166 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -67.04 -50.58 61.47 Favored 'General case' 0 CA--C 1.519 -0.218 0 CA-C-N 121.387 1.903 . . . . 2.28 107.141 168.092 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 69.0 t -58.03 -43.53 85.25 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.671 0 CA-C-O 117.471 -1.252 . . . . 1.52 112.008 177.79 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 9.9 mt-30 -68.1 -47.79 67.25 Favored 'General case' 0 C--O 1.225 -0.225 0 CA-C-N 122.305 2.321 . . . . 2.31 111.853 177.972 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 72.4 tttt -57.12 -49.18 76.71 Favored 'General case' 0 N--CA 1.449 -0.506 0 O-C-N 121.568 -0.707 . . . . 3.07 110.602 -173.942 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 25.0 m120 -68.83 -48.76 62.73 Favored 'General case' 0 N--CA 1.453 -0.291 0 N-CA-C 109.622 -0.511 . . . . 2.88 109.622 175.738 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -122.81 77.62 48.88 Favored Pre-proline 0 C--O 1.236 0.393 0 C-N-CA 125.652 1.581 . . . . 1.35 111.656 -170.34 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 57.9 Cg_endo -69.78 4.18 2.35 Favored 'Trans proline' 0 CA--C 1.537 0.632 0 C-N-CA 122.907 2.404 . . . . 1.57 113.187 -176.815 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 91' ' ' LYS . . . . . 0.469 ' HE3' ' OE2' ' A' ' 51' ' ' GLU . 0.5 OUTLIER -122.49 -44.14 2.25 Favored 'General case' 0 N--CA 1.45 -0.448 0 C-N-CA 126.26 1.824 . . . . 4.24 110.143 -171.702 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 5.9 m -58.25 -45.52 87.64 Favored 'General case' 0 N--CA 1.464 0.237 0 O-C-N 120.946 -1.097 . . . . 1.51 111.214 175.668 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 10.9 t80 -58.15 -46.08 86.3 Favored 'General case' 0 CA--C 1.511 -0.556 0 CA-C-O 121.771 0.796 . . . . 3.68 110.83 178.136 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 26.8 tt0 -56.09 -34.75 66.31 Favored 'General case' 0 N--CA 1.44 -0.931 0 CA-C-N 114.284 -1.325 . . . . 3.29 109.834 179.851 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 4.0 t80 -62.7 -57.19 11.85 Favored 'General case' 0 N--CA 1.455 -0.207 0 C-N-CA 124.338 1.055 . . . . 1.16 110.305 -178.083 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 37.3 mm -53.91 -44.62 61.7 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.114 0 N-CA-C 109.591 -0.522 . . . . 2.72 109.591 177.368 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 9.3 t30 -62.56 -30.78 71.57 Favored 'General case' 0 CA--C 1.534 0.335 0 N-CA-C 111.957 0.354 . . . . 2.2 111.957 -179.329 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 7.7 t70 . . . . . 0 N--CA 1.462 0.156 0 C-N-CA 124.587 1.155 . . . . 2.46 110.003 175.118 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 C--O 1.227 -0.106 0 CA-C-O 121.055 0.455 . . . . 4.14 110.741 . . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -63.87 -34.33 67.56 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.559 0 N-CA-C 112.747 0.647 . . . . 1.88 112.747 178.891 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 2.1 t-160 -59.79 -54.65 43.82 Favored 'General case' 0 N--CA 1.462 0.128 0 N-CA-C 106.762 -1.57 . . . . 0.62 106.762 176.4 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 41.0 mt-10 -57.28 -39.32 75.45 Favored 'General case' 0 C--O 1.222 -0.349 0 CA-C-O 118.209 -0.901 . . . . 2.46 111.075 179.723 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -51.1 -54.72 22.5 Favored 'General case' 0 CA--C 1.52 -0.203 0 CA-C-N 119.368 0.985 . . . . 4.67 110.45 173.452 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -47.94 -46.26 25.93 Favored Glycine 0 CA--C 1.527 0.792 0 N-CA-C 110.999 -0.84 . . . . 0.48 110.999 176.5 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 2.1 t-160 -63.62 -46.73 84.42 Favored 'General case' 0 N--CA 1.45 -0.462 0 O-C-N 121.98 -0.718 . . . . 2.6 111.794 -179.367 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -59.23 -32.72 70.22 Favored 'General case' 0 N--CA 1.452 -0.342 0 CA-C-N 118.603 0.638 . . . . 1.58 109.352 -179.25 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 45.0 t -68.39 -41.57 83.53 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.267 0 C-N-CA 119.923 -0.711 . . . . 1.82 110.201 177.092 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 2.0 t70 . . . . . 0 C--O 1.23 0.07 0 CA-C-O 121.284 0.564 . . . . 2.16 110.974 173.86 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 6.6 t70 . . . . . 0 N--CA 1.465 0.292 0 N-CA-C 107.374 -1.343 . . . . 2.75 107.374 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 4.3 mm -54.28 -55.79 12.98 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.396 0 C-N-CA 126.038 1.735 . . . . 1.6 109.689 -179.894 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 30.4 t80 -62.28 -26.02 68.17 Favored 'General case' 0 C--O 1.225 -0.219 0 O-C-N 120.498 -1.376 . . . . 0.43 112.181 175.664 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . 0.445 ' HA ' ' HE2' ' A' ' 49' ' ' LYS . 10.9 mmpt? -70.15 -47.21 62.66 Favored 'General case' 0 N--CA 1.45 -0.433 0 O-C-N 120.164 -1.585 . . . . 2.09 110.877 -178.066 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 16.4 tp10 -89.25 -60.61 1.9 Allowed 'General case' 0 C--N 1.332 -0.179 0 CA-C-O 121.519 0.676 . . . . 2.48 109.449 -176.504 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . 0.451 ' OE2' ' HE2' ' A' ' 91' ' ' LYS . 29.3 mp0 -71.32 -26.99 63.08 Favored 'General case' 0 C--O 1.235 0.324 0 O-C-N 121.185 -0.947 . . . . 2.61 110.699 -174.534 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . 0.424 ' HA2' ' CD1' ' A' ' 66' ' ' PHE . . . -72.45 42.59 0.84 Allowed Glycine 0 CA--C 1.53 1.016 0 C-N-CA 124.152 0.882 . . . . 0.36 114.562 171.619 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 28.2 t -151.51 34.24 0.56 Allowed 'General case' 0 N--CA 1.451 -0.409 0 O-C-N 121.109 -1.23 . . . . 2.86 109.087 151.432 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 1.5 m-20 -132.25 -47.68 0.92 Allowed 'General case' 0 CA--C 1.519 -0.237 0 N-CA-C 112.246 0.462 . . . . 2.43 112.246 -172.238 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 25.0 mt -59.42 -36.89 76.72 Favored 'General case' 0 N--CA 1.464 0.26 0 CA-C-O 121.033 0.444 . . . . 1.58 111.411 -172.294 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -177.56 171.76 1.87 Allowed 'General case' 0 C--N 1.33 -0.245 0 N-CA-C 107.126 -1.435 . . . . 1.63 107.126 -175.871 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 31.2 m -63.15 -33.7 76.03 Favored 'General case' 0 CA--C 1.53 0.179 0 O-C-N 121.693 -0.629 . . . . 1.61 110.834 169.101 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 1.8 m-85 -65.63 -19.2 65.82 Favored 'General case' 0 N--CA 1.466 0.361 0 CA-C-N 119.191 0.905 . . . . 1.61 111.502 171.041 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -69.21 -9.81 61.28 Favored Glycine 0 N--CA 1.443 -0.845 0 CA-C-O 118.656 -1.08 . . . . 0.49 111.31 173.607 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 58.3 ttt180 -116.35 -11.5 11.21 Favored 'General case' 0 N--CA 1.454 -0.232 0 CA-C-N 119.211 1.506 . . . . 4.66 112.657 -174.33 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 32.4 p -72.85 -123.61 0.0 OUTLIER 'General case' 0 CA--C 1.533 0.317 0 C-N-CA 123.227 0.611 . . . . 1.85 109.724 -178.378 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 14.3 t30 -76.3 149.19 37.11 Favored 'General case' 0 N--CA 1.451 -0.405 0 O-C-N 120.215 -1.553 . . . . 2.56 107.537 177.219 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -57.12 -33.32 67.24 Favored 'General case' 0 CA--C 1.534 0.336 0 CA-C-O 121.79 0.805 . . . . 2.86 110.321 178.832 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -60.14 -34.81 74.05 Favored 'General case' 0 N--CA 1.45 -0.445 0 O-C-N 121.684 -0.635 . . . . 1.78 112.592 177.656 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 7.0 mt-10 -76.25 -42.29 46.22 Favored 'General case' 0 CA--C 1.516 -0.34 0 O-C-N 121.694 -0.628 . . . . 2.14 110.174 178.491 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 66' ' ' PHE . . . . . 0.424 ' CD1' ' HA2' ' A' ' 52' ' ' GLY . 36.8 t80 -48.94 -53.84 18.01 Favored 'General case' 0 N--CA 1.453 -0.289 0 C-N-CA 123.786 0.834 . . . . 0.39 111.183 171.626 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 72.3 t80 -61.79 -45.92 91.79 Favored 'General case' 0 CA--C 1.534 0.347 0 C-N-CA 123.028 0.531 . . . . 0.59 110.483 -179.988 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -60.54 -48.22 82.74 Favored 'General case' 0 CA--C 1.538 0.517 0 O-C-N 121.378 -0.826 . . . . 1.65 112.186 -177.226 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 5.7 mm-40 -57.47 -41.53 80.79 Favored 'General case' 0 N--CA 1.458 -0.067 0 C-N-CA 123.74 0.816 . . . . 4.15 110.095 172.256 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -57.48 -45.16 85.15 Favored 'General case' 0 N--CA 1.451 -0.401 0 CA-C-O 118.664 -0.684 . . . . 1.44 109.801 -179.92 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 50.1 t80 -55.99 -49.87 72.43 Favored 'General case' 0 N--CA 1.465 0.287 0 CA-C-N 119.167 0.894 . . . . 3.32 112.004 174.607 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 11.6 ttt180 -47.46 -61.35 1.96 Allowed 'General case' 0 CA--C 1.533 0.327 0 N-CA-C 109.107 -0.701 . . . . 2.82 109.107 175.405 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -65.36 -23.37 66.97 Favored 'General case' 0 C--N 1.328 -0.362 0 C-N-CA 124.414 1.086 . . . . 1.47 111.607 -173.411 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -65.05 -40.8 95.28 Favored 'General case' 0 C--N 1.326 -0.425 0 C-N-CA 122.933 0.493 . . . . 3.62 110.719 179.109 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 13.8 p80 -95.41 -18.68 20.53 Favored 'General case' 0 C--O 1.227 -0.083 0 CA-C-O 116.936 -1.506 . . . . 1.13 113.478 -178.603 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 7.6 m -25.67 118.04 0.06 Allowed 'General case' 0 CA--C 1.516 -0.342 0 C-N-CA 126.419 1.888 . . . . 1.64 113.59 -171.603 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 6.2 p -46.08 -44.19 15.3 Favored 'General case' 0 N--CA 1.451 -0.424 0 C-N-CA 125.746 1.619 . . . . 2.09 109.985 177.607 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 13.4 t0 -70.03 103.81 2.38 Favored 'General case' 0 N--CA 1.451 -0.408 0 CA-C-O 122.034 0.921 . . . . 1.92 109.738 166.274 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 1.4 p80 -45.49 -37.32 5.19 Favored 'General case' 0 CA--C 1.531 0.239 0 CA-C-N 115.569 -0.741 . . . . 5.93 112.746 172.017 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -65.22 -42.07 93.82 Favored 'General case' 0 N--CA 1.449 -0.477 0 CA-C-O 118.68 -0.676 . . . . 1.32 110.879 -178.699 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 1.2 tt0 -48.83 -41.41 32.84 Favored 'General case' 0 N--CA 1.463 0.188 0 CA-C-N 118.896 0.771 . . . . 2.99 109.794 174.377 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 14.9 mtp180 -65.01 -52.53 55.55 Favored 'General case' 0 CA--C 1.517 -0.317 0 N-CA-C 109.332 -0.618 . . . . 3.14 109.332 -179.714 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 1.4 mm? -62.5 -21.79 65.77 Favored 'General case' 0 C--O 1.222 -0.345 0 CA-C-O 118.315 -0.85 . . . . 1.81 112.838 177.752 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 30.4 mttt -67.45 -42.91 82.31 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 120.907 1.685 . . . . 2.62 108.424 174.467 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 84.0 t -60.69 -64.9 0.53 Allowed 'Isoleucine or valine' 0 C--O 1.219 -0.503 0 CA-C-O 118.032 -0.985 . . . . 1.83 109.815 170.639 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -48.72 -42.67 35.9 Favored 'General case' 0 CA--C 1.533 0.309 0 CA-C-N 120.309 1.413 . . . . 2.78 112.31 -174.622 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 35.6 tttm -62.52 -49.35 75.69 Favored 'General case' 0 N--CA 1.448 -0.56 0 C-N-CA 123.933 0.893 . . . . 3.01 111.891 178.793 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 70.6 m-80 -84.79 -4.96 59.3 Favored 'General case' 0 CA--C 1.531 0.219 0 CA-C-N 118.332 0.515 . . . . 2.3 111.973 -179.465 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -162.02 62.78 1.44 Allowed Pre-proline 0 N--CA 1.448 -0.539 0 C-N-CA 124.274 1.029 . . . . 1.78 110.005 -166.343 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 30.2 Cg_endo -60.08 -35.07 93.95 Favored 'Trans proline' 0 N--CA 1.454 -0.836 0 C-N-CA 122.516 2.144 . . . . 2.43 110.446 -174.754 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 91' ' ' LYS . . . . . 0.451 ' HE2' ' OE2' ' A' ' 51' ' ' GLU . 0.2 OUTLIER -81.65 -39.55 24.23 Favored 'General case' 0 N--CA 1.451 -0.379 0 C-N-CA 124.813 1.245 . . . . 3.38 112.639 -177.525 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 3.5 m -60.96 -45.99 92.52 Favored 'General case' 0 N--CA 1.464 0.262 0 CA-C-N 120.303 1.411 . . . . 1.51 110.342 179.04 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 5.1 t80 -58.84 -47.96 83.01 Favored 'General case' 0 CA--C 1.51 -0.571 0 CA-C-O 121.068 0.461 . . . . 3.09 110.835 176.835 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 44.9 tt0 -56.22 -31.22 63.3 Favored 'General case' 0 N--CA 1.441 -0.887 0 CA-C-N 115.327 -0.851 . . . . 1.98 110.767 177.841 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 3.6 t80 -61.12 -58.78 6.96 Favored 'General case' 0 N--CA 1.455 -0.205 0 CA-C-N 118.702 0.683 . . . . 1.13 110.417 -176.07 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 3.3 mp -57.15 -41.58 78.1 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.206 0 N-CA-C 108.625 -0.88 . . . . 1.92 108.625 176.237 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 7.7 t-20 -59.65 -35.14 73.82 Favored 'General case' 0 CA--C 1.542 0.662 0 N-CA-C 112.342 0.497 . . . . 3.01 112.342 -177.726 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 21.0 t70 . . . . . 0 CA--C 1.516 -0.356 0 C-N-CA 125.214 1.406 . . . . 2.47 109.66 176.423 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 84.3 t80 . . . . . 0 CA--C 1.517 -0.319 0 N-CA-C 110.197 -0.298 . . . . 4.46 110.197 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -62.99 -33.72 62.26 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.407 0 O-C-N 121.755 -0.59 . . . . 1.95 112.194 -179.906 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 1.9 t60 -58.99 -57.51 12.75 Favored 'General case' 0 C--N 1.342 0.259 0 N-CA-C 107.303 -1.369 . . . . 0.75 107.303 175.954 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 44.0 mt-10 -55.64 -35.44 65.92 Favored 'General case' 0 C--O 1.222 -0.389 0 C-N-CA 124.262 1.025 . . . . 2.56 110.72 -179.805 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 6.2 t80 -58.64 -49.66 76.71 Favored 'General case' 0 N--CA 1.453 -0.292 0 C-N-CA 124.097 0.959 . . . . 4.25 109.8 177.521 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -48.52 -46.93 29.73 Favored Glycine 0 CA--C 1.527 0.837 0 N-CA-C 110.959 -0.856 . . . . 0.47 110.959 171.128 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 1.9 t-160 -62.5 -44.99 95.03 Favored 'General case' 0 N--CA 1.453 -0.299 0 O-C-N 121.516 -0.991 . . . . 2.66 111.742 -179.526 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -62.59 -29.56 70.69 Favored 'General case' 0 N--CA 1.451 -0.377 0 O-C-N 121.483 -0.761 . . . . 1.9 109.806 -179.695 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 90.1 t -66.29 -40.07 85.87 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.147 0 O-C-N 121.36 -0.838 . . . . 1.86 110.697 175.432 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 18.8 t0 . . . . . 0 C--N 1.332 -0.195 0 CA-C-O 121.785 0.802 . . . . 2.0 110.863 173.936 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 6.3 t70 . . . . . 0 N--CA 1.47 0.533 0 CA-C-O 121.775 0.798 . . . . 2.51 110.068 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 4.5 mm -54.8 -50.02 64.4 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.385 0 C-N-CA 124.901 1.28 . . . . 1.5 108.643 -176.418 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 36.1 t80 -66.92 -26.99 67.12 Favored 'General case' 0 N--CA 1.453 -0.314 0 O-C-N 121.617 -0.677 . . . . 0.78 112.724 177.067 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . 0.442 ' HA ' ' HE2' ' A' ' 49' ' ' LYS . 0.2 OUTLIER -68.44 -48.59 64.18 Favored 'General case' 0 N--CA 1.452 -0.367 0 O-C-N 120.591 -1.318 . . . . 2.3 111.047 -175.994 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 7.6 mm-40 -86.77 -62.17 1.57 Allowed 'General case' 0 C--N 1.33 -0.258 0 N-CA-C 109.059 -0.719 . . . . 2.65 109.059 179.155 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 4.2 mm-40 -69.9 -33.58 72.38 Favored 'General case' 0 CA--C 1.535 0.373 0 O-C-N 121.643 -0.661 . . . . 2.05 109.546 -167.719 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -68.92 34.97 0.29 Allowed Glycine 0 CA--C 1.53 0.997 0 C-N-CA 125.926 1.727 . . . . 0.38 114.213 169.041 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 23.0 t -146.9 35.94 0.93 Allowed 'General case' 0 N--CA 1.447 -0.601 0 O-C-N 120.917 -1.343 . . . . 2.7 108.845 157.433 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 1.1 t-20 -141.25 -43.58 0.37 Allowed 'General case' 0 CA--C 1.52 -0.204 0 N-CA-C 112.817 0.673 . . . . 2.62 112.817 -173.985 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 17.0 mt -60.58 -37.04 80.04 Favored 'General case' 0 N--CA 1.461 0.124 0 CA-C-O 120.876 0.369 . . . . 1.71 111.385 -174.56 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER 178.93 168.86 0.93 Allowed 'General case' 0 C--N 1.33 -0.25 0 C-N-CA 125.386 1.474 . . . . 1.54 107.319 -178.21 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 18.7 m -60.43 -36.42 78.13 Favored 'General case' 0 N--CA 1.454 -0.24 0 O-C-N 121.742 -0.599 . . . . 1.66 110.569 168.701 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -67.81 -8.34 35.18 Favored 'General case' 0 N--CA 1.465 0.308 0 C-N-CA 122.806 0.443 . . . . 1.69 112.066 174.209 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -92.47 -0.39 70.03 Favored Glycine 0 N--CA 1.443 -0.846 0 CA-C-O 118.787 -1.007 . . . . 0.52 110.825 175.2 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 1.2 ttt180 -123.11 -2.93 8.57 Favored 'General case' 0 C--O 1.227 -0.087 0 CA-C-N 119.003 1.401 . . . . 2.95 112.175 -178.746 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 12.1 p -68.63 -106.72 0.0 OUTLIER 'General case' 0 N--CA 1.453 -0.275 0 C-N-CA 125.038 1.335 . . . . 1.9 109.644 175.877 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 2.2 t-20 -93.25 151.22 19.94 Favored 'General case' 0 N--CA 1.447 -0.599 0 N-CA-C 108.312 -0.995 . . . . 2.63 108.312 177.071 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 22.7 tt0 -61.23 -29.49 69.86 Favored 'General case' 0 CA--C 1.535 0.401 0 CA-C-N 118.769 0.713 . . . . 3.15 109.974 176.914 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -64.91 -36.43 84.33 Favored 'General case' 0 N--CA 1.452 -0.357 0 N-CA-C 112.797 0.666 . . . . 1.74 112.797 174.959 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 11.3 mt-10 -75.47 -37.75 60.07 Favored 'General case' 0 CA--C 1.511 -0.531 0 O-C-N 121.367 -0.833 . . . . 2.28 110.178 178.473 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 48.8 t80 -53.2 -51.54 61.79 Favored 'General case' 0 N--CA 1.447 -0.607 0 C-N-CA 123.604 0.762 . . . . 0.37 110.472 173.685 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 84.8 t80 -60.59 -46.71 89.22 Favored 'General case' 0 CA--C 1.534 0.35 0 CA-C-O 121.204 0.526 . . . . 0.55 111.121 177.512 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -60.81 -50.96 71.33 Favored 'General case' 0 CA--C 1.541 0.606 0 O-C-N 121.4 -0.813 . . . . 1.54 112.342 -176.553 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 24.8 mm-40 -54.01 -43.71 70.32 Favored 'General case' 0 CA--C 1.52 -0.192 0 C-N-CA 124.425 1.09 . . . . 4.35 110.487 169.6 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -56.36 -42.25 77.49 Favored 'General case' 0 N--CA 1.451 -0.413 0 CA-C-O 118.414 -0.803 . . . . 1.65 109.768 -178.649 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 22.9 t80 -58.09 -52.21 66.51 Favored 'General case' 0 N--CA 1.465 0.323 0 CA-C-N 119.233 0.924 . . . . 4.56 111.578 173.055 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 28.1 ttt180 -46.8 -51.2 16.95 Favored 'General case' 0 CA--C 1.533 0.303 0 C-N-CA 122.738 0.415 . . . . 2.95 110.148 177.584 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -72.51 -30.19 64.27 Favored 'General case' 0 C--N 1.327 -0.377 0 C-N-CA 124.698 1.199 . . . . 1.49 111.035 -176.132 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 4.0 tmm? -62.78 -37.91 88.52 Favored 'General case' 0 C--N 1.33 -0.245 0 C-N-CA 123.784 0.834 . . . . 3.52 111.015 -179.374 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 23.4 p80 -87.57 -47.59 8.59 Favored 'General case' 0 C--O 1.224 -0.278 0 CA-C-O 116.832 -1.556 . . . . 1.18 109.826 179.201 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 5.2 m -0.09 104.75 0.01 OUTLIER 'General case' 0 N--CA 1.47 0.557 0 C-N-CA 128.297 2.639 . . . . 2.06 113.624 -173.454 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 2.1 p -45.7 -41.62 10.71 Favored 'General case' 0 N--CA 1.452 -0.372 0 C-N-CA 125.685 1.594 . . . . 1.86 111.621 -177.086 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 59.4 t0 -69.48 103.5 2.06 Favored 'General case' 0 N--CA 1.455 -0.223 0 C-N-CA 118.589 -1.244 . . . . 2.11 109.129 167.381 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 1.7 p80 -42.03 -36.57 1.16 Allowed 'General case' 0 CA--C 1.53 0.177 0 C-N-CA 124.462 1.105 . . . . 5.68 112.63 172.581 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -58.1 -48.84 78.97 Favored 'General case' 0 N--CA 1.451 -0.38 0 C-N-CA 122.644 0.378 . . . . 1.87 111.011 178.91 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -53.62 -38.55 64.13 Favored 'General case' 0 C--O 1.232 0.181 0 C-N-CA 123.407 0.683 . . . . 3.85 110.964 179.073 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 3.3 mtp-105 -65.4 -51.4 60.65 Favored 'General case' 0 C--N 1.328 -0.334 0 C-N-CA 120.167 -0.613 . . . . 4.25 109.702 178.383 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -60.53 -26.7 67.07 Favored 'General case' 0 N--CA 1.452 -0.344 0 CA-C-O 118.656 -0.688 . . . . 1.56 112.695 177.752 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 37.6 mttt -65.14 -42.39 93.86 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 119.691 1.132 . . . . 2.71 108.489 175.814 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 78.5 t -62.77 -60.34 2.91 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.485 0 CA-C-O 117.4 -1.286 . . . . 1.57 111.612 171.138 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 11.9 mt-30 -49.11 -46.55 45.01 Favored 'General case' 0 N--CA 1.468 0.446 0 CA-C-N 121.19 1.814 . . . . 2.2 111.619 -175.86 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 18.5 tttt -60.25 -52.33 65.73 Favored 'General case' 0 N--CA 1.449 -0.494 0 C-N-CA 123.737 0.815 . . . . 3.16 110.57 178.803 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 19.3 m-20 -84.25 5.38 26.86 Favored 'General case' 0 CA--C 1.533 0.293 0 C-N-CA 123.296 0.638 . . . . 1.41 111.516 -174.629 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -164.47 77.93 1.47 Allowed Pre-proline 0 N--CA 1.448 -0.553 0 C-N-CA 125.324 1.45 . . . . 1.62 108.894 -177.696 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 96.8 Cg_endo -80.65 47.42 2.55 Favored 'Trans proline' 0 CA--C 1.539 0.76 0 C-N-CA 124.211 3.274 . . . . 1.81 111.624 -175.101 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 4.0 ptmt -169.06 -51.14 0.02 OUTLIER 'General case' 0 C--O 1.225 -0.233 0 C-N-CA 126.436 1.894 . . . . 3.26 109.643 -176.889 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 3.2 m -53.19 -45.61 68.66 Favored 'General case' 0 N--CA 1.464 0.231 0 CA-C-N 119.09 0.859 . . . . 1.43 111.817 179.913 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 9.1 t80 -60.2 -47.27 86.69 Favored 'General case' 0 CA--C 1.514 -0.408 0 CA-C-O 121.572 0.701 . . . . 4.0 110.039 178.527 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 2.0 tt0 -57.89 -30.14 65.62 Favored 'General case' 0 N--CA 1.442 -0.834 0 CA-C-N 114.746 -1.115 . . . . 2.37 110.471 179.253 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 3.9 t80 -64.49 -57.41 9.3 Favored 'General case' 0 N--CA 1.455 -0.196 0 C-N-CA 124.715 1.206 . . . . 1.18 109.917 -175.723 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 3.2 mp -58.79 -41.99 84.18 Favored 'Isoleucine or valine' 0 C--O 1.226 -0.136 0 N-CA-C 108.326 -0.99 . . . . 1.81 108.326 176.108 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 7.7 t30 -59.66 -31.34 69.45 Favored 'General case' 0 CA--C 1.536 0.44 0 N-CA-C 111.617 0.228 . . . . 2.09 111.617 -179.496 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 2.4 t0 . . . . . 0 C--N 1.338 0.095 0 C-N-CA 126.132 1.773 . . . . 2.31 108.829 175.672 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 39.8 t80 . . . . . 0 C--O 1.225 -0.197 0 N-CA-C 110.206 -0.294 . . . . 5.2 110.206 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 0.7 OUTLIER -65.72 -31.93 55.92 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.21 0 O-C-N 121.761 -0.587 . . . . 1.67 112.111 -177.778 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 9.1 t60 -60.78 -54.74 41.46 Favored 'General case' 0 CA--C 1.532 0.254 0 N-CA-C 107.388 -1.338 . . . . 0.73 107.388 177.647 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 22.4 mt-10 -53.2 -39.37 63.65 Favored 'General case' 0 C--O 1.222 -0.353 0 C-N-CA 123.773 0.829 . . . . 2.14 110.639 174.977 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 5.1 t80 -58.05 -47.67 82.43 Favored 'General case' 0 CA--C 1.52 -0.182 0 C-N-CA 123.757 0.823 . . . . 4.34 110.259 -178.407 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -49.07 -48.73 31.29 Favored Glycine 0 CA--C 1.524 0.621 0 N-CA-C 110.508 -1.037 . . . . 0.46 110.508 171.068 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 20' ' ' HIS . . . . . 0.406 ' CE1' ' HB3' ' A' ' 64' ' ' ALA . 2.0 t60 -60.69 -45.53 93.84 Favored 'General case' 0 N--CA 1.451 -0.384 0 O-C-N 122.002 -0.705 . . . . 2.61 112.0 -178.4 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -66.32 -27.24 67.76 Favored 'General case' 0 N--CA 1.452 -0.354 0 O-C-N 121.606 -0.684 . . . . 1.61 110.032 -179.599 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 55.8 t -73.44 -37.83 51.7 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.185 0 C-N-CA 119.406 -0.918 . . . . 1.77 110.187 174.586 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 7.0 t0 . . . . . 0 N--CA 1.453 -0.319 0 C-N-CA 122.718 0.407 . . . . 1.89 110.954 174.464 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 10.2 t70 . . . . . 0 N--CA 1.466 0.373 0 CA-C-O 122.031 0.92 . . . . 2.56 110.451 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 2.9 mm -51.42 -48.16 34.55 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.226 0 C-N-CA 126.911 2.084 . . . . 1.64 109.526 176.78 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 20.0 t80 -63.42 -31.92 73.21 Favored 'General case' 0 N--CA 1.45 -0.436 0 O-C-N 121.039 -1.038 . . . . 0.61 112.229 177.917 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . 0.477 ' HA ' ' HE2' ' A' ' 49' ' ' LYS . 10.8 mmpt? -69.97 -45.52 67.18 Favored 'General case' 0 C--N 1.33 -0.265 0 O-C-N 119.662 -1.899 . . . . 2.13 110.543 -177.954 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 7.2 mm-40 -79.95 -65.76 0.96 Allowed 'General case' 0 N--CA 1.452 -0.344 0 CA-C-O 121.901 0.858 . . . . 3.13 109.526 -176.906 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 14.0 mp0 -73.53 -28.32 61.82 Favored 'General case' 0 CA--C 1.533 0.314 0 O-C-N 121.492 -0.755 . . . . 2.65 110.64 -172.33 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . 0.409 ' HA2' ' CD1' ' A' ' 66' ' ' PHE . . . -68.99 33.5 0.29 Allowed Glycine 0 CA--C 1.533 1.158 0 C-N-CA 124.944 1.259 . . . . 0.38 114.498 168.285 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 32.6 t -149.61 44.16 0.93 Allowed 'General case' 0 N--CA 1.447 -0.58 0 O-C-N 120.79 -1.418 . . . . 2.38 107.56 158.84 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -148.48 -42.41 0.16 Allowed 'General case' 0 CA--C 1.516 -0.334 0 N-CA-C 114.003 1.112 . . . . 3.04 114.003 -176.078 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 19.0 mt -61.89 -38.69 89.27 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-O 120.954 0.407 . . . . 1.73 110.778 -176.737 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 1.2 t 178.63 172.76 0.73 Allowed 'General case' 0 CA--C 1.531 0.236 0 C-N-CA 125.41 1.484 . . . . 1.6 107.678 -176.325 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 10.7 m -60.86 -34.66 74.94 Favored 'General case' 0 N--CA 1.453 -0.303 0 O-C-N 121.671 -0.643 . . . . 1.28 110.408 168.45 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 1.6 m-85 -67.5 -10.82 55.25 Favored 'General case' 0 N--CA 1.464 0.242 0 N-CA-C 112.332 0.493 . . . . 2.14 112.332 173.831 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -83.1 -9.37 84.25 Favored Glycine 0 N--CA 1.443 -0.879 0 N-CA-C 110.825 -0.91 . . . . 0.46 110.825 173.775 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 3.4 tmt_? -120.96 -6.39 9.54 Favored 'General case' 0 CA--C 1.526 0.03 0 CA-C-N 118.994 1.397 . . . . 3.21 112.767 -173.81 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 19.5 p -67.56 -145.32 0.01 OUTLIER 'General case' 0 CA--C 1.54 0.575 0 C-N-CA 124.689 1.196 . . . . 1.76 108.947 169.277 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 32.5 m-80 -62.36 148.75 44.27 Favored 'General case' 0 N--CA 1.456 -0.158 0 O-C-N 119.318 -2.114 . . . . 2.95 109.261 178.269 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 58.2 tt0 -60.37 -27.86 67.74 Favored 'General case' 0 CA--C 1.537 0.449 0 CA-C-O 121.819 0.819 . . . . 2.78 111.065 -179.565 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 64' ' ' ALA . . . . . 0.406 ' HB3' ' CE1' ' A' ' 20' ' ' HIS . . . -59.32 -40.92 87.79 Favored 'General case' 0 N--CA 1.452 -0.362 0 C-N-CA 124.643 1.177 . . . . 1.92 112.507 171.564 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 10.4 mt-10 -70.41 -47.09 62.42 Favored 'General case' 0 N--CA 1.446 -0.631 0 CA-C-O 118.211 -0.899 . . . . 2.04 109.828 176.927 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 66' ' ' PHE . . . . . 0.409 ' CD1' ' HA2' ' A' ' 52' ' ' GLY . 48.7 t80 -45.86 -51.92 12.21 Favored 'General case' 0 N--CA 1.454 -0.249 0 C-N-CA 124.042 0.937 . . . . 0.38 111.576 175.23 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 60.1 t80 -65.11 -43.81 90.81 Favored 'General case' 0 CA--C 1.538 0.5 0 O-C-N 121.426 -0.796 . . . . 0.46 110.98 178.27 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -62.73 -53.89 47.47 Favored 'General case' 0 CA--C 1.541 0.611 0 O-C-N 121.023 -1.048 . . . . 1.43 113.156 -176.23 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -57.78 -40.15 79.14 Favored 'General case' 0 C--N 1.332 -0.154 0 O-C-N 120.435 -1.416 . . . . 3.83 110.738 171.388 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -56.76 -39.41 73.95 Favored 'General case' 0 N--CA 1.451 -0.378 0 CA-C-O 118.282 -0.866 . . . . 1.74 110.951 176.899 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 58.6 t80 -57.61 -49.82 75.18 Favored 'General case' 0 N--CA 1.465 0.299 0 CA-C-N 120.195 1.361 . . . . 5.51 111.05 172.375 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 38.0 ttp85 -49.5 -57.7 6.55 Favored 'General case' 0 C--N 1.341 0.218 0 N-CA-C 109.235 -0.654 . . . . 4.38 109.235 178.256 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -64.09 -29.6 70.72 Favored 'General case' 0 N--CA 1.451 -0.409 0 C-N-CA 124.34 1.056 . . . . 1.64 110.834 -174.704 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 1.4 ttp -60.7 -41.44 95.19 Favored 'General case' 0 C--O 1.234 0.271 0 C-N-CA 123.042 0.537 . . . . 3.17 110.116 -179.582 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 5.8 p80 -97.48 -9.79 26.53 Favored 'General case' 0 N--CA 1.454 -0.266 0 CA-C-O 116.238 -1.839 . . . . 1.1 113.97 -177.598 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 8.0 m -36.19 123.78 0.75 Allowed 'General case' 0 CA--C 1.516 -0.363 0 CA-C-N 120.363 1.438 . . . . 1.72 111.505 -169.026 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 2.1 p -48.95 -42.82 38.75 Favored 'General case' 0 N--CA 1.45 -0.467 0 CA-C-N 113.318 -1.765 . . . . 2.07 109.068 -179.791 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 14.9 t0 -70.52 104.19 2.7 Favored 'General case' 0 N--CA 1.445 -0.705 0 CA-C-O 122.439 1.114 . . . . 1.78 109.764 165.879 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 18.1 p-80 -45.39 -38.84 6.29 Favored 'General case' 0 N--CA 1.453 -0.284 0 CA-C-N 115.064 -0.971 . . . . 5.51 112.763 170.909 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -63.35 -44.64 94.26 Favored 'General case' 0 N--CA 1.451 -0.391 0 O-C-N 121.537 -0.727 . . . . 1.51 110.179 -177.82 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 1.8 tt0 -47.61 -43.16 25.54 Favored 'General case' 0 C--O 1.231 0.127 0 C-N-CA 123.948 0.899 . . . . 2.76 110.389 175.185 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 4.5 mtp180 -62.79 -51.0 68.78 Favored 'General case' 0 CA--C 1.516 -0.359 0 N-CA-C 108.774 -0.824 . . . . 3.63 108.774 -179.405 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 1.6 mm? -63.68 -18.62 64.17 Favored 'General case' 0 N--CA 1.455 -0.211 0 CA-C-O 118.194 -0.907 . . . . 1.46 113.355 176.664 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 1.9 mptm? -65.93 -47.46 74.65 Favored 'General case' 0 CA--C 1.521 -0.164 0 CA-C-N 120.856 1.662 . . . . 2.67 107.998 169.234 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 84.8 t -60.58 -59.07 4.74 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.6 0 CA-C-O 118.401 -0.809 . . . . 1.71 110.206 175.19 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -52.69 -48.62 66.42 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 120.075 1.307 . . . . 2.85 111.959 -175.803 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 18.5 pttt -65.19 -41.07 94.91 Favored 'General case' 0 CA--C 1.533 0.32 0 O-C-N 120.931 -1.106 . . . . 3.99 110.676 -177.975 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 37.8 m-20 -74.81 -20.68 59.67 Favored 'General case' 0 CA--C 1.534 0.335 0 C-N-CA 122.712 0.405 . . . . 1.38 111.013 -179.208 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -157.43 67.11 3.88 Favored Pre-proline 0 N--CA 1.45 -0.459 0 C-N-CA 125.932 1.693 . . . . 1.23 108.959 -163.549 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 25.4 Cg_endo -60.33 -28.84 87.6 Favored 'Trans proline' 0 N--CA 1.455 -0.786 0 C-N-CA 122.255 1.97 . . . . 2.56 110.919 -173.486 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -89.31 -43.8 10.69 Favored 'General case' 0 N--CA 1.451 -0.387 0 C-N-CA 126.215 1.806 . . . . 3.19 111.941 -174.561 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 4.9 m -56.86 -44.52 82.26 Favored 'General case' 0 N--CA 1.465 0.28 0 CA-C-N 120.168 1.349 . . . . 1.64 110.909 178.791 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 13.5 t80 -55.39 -49.42 72.39 Favored 'General case' 0 CA--C 1.512 -0.498 0 C-N-CA 120.123 -0.631 . . . . 2.94 110.631 176.008 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 9.8 tt0 -59.22 -30.09 67.98 Favored 'General case' 0 N--CA 1.445 -0.693 0 CA-C-N 115.594 -0.73 . . . . 2.82 110.894 -179.508 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 4.6 t80 -61.46 -57.86 10.47 Favored 'General case' 0 C--O 1.231 0.12 0 C-N-CA 123.781 0.833 . . . . 1.35 109.047 -176.687 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 3.4 mp -58.45 -42.48 84.39 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.254 0 N-CA-C 108.681 -0.859 . . . . 1.87 108.681 175.983 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -57.44 -35.69 70.44 Favored 'General case' 0 CA--C 1.532 0.266 0 CA-C-N 118.445 0.566 . . . . 2.96 111.515 -177.73 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 CA--C 1.532 0.253 0 C-N-CA 123.509 0.724 . . . . 2.09 109.416 179.263 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 N--CA 1.454 -0.271 0 CA-C-O 120.874 0.368 . . . . 4.31 110.312 . . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER -66.91 -31.59 54.14 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.336 0 O-C-N 121.265 -0.897 . . . . 1.69 111.849 -176.933 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 2.5 t-160 -63.32 -57.64 9.74 Favored 'General case' 0 N--CA 1.45 -0.46 0 N-CA-C 106.878 -1.527 . . . . 1.14 106.878 -179.411 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 42.4 mt-10 -57.88 -32.51 67.77 Favored 'General case' 0 N--CA 1.446 -0.641 0 C-N-CA 124.573 1.149 . . . . 2.96 110.552 177.408 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 4.3 t80 -55.95 -49.75 72.67 Favored 'General case' 0 C--N 1.332 -0.161 0 CA-C-N 120.388 1.449 . . . . 4.41 110.02 174.481 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -51.95 -47.11 54.74 Favored Glycine 0 CA--C 1.526 0.749 0 N-CA-C 111.308 -0.717 . . . . 0.76 111.308 173.499 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 2.4 t-160 -65.89 -50.66 63.68 Favored 'General case' 0 N--CA 1.452 -0.348 0 O-C-N 121.608 -0.936 . . . . 2.73 111.69 -174.374 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -57.54 -31.2 65.86 Favored 'General case' 0 N--CA 1.446 -0.647 0 C-N-CA 124.672 1.189 . . . . 1.65 109.624 -179.184 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 71.4 t -67.69 -45.84 83.9 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.238 0 C-N-CA 118.663 -1.215 . . . . 2.06 110.944 173.439 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 2.2 t70 . . . . . 0 C--N 1.329 -0.315 0 CA-C-O 121.136 0.494 . . . . 2.18 111.57 175.217 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 19.7 t70 . . . . . 0 N--CA 1.464 0.26 0 N-CA-C 110.367 -0.235 . . . . 2.14 110.367 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 47' ' ' ILE . . . . . 0.414 ' CG2' ' HG1' ' A' ' 92' ' ' THR . 2.3 mm -45.52 -49.04 4.0 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.546 0 CA-C-O 122.749 1.262 . . . . 1.94 109.671 169.277 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 28.7 t80 -65.76 -28.36 68.97 Favored 'General case' 0 N--CA 1.452 -0.356 0 O-C-N 120.397 -1.439 . . . . 0.53 112.386 -179.754 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -65.04 -55.29 19.78 Favored 'General case' 0 N--CA 1.454 -0.263 0 O-C-N 120.049 -1.657 . . . . 1.89 109.801 174.764 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 6.4 mm-40 -74.0 -70.74 0.37 Allowed 'General case' 0 N--CA 1.451 -0.421 0 N-CA-C 108.687 -0.857 . . . . 2.97 108.687 -173.337 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . 0.535 ' OE2' ' HE2' ' A' ' 91' ' ' LYS . 18.5 mp0 -70.21 -31.36 68.75 Favored 'General case' 0 C--O 1.235 0.32 0 O-C-N 121.544 -0.722 . . . . 2.56 110.693 -171.577 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . 0.441 ' HA2' ' CD1' ' A' ' 66' ' ' PHE . . . -69.92 35.96 0.39 Allowed Glycine 0 CA--C 1.53 1.0 0 C-N-CA 124.59 1.09 . . . . 0.33 114.155 170.341 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 33.2 p -142.39 20.14 2.05 Favored 'General case' 0 N--CA 1.449 -0.517 0 O-C-N 120.81 -1.406 . . . . 2.68 111.535 157.915 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -134.04 -35.16 0.96 Allowed 'General case' 0 C--N 1.342 0.24 0 N-CA-C 112.871 0.693 . . . . 3.97 112.871 -171.629 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 29.4 mt -61.89 -39.18 91.06 Favored 'General case' 0 N--CA 1.465 0.293 0 CA-C-N 119.302 0.955 . . . . 1.66 110.927 -175.817 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 1.2 t 178.2 173.65 0.62 Allowed 'General case' 0 CA--C 1.531 0.233 0 C-N-CA 125.463 1.505 . . . . 1.59 107.564 -179.146 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 14.7 m -58.64 -36.39 74.02 Favored 'General case' 0 N--CA 1.453 -0.306 0 O-C-N 121.712 -0.617 . . . . 1.34 110.819 168.526 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -68.54 -12.43 61.26 Favored 'General case' 0 N--CA 1.467 0.381 0 CA-C-N 118.401 0.546 . . . . 1.6 112.191 175.001 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -86.45 -4.98 82.82 Favored Glycine 0 N--CA 1.444 -0.783 0 CA-C-O 118.596 -1.113 . . . . 0.39 110.927 173.047 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -120.4 1.95 10.74 Favored 'General case' 0 CA--C 1.529 0.169 0 CA-C-N 119.402 1.601 . . . . 4.27 112.129 -178.447 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 14.9 p -76.18 -145.99 0.03 OUTLIER 'General case' 0 CA--C 1.539 0.543 0 N-CA-C 108.605 -0.887 . . . . 1.91 108.605 170.759 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 1.6 m120 -58.16 149.57 23.53 Favored 'General case' 0 C--N 1.34 0.19 0 CA-C-N 120.532 1.515 . . . . 2.37 109.087 177.224 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -58.55 -34.42 71.0 Favored 'General case' 0 CA--C 1.533 0.317 0 CA-C-O 121.739 0.78 . . . . 2.89 110.366 178.479 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -59.31 -34.0 71.78 Favored 'General case' 0 N--CA 1.451 -0.42 0 O-C-N 121.536 -0.728 . . . . 1.71 112.922 175.277 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 12.5 mt-10 -74.19 -42.62 59.54 Favored 'General case' 0 N--CA 1.45 -0.427 0 O-C-N 121.278 -0.889 . . . . 1.85 110.408 174.932 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 66' ' ' PHE . . . . . 0.441 ' CD1' ' HA2' ' A' ' 52' ' ' GLY . 57.9 t80 -49.91 -50.45 46.1 Favored 'General case' 0 N--CA 1.455 -0.206 0 C-N-CA 123.173 0.589 . . . . 0.54 111.115 173.709 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 76.3 t80 -63.42 -42.44 98.72 Favored 'General case' 0 CA--C 1.537 0.448 0 O-C-N 121.589 -0.694 . . . . 0.7 111.28 178.291 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -70.97 -39.55 72.47 Favored 'General case' 0 CA--C 1.535 0.396 0 O-C-N 121.095 -1.003 . . . . 1.77 111.802 -172.616 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -76.71 -31.72 57.37 Favored 'General case' 0 N--CA 1.449 -0.484 0 O-C-N 121.281 -0.887 . . . . 3.27 109.232 179.121 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -55.02 -47.28 74.92 Favored 'General case' 0 C--O 1.222 -0.355 0 O-C-N 121.684 -0.635 . . . . 1.49 109.394 167.944 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -50.47 -47.41 57.03 Favored 'General case' 0 N--CA 1.468 0.442 0 CA-C-N 119.289 0.95 . . . . 4.83 112.212 172.098 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 49.5 ttp85 -53.35 -52.17 60.1 Favored 'General case' 0 CA--C 1.534 0.345 0 CA-C-N 118.71 0.687 . . . . 4.19 109.95 176.659 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 73' ' ' LEU . . . . . 0.405 HD12 ' CG2' ' A' ' 85' ' ' VAL . 0.2 OUTLIER -71.44 -25.36 62.28 Favored 'General case' 0 C--N 1.327 -0.372 0 C-N-CA 123.88 0.872 . . . . 1.72 111.717 -173.888 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 38.9 mmm -62.16 -39.74 93.67 Favored 'General case' 0 C--O 1.234 0.265 0 C-N-CA 124.751 1.22 . . . . 3.81 110.537 178.829 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 8.7 p80 -96.87 -8.56 30.58 Favored 'General case' 0 N--CA 1.455 -0.185 0 CA-C-O 116.24 -1.838 . . . . 1.34 113.151 -177.857 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 3.2 m -33.71 119.74 0.39 Allowed 'General case' 0 C--N 1.344 0.343 0 C-N-CA 124.763 1.225 . . . . 1.88 111.089 -170.476 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 1.3 p -51.02 -42.26 60.32 Favored 'General case' 0 N--CA 1.45 -0.43 0 CA-C-N 113.481 -1.691 . . . . 2.12 108.863 -177.938 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 12.6 t0 -71.4 110.06 5.78 Favored 'General case' 0 N--CA 1.447 -0.613 0 CA-C-O 121.998 0.904 . . . . 1.91 109.344 164.578 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 6.9 p80 -50.41 -37.43 37.76 Favored 'General case' 0 N--CA 1.452 -0.347 0 CA-C-N 115.867 -0.606 . . . . 5.75 111.866 172.719 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -60.17 -47.73 84.69 Favored 'General case' 0 N--CA 1.454 -0.255 0 CA-C-N 118.413 0.551 . . . . 2.03 110.224 -177.327 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 13.6 mt-10 -47.95 -41.29 24.59 Favored 'General case' 0 N--CA 1.453 -0.278 0 C-N-CA 124.057 0.943 . . . . 2.87 111.212 175.748 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 4.2 mtp180 -63.4 -48.16 79.01 Favored 'General case' 0 C--N 1.329 -0.317 0 N-CA-C 108.968 -0.753 . . . . 3.54 108.968 178.623 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 1.5 mm? -62.37 -23.71 66.96 Favored 'General case' 0 N--CA 1.452 -0.334 0 CA-C-O 117.513 -1.232 . . . . 2.0 112.932 175.88 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -63.42 -43.19 98.17 Favored 'General case' 0 N--CA 1.462 0.156 0 CA-C-N 121.678 2.035 . . . . 2.53 108.122 171.407 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 85' ' ' VAL . . . . . 0.405 ' CG2' HD12 ' A' ' 73' ' ' LEU . 86.5 t -62.22 -62.29 1.22 Allowed 'Isoleucine or valine' 0 C--O 1.218 -0.579 0 CA-C-O 117.405 -1.283 . . . . 1.65 110.629 173.696 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 1.9 mt-30 -48.86 -49.78 37.87 Favored 'General case' 0 N--CA 1.464 0.264 0 CA-C-N 120.946 1.703 . . . . 2.54 111.464 -175.628 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 51.9 tttt -55.41 -51.78 65.74 Favored 'General case' 0 N--CA 1.445 -0.707 0 C-N-CA 123.422 0.689 . . . . 2.88 111.138 178.769 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 85.7 m-20 -80.39 -5.79 57.01 Favored 'General case' 0 CA--C 1.531 0.239 0 CA-C-O 119.481 -0.295 . . . . 1.48 111.703 -176.722 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -163.92 68.0 1.57 Allowed Pre-proline 0 N--CA 1.448 -0.545 0 C-N-CA 124.223 1.009 . . . . 1.34 110.418 -167.364 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 59.5 Cg_endo -70.57 0.33 6.41 Favored 'Trans proline' 0 N--CA 1.457 -0.648 0 C-N-CA 123.057 2.504 . . . . 1.7 112.76 -174.629 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 91' ' ' LYS . . . . . 0.535 ' HE2' ' OE2' ' A' ' 51' ' ' GLU . 0.4 OUTLIER -115.81 -41.97 3.15 Favored 'General case' 0 N--CA 1.453 -0.315 0 C-N-CA 125.248 1.419 . . . . 3.84 110.15 -178.812 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 92' ' ' THR . . . . . 0.414 ' HG1' ' CG2' ' A' ' 47' ' ' ILE . 2.5 m -57.6 -44.77 85.66 Favored 'General case' 0 C--O 1.226 -0.14 0 CA-C-N 119.591 1.087 . . . . 1.5 110.74 174.66 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 9.0 t80 -60.64 -48.33 82.28 Favored 'General case' 0 CA--C 1.511 -0.556 0 CA-C-O 121.75 0.786 . . . . 3.06 110.655 179.526 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 30.3 tt0 -54.93 -34.52 63.28 Favored 'General case' 0 N--CA 1.44 -0.936 0 CA-C-N 114.762 -1.108 . . . . 2.18 110.369 177.313 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 5.5 t80 -59.82 -59.65 5.1 Favored 'General case' 0 N--CA 1.454 -0.235 0 C-N-CA 124.363 1.065 . . . . 1.2 110.573 -174.157 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 3.7 mp -60.81 -38.54 79.21 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.231 0 N-CA-C 109.04 -0.726 . . . . 2.18 109.04 176.653 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 4.3 t30 -60.46 -28.67 68.5 Favored 'General case' 0 CA--C 1.533 0.291 0 O-C-N 121.781 -0.575 . . . . 2.0 111.66 -178.965 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.456 -0.146 0 C-N-CA 124.725 1.21 . . . . 2.21 109.076 174.976 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.457 -0.097 0 CA-C-O 121.79 0.805 . . . . 4.73 109.081 . . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER -67.71 -27.69 39.0 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.25 0 O-C-N 121.656 -0.652 . . . . 1.79 111.588 179.316 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 6.6 t60 -60.79 -47.9 84.24 Favored 'General case' 0 CA--C 1.534 0.351 0 N-CA-C 107.369 -1.345 . . . . 0.94 107.369 175.36 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 32.7 mt-10 -59.42 -40.7 87.55 Favored 'General case' 0 CA--C 1.528 0.111 0 O-C-N 121.254 -0.904 . . . . 2.03 111.186 177.439 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 2.4 m-85 -50.73 -47.33 59.31 Favored 'General case' 0 CA--C 1.519 -0.229 0 CA-C-N 118.938 0.79 . . . . 5.01 110.764 173.478 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -48.81 -43.68 30.35 Favored Glycine 0 CA--C 1.533 1.192 0 CA-C-N 118.352 0.524 . . . . 0.83 111.88 176.71 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 58.0 m-70 -62.12 -49.52 75.56 Favored 'General case' 0 C--O 1.226 -0.169 0 O-C-N 121.435 -1.038 . . . . 5.12 111.768 174.481 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -59.17 -27.39 65.64 Favored 'General case' 0 CA--C 1.533 0.319 0 O-C-N 122.043 -0.41 . . . . 1.58 111.214 -178.758 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 71.4 t -68.07 -42.96 85.57 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.19 0 O-C-N 121.029 -1.044 . . . . 2.12 110.477 175.311 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 4.3 m-20 . . . . . 0 N--CA 1.462 0.17 0 N-CA-C 111.747 0.277 . . . . 1.96 111.747 173.489 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 28.8 t0 . . . . . 0 N--CA 1.464 0.249 0 N-CA-C 109.057 -0.719 . . . . 2.29 109.057 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 8.2 mm -52.13 -54.17 15.3 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.413 0 C-N-CA 125.404 1.482 . . . . 1.82 109.5 177.966 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 36.5 t80 -64.0 -24.8 67.85 Favored 'General case' 0 N--CA 1.453 -0.305 0 O-C-N 121.346 -0.847 . . . . 0.61 113.206 178.372 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . 0.459 ' CA ' ' HE2' ' A' ' 49' ' ' LYS . 1.0 OUTLIER -66.77 -53.66 30.78 Favored 'General case' 0 N--CA 1.456 -0.168 0 C-N-CA 118.186 -1.406 . . . . 2.16 109.304 -178.85 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -84.49 -59.78 2.27 Favored 'General case' 0 N--CA 1.451 -0.385 0 N-CA-C 108.734 -0.839 . . . . 2.68 108.734 -172.812 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . 0.475 ' OE2' ' HE2' ' A' ' 91' ' ' LYS . 18.1 mm-40 -71.15 -31.24 67.45 Favored 'General case' 0 C--O 1.235 0.306 0 O-C-N 122.058 -0.401 . . . . 2.31 110.268 -170.44 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . 0.433 ' HA2' ' CD1' ' A' ' 66' ' ' PHE . . . -68.08 40.52 0.26 Allowed Glycine 0 CA--C 1.528 0.864 0 C-N-CA 126.644 2.069 . . . . 0.38 114.464 171.318 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 9.3 p -156.61 34.83 0.31 Allowed 'General case' 0 N--CA 1.449 -0.504 0 O-C-N 120.806 -1.409 . . . . 2.25 109.901 155.725 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 35.9 t-20 -135.6 -46.83 0.68 Allowed 'General case' 0 CA--C 1.521 -0.147 0 O-C-N 122.174 -0.329 . . . . 2.41 111.722 -169.74 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 17.8 mt -55.85 -40.47 72.91 Favored 'General case' 0 CA--C 1.53 0.18 0 CA-C-O 120.825 0.345 . . . . 1.9 111.196 -178.873 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 2.8 t 178.07 173.76 0.6 Allowed 'General case' 0 CA--C 1.533 0.301 0 C-N-CA 125.67 1.588 . . . . 1.63 107.766 -174.483 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 9.6 p -61.75 -36.29 80.59 Favored 'General case' 0 N--CA 1.456 -0.173 0 C-N-CA 123.499 0.72 . . . . 3.21 109.959 170.307 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -62.16 -14.4 36.94 Favored 'General case' 0 CA--C 1.537 0.446 0 N-CA-C 112.332 0.493 . . . . 1.82 112.332 174.342 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -87.12 -13.25 66.52 Favored Glycine 0 N--CA 1.446 -0.693 0 CA-C-O 118.802 -0.999 . . . . 0.39 111.603 177.649 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 71.5 ttt-85 -101.94 -17.7 16.01 Favored 'General case' 0 N--CA 1.461 0.077 0 CA-C-N 119.23 1.515 . . . . 3.06 112.252 176.985 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 1.4 p -60.01 -170.01 0.01 OUTLIER 'General case' 0 CA--C 1.538 0.489 0 C-N-CA 123.064 0.546 . . . . 1.87 110.529 168.736 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 83.6 m-20 -48.89 148.28 2.32 Favored 'General case' 0 N--CA 1.464 0.227 0 O-C-N 121.428 -0.795 . . . . 2.96 110.529 -174.751 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -60.34 -31.23 70.11 Favored 'General case' 0 C--O 1.224 -0.273 0 C-N-CA 120.526 -0.47 . . . . 2.93 110.7 -174.056 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -54.64 -38.35 66.76 Favored 'General case' 0 N--CA 1.453 -0.297 0 N-CA-C 113.013 0.745 . . . . 1.5 113.013 173.675 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 1.6 mt-10 -74.56 -44.79 49.3 Favored 'General case' 0 CA--C 1.505 -0.784 0 CA-C-O 118.622 -0.704 . . . . 2.22 110.148 178.569 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 66' ' ' PHE . . . . . 0.433 ' CD1' ' HA2' ' A' ' 52' ' ' GLY . 49.1 t80 -50.22 -47.33 54.93 Favored 'General case' 0 N--CA 1.45 -0.457 0 O-C-N 123.896 0.748 . . . . 0.37 111.594 174.397 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 76.8 t80 -64.75 -45.01 88.21 Favored 'General case' 0 N--CA 1.452 -0.327 0 O-C-N 121.421 -0.799 . . . . 0.46 110.355 175.605 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -64.83 -54.44 31.0 Favored 'General case' 0 CA--C 1.537 0.456 0 O-C-N 121.446 -0.784 . . . . 1.76 112.619 -172.023 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -55.1 -36.62 65.88 Favored 'General case' 0 N--CA 1.456 -0.126 0 C-N-CA 124.207 1.003 . . . . 3.59 111.071 169.534 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -53.18 -52.12 59.87 Favored 'General case' 0 C--O 1.22 -0.496 0 CA-C-N 118.913 0.779 . . . . 1.72 109.644 170.635 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 4.7 t80 -51.71 -49.81 61.73 Favored 'General case' 0 C--O 1.233 0.209 0 CA-C-N 119.764 1.165 . . . . 3.66 111.682 179.981 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 25.1 ttt180 -46.89 -58.66 3.71 Favored 'General case' 0 CA--C 1.536 0.434 0 CA-C-N 118.005 0.366 . . . . 2.55 110.341 172.389 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -67.31 -33.24 74.85 Favored 'General case' 0 C--N 1.329 -0.293 0 C-N-CA 123.607 0.763 . . . . 1.85 110.565 -170.317 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -61.5 -39.74 92.08 Favored 'General case' 0 CA--C 1.52 -0.199 0 C-N-CA 124.853 1.261 . . . . 7.51 109.939 -178.865 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 14.1 p80 -88.45 -33.29 17.9 Favored 'General case' 0 N--CA 1.453 -0.294 0 CA-C-O 116.702 -1.618 . . . . 1.09 110.991 -177.458 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 17.5 m -14.45 116.62 0.02 OUTLIER 'General case' 0 C--N 1.345 0.403 0 C-N-CA 128.561 2.744 . . . . 2.32 113.537 -167.204 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 7.7 p -45.29 -44.37 11.38 Favored 'General case' 0 N--CA 1.452 -0.365 0 C-N-CA 126.172 1.789 . . . . 2.32 110.017 -179.657 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 11.0 t0 -70.68 108.2 4.29 Favored 'General case' 0 N--CA 1.447 -0.624 0 CA-C-O 121.822 0.82 . . . . 2.03 109.614 168.054 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 57.8 m80 -52.27 -32.68 38.35 Favored 'General case' 0 N--CA 1.456 -0.155 0 CA-C-N 115.936 -0.574 . . . . 7.32 111.519 174.676 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -61.64 -51.19 69.49 Favored 'General case' 0 N--CA 1.449 -0.478 0 CA-C-O 118.325 -0.845 . . . . 1.62 110.37 177.935 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 1.9 mt-10 -47.26 -40.92 17.63 Favored 'General case' 0 N--CA 1.464 0.264 0 CA-C-N 119.331 0.969 . . . . 3.03 110.419 178.049 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -62.91 -52.57 62.53 Favored 'General case' 0 CA--C 1.515 -0.386 0 C-N-CA 120.108 -0.637 . . . . 4.25 110.145 178.581 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -61.98 -24.59 67.11 Favored 'General case' 0 N--CA 1.453 -0.319 0 CA-C-O 117.49 -1.243 . . . . 1.83 112.677 177.491 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 1.1 mptm? -61.29 -42.46 98.69 Favored 'General case' 0 C--O 1.225 -0.232 0 CA-C-N 121.166 1.803 . . . . 1.88 107.567 172.517 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 93.0 t -69.26 -55.36 15.62 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.473 0 CA-C-O 118.21 -0.9 . . . . 1.86 112.308 176.19 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -50.8 -41.38 57.16 Favored 'General case' 0 CA--C 1.531 0.243 0 CA-C-N 120.676 1.58 . . . . 2.86 111.237 -178.013 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 34.9 tttt -62.88 -60.62 3.22 Favored 'General case' 0 N--CA 1.448 -0.54 0 C-N-CA 124.747 1.219 . . . . 2.64 110.919 175.67 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 3.0 m120 -76.7 0.34 20.78 Favored 'General case' 0 CA--C 1.53 0.187 0 C-N-CA 123.539 0.735 . . . . 1.82 112.075 -174.069 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -158.33 68.58 3.68 Favored Pre-proline 0 N--CA 1.448 -0.53 0 C-N-CA 124.443 1.097 . . . . 1.36 108.7 -171.434 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 89.2 Cg_endo -80.3 56.64 6.15 Favored 'Trans proline' 0 CA--C 1.536 0.58 0 C-N-CA 124.378 3.386 . . . . 2.0 110.568 -173.3 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 91' ' ' LYS . . . . . 0.475 ' HE2' ' OE2' ' A' ' 51' ' ' GLU . 0.0 OUTLIER 176.18 -53.76 0.01 OUTLIER 'General case' 0 C--O 1.227 -0.127 0 C-N-CA 126.681 1.992 . . . . 3.43 109.669 -168.626 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 2.7 m -55.19 -46.51 75.84 Favored 'General case' 0 CA--C 1.518 -0.272 0 CA-C-N 118.855 0.752 . . . . 1.68 110.486 179.138 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 3.0 t80 -57.76 -49.02 77.97 Favored 'General case' 0 CA--C 1.506 -0.72 0 N-CA-C 109.677 -0.49 . . . . 3.73 109.677 178.246 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 3.8 tt0 -53.92 -33.78 57.67 Favored 'General case' 0 N--CA 1.443 -0.789 0 O-C-N 124.072 0.857 . . . . 2.77 110.694 -177.631 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 4.6 t80 -60.56 -56.25 23.56 Favored 'General case' 0 CA--C 1.529 0.173 0 C-N-CA 123.355 0.662 . . . . 1.12 109.945 -175.865 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 2.3 mp -61.67 -41.28 89.79 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.293 0 N-CA-C 108.853 -0.795 . . . . 2.14 108.853 176.817 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 11.7 t30 -58.7 -36.34 74.08 Favored 'General case' 0 CA--C 1.533 0.304 0 C-N-CA 123.143 0.577 . . . . 2.38 110.953 -175.896 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 CA--C 1.529 0.171 0 C-N-CA 126.588 1.955 . . . . 2.73 109.128 175.865 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 CA--C 1.528 0.124 0 CA-C-O 121.42 0.629 . . . . 4.92 110.82 . . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 1.1 pt -70.67 -27.14 29.85 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.283 0 O-C-N 121.613 -0.679 . . . . 2.11 112.479 -178.322 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 1.1 t-160 -58.31 -57.76 11.48 Favored 'General case' 0 CA--C 1.529 0.163 0 N-CA-C 105.894 -1.891 . . . . 0.77 105.894 174.015 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 43.5 mt-10 -55.4 -43.35 75.14 Favored 'General case' 0 N--CA 1.456 -0.158 0 C-N-CA 123.967 0.907 . . . . 2.47 110.663 -178.859 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 16.1 t80 -53.53 -51.49 62.67 Favored 'General case' 0 N--CA 1.455 -0.176 0 C-N-CA 123.493 0.717 . . . . 3.35 110.533 177.273 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -48.64 -43.56 29.02 Favored Glycine 0 CA--C 1.525 0.676 0 N-CA-C 111.347 -0.701 . . . . 0.75 111.347 174.889 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 2.3 t-160 -61.18 -48.94 79.22 Favored 'General case' 0 N--CA 1.45 -0.466 0 O-C-N 121.967 -0.726 . . . . 2.58 111.047 178.299 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -58.63 -32.41 69.01 Favored 'General case' 0 N--CA 1.454 -0.232 0 CA-C-N 118.279 0.49 . . . . 2.15 110.346 177.802 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 41.4 t -67.6 -33.83 64.46 Favored 'Isoleucine or valine' 0 N--CA 1.46 0.059 0 O-C-N 121.256 -0.902 . . . . 2.13 111.537 179.13 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 12.1 t0 . . . . . 0 CA--C 1.533 0.295 0 CA-C-O 122.082 0.944 . . . . 1.96 110.688 174.309 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 19.8 t70 . . . . . 0 N--CA 1.465 0.319 0 CA-C-O 120.72 0.295 . . . . 2.11 110.784 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 47' ' ' ILE . . . . . 0.435 ' CG2' ' HG1' ' A' ' 92' ' ' THR . 5.9 mm -56.53 -46.49 82.45 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.315 0 CA-C-O 122.943 1.354 . . . . 1.88 109.102 175.873 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 24.7 t80 -63.62 -23.14 67.26 Favored 'General case' 0 N--CA 1.451 -0.401 0 O-C-N 120.561 -1.337 . . . . 0.64 112.187 177.085 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . 0.436 ' HA ' ' CE ' ' A' ' 49' ' ' LYS . 0.9 OUTLIER -71.85 -48.96 42.38 Favored 'General case' 0 N--CA 1.448 -0.549 0 O-C-N 120.053 -1.655 . . . . 2.35 110.343 -179.653 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 21.8 tp10 -90.31 -55.82 3.45 Favored 'General case' 0 C--N 1.331 -0.208 0 O-C-N 123.541 0.526 . . . . 2.48 109.619 -173.04 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 33.0 mp0 -75.67 -28.43 58.7 Favored 'General case' 0 C--O 1.236 0.359 0 O-C-N 121.25 -0.906 . . . . 2.6 110.904 -176.261 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . 0.46 ' HA2' ' CD1' ' A' ' 66' ' ' PHE . . . -70.92 45.72 0.71 Allowed Glycine 0 CA--C 1.531 1.055 0 C-N-CA 125.805 1.669 . . . . 0.38 114.843 169.935 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 46.8 t -162.66 46.13 0.14 Allowed 'General case' 0 N--CA 1.449 -0.476 0 N-CA-C 107.182 -1.414 . . . . 2.82 107.182 157.636 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 4.8 t-20 -147.45 -50.85 0.19 Allowed 'General case' 0 CA--C 1.519 -0.243 0 N-CA-C 111.746 0.276 . . . . 2.33 111.746 -170.116 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 28.0 mt -59.97 -37.07 78.55 Favored 'General case' 0 N--CA 1.462 0.14 0 CA-C-O 120.885 0.374 . . . . 1.61 111.048 -176.907 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -178.0 170.52 1.85 Allowed 'General case' 0 C--N 1.33 -0.277 0 N-CA-C 107.81 -1.181 . . . . 1.54 107.81 -175.982 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 11.6 t -63.02 -35.23 79.52 Favored 'General case' 0 CA--C 1.533 0.312 0 C-N-CA 123.195 0.598 . . . . 2.18 109.713 170.184 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -67.1 -9.52 40.43 Favored 'General case' 0 N--CA 1.466 0.342 0 O-C-N 121.737 -0.602 . . . . 1.67 112.237 172.811 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -85.58 -5.08 84.94 Favored Glycine 0 C--O 1.22 -0.745 0 CA-C-O 118.797 -1.002 . . . . 0.57 111.287 173.195 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -114.11 -16.66 12.07 Favored 'General case' 0 C--N 1.334 -0.07 0 CA-C-N 119.291 1.546 . . . . 3.74 112.239 -175.583 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 24.1 p -64.45 -149.72 0.01 OUTLIER 'General case' 0 CA--C 1.54 0.565 0 C-N-CA 125.629 1.571 . . . . 1.85 109.881 176.299 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 15.9 m120 -58.3 143.8 43.48 Favored 'General case' 0 N--CA 1.455 -0.184 0 O-C-N 119.298 -2.126 . . . . 2.96 109.212 177.307 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 66.3 tt0 -56.55 -29.03 61.5 Favored 'General case' 0 CA--C 1.534 0.335 0 CA-C-O 121.785 0.802 . . . . 3.11 111.466 -178.52 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -60.23 -39.82 88.03 Favored 'General case' 0 N--CA 1.449 -0.49 0 C-N-CA 123.349 0.659 . . . . 2.09 112.224 175.126 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 9.6 mt-10 -70.91 -42.0 70.52 Favored 'General case' 0 N--CA 1.451 -0.384 0 O-C-N 121.365 -0.834 . . . . 2.37 110.757 176.443 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 66' ' ' PHE . . . . . 0.46 ' CD1' ' HA2' ' A' ' 52' ' ' GLY . 49.8 t80 -49.98 -52.5 33.32 Favored 'General case' 0 N--CA 1.454 -0.23 0 C-N-CA 122.858 0.463 . . . . 0.58 110.861 174.753 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 75.9 t80 -60.92 -41.81 96.88 Favored 'General case' 0 CA--C 1.534 0.346 0 C-N-CA 122.508 0.323 . . . . 0.86 110.827 177.716 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -63.95 -45.67 88.14 Favored 'General case' 0 CA--C 1.54 0.577 0 O-C-N 121.209 -0.932 . . . . 1.84 111.838 -176.109 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 18.8 mm-40 -58.42 -43.9 88.84 Favored 'General case' 0 CA--C 1.521 -0.143 0 C-N-CA 124.447 1.099 . . . . 4.28 110.187 171.38 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -52.07 -54.5 29.54 Favored 'General case' 0 N--CA 1.454 -0.257 0 N-CA-C 108.359 -0.978 . . . . 1.65 108.359 178.021 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 39.4 t80 -50.45 -51.13 49.58 Favored 'General case' 0 N--CA 1.456 -0.173 0 C-N-CA 123.551 0.74 . . . . 3.19 111.986 179.616 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 13.6 ttt180 -47.55 -57.93 4.84 Favored 'General case' 0 CA--C 1.534 0.354 0 CA-C-N 118.62 0.646 . . . . 2.71 110.094 176.154 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -67.4 -24.47 65.67 Favored 'General case' 0 C--O 1.222 -0.355 0 C-N-CA 125.132 1.373 . . . . 1.95 110.984 -172.505 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 33.4 mmt -57.0 -45.72 82.8 Favored 'General case' 0 N--CA 1.468 0.437 0 CA-C-N 119.041 0.837 . . . . 6.64 111.486 178.409 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 6.6 p80 -95.94 -29.36 14.21 Favored 'General case' 0 C--N 1.334 -0.102 0 CA-C-O 116.388 -1.768 . . . . 3.38 113.556 -175.589 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 81.3 p -13.18 117.08 0.02 OUTLIER 'General case' 0 C--N 1.344 0.337 0 C-N-CA 127.87 2.468 . . . . 3.16 113.672 -173.047 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 1.9 p -44.93 -42.39 8.07 Favored 'General case' 0 C--N 1.33 -0.276 0 C-N-CA 125.173 1.389 . . . . 2.06 110.87 176.994 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 11.1 t0 -66.98 103.03 1.06 Allowed 'General case' 0 N--CA 1.452 -0.374 0 N-CA-C 108.857 -0.794 . . . . 2.32 108.857 166.206 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 4.6 t-80 -59.87 -23.05 63.11 Favored 'General case' 0 CA--C 1.531 0.237 0 O-C-N 121.522 -0.736 . . . . 7.27 111.679 179.896 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -66.09 -46.17 78.63 Favored 'General case' 0 N--CA 1.451 -0.41 0 CA-C-O 118.525 -0.75 . . . . 1.55 110.918 176.493 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 1.1 mt-10 -47.77 -38.85 16.46 Favored 'General case' 0 N--CA 1.465 0.306 0 CA-C-N 119.025 0.829 . . . . 3.25 109.908 177.655 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 11.3 mtp180 -62.19 -54.54 39.52 Favored 'General case' 0 CA--C 1.517 -0.32 0 N-CA-C 108.822 -0.807 . . . . 3.56 108.822 -178.439 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 1.5 mm? -65.36 -19.08 65.79 Favored 'General case' 0 N--CA 1.451 -0.409 0 CA-C-O 118.095 -0.955 . . . . 1.61 112.726 178.2 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 24.3 mttt -68.73 -43.6 75.59 Favored 'General case' 0 CA--C 1.517 -0.302 0 CA-C-N 120.885 1.675 . . . . 2.42 108.317 172.351 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 92.8 t -61.23 -62.34 1.16 Allowed 'Isoleucine or valine' 0 C--O 1.217 -0.633 0 CA-C-O 118.413 -0.803 . . . . 1.69 109.893 171.584 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -50.09 -46.13 53.27 Favored 'General case' 0 C--O 1.224 -0.249 0 CA-C-N 120.213 1.37 . . . . 2.88 112.082 -175.084 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 41.7 tttt -58.91 -53.37 59.18 Favored 'General case' 0 N--CA 1.448 -0.529 0 O-C-N 121.459 -0.776 . . . . 2.88 110.879 177.299 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 64.4 m-20 -79.82 -7.15 58.52 Favored 'General case' 0 C--N 1.33 -0.258 0 C-N-CA 122.386 0.274 . . . . 1.4 111.486 -174.449 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -164.88 62.94 0.96 Allowed Pre-proline 0 N--CA 1.447 -0.576 0 C-N-CA 124.558 1.143 . . . . 1.87 109.624 -163.709 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 20.8 Cg_endo -57.6 -41.13 74.4 Favored 'Trans proline' 0 N--CA 1.454 -0.813 0 C-N-CA 122.54 2.16 . . . . 2.58 109.884 -173.123 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 1.2 ptpt -74.29 -43.13 58.11 Favored 'General case' 0 N--CA 1.453 -0.325 0 C-N-CA 126.584 1.954 . . . . 3.19 113.222 -178.789 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 92' ' ' THR . . . . . 0.435 ' HG1' ' CG2' ' A' ' 47' ' ' ILE . 3.7 m -59.04 -45.74 89.99 Favored 'General case' 0 CA--C 1.517 -0.296 0 CA-C-N 119.924 1.238 . . . . 1.75 110.048 179.967 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 2.5 t80 -59.27 -46.39 88.65 Favored 'General case' 0 CA--C 1.512 -0.502 0 C-N-CA 120.123 -0.631 . . . . 3.03 110.162 175.577 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 2.8 tt0 -52.36 -32.72 39.75 Favored 'General case' 0 N--CA 1.448 -0.552 0 CA-C-N 115.532 -0.758 . . . . 1.99 111.066 179.942 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 2.3 t80 -58.15 -62.56 1.74 Allowed 'General case' 0 N--CA 1.456 -0.166 0 C-N-CA 124.091 0.956 . . . . 1.47 110.191 -178.269 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 3.5 mp -63.05 -36.08 74.35 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.286 0 N-CA-C 109.218 -0.66 . . . . 2.0 109.218 -179.762 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 7.3 t-20 -57.96 -39.0 77.05 Favored 'General case' 0 CA--C 1.536 0.426 0 CA-C-N 117.953 0.342 . . . . 3.14 110.743 -179.486 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 6.9 t0 . . . . . 0 N--CA 1.463 0.197 0 C-N-CA 125.225 1.41 . . . . 2.19 110.141 177.327 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 2.9 t80 . . . . . 0 N--CA 1.454 -0.273 0 CA-C-O 121.078 0.466 . . . . 4.03 110.699 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 0.7 OUTLIER -67.26 -36.31 76.36 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.499 0 O-C-N 121.229 -0.919 . . . . 1.81 112.184 -178.859 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 3.0 t60 -57.34 -53.7 55.1 Favored 'General case' 0 CA--C 1.531 0.213 0 N-CA-C 107.228 -1.397 . . . . 1.05 107.228 176.383 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 45.8 mt-10 -64.99 -32.21 73.82 Favored 'General case' 0 N--CA 1.449 -0.487 0 C-N-CA 125.105 1.362 . . . . 2.36 111.131 -175.333 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 1.1 m-85 -54.39 -53.84 48.66 Favored 'General case' 0 CA--C 1.517 -0.318 0 CA-C-N 119.56 1.073 . . . . 4.42 110.129 167.762 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -49.76 -47.91 37.65 Favored Glycine 0 CA--C 1.526 0.742 0 N-CA-C 110.825 -0.91 . . . . 0.72 110.825 176.857 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 2.5 t60 -62.28 -43.7 98.21 Favored 'General case' 0 N--CA 1.447 -0.592 0 O-C-N 122.058 -0.672 . . . . 2.77 112.017 -178.661 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -61.84 -32.28 72.6 Favored 'General case' 0 N--CA 1.451 -0.394 0 N-CA-C 109.224 -0.658 . . . . 1.86 109.224 -178.863 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 84.8 t -71.46 -40.83 72.75 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.164 0 C-N-CA 119.314 -0.954 . . . . 2.04 111.086 176.967 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 15.1 t0 . . . . . 0 C--N 1.328 -0.338 0 CA-C-O 121.807 0.813 . . . . 1.97 110.981 172.182 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 30.3 t70 . . . . . 0 N--CA 1.465 0.289 0 CA-C-O 122.057 0.932 . . . . 2.38 110.232 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 3.4 mm -52.06 -51.2 31.62 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.19 0 C-N-CA 124.739 1.216 . . . . 1.78 109.932 175.948 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 25.7 t80 -61.29 -32.74 72.58 Favored 'General case' 0 C--O 1.224 -0.268 0 O-C-N 121.781 -0.575 . . . . 1.03 111.895 175.88 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . 0.444 ' HA ' ' HE2' ' A' ' 49' ' ' LYS . 7.6 mmpt? -67.74 -44.05 78.48 Favored 'General case' 0 N--CA 1.451 -0.403 0 O-C-N 120.544 -1.347 . . . . 2.47 110.728 -176.668 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 18.5 mm-40 -82.31 -64.67 1.13 Allowed 'General case' 0 CA--C 1.532 0.274 0 CA-C-O 122.294 1.045 . . . . 3.35 109.749 -179.738 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 21.1 mm-40 -74.18 -28.28 61.21 Favored 'General case' 0 C--O 1.235 0.338 0 C-N-CA 123.281 0.632 . . . . 2.22 110.829 -169.084 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . 0.42 ' HA2' ' CD1' ' A' ' 66' ' ' PHE . . . -71.46 38.21 0.58 Allowed Glycine 0 CA--C 1.533 1.165 0 C-N-CA 124.295 0.95 . . . . 0.41 113.287 170.184 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -148.61 33.16 0.78 Allowed 'General case' 0 N--CA 1.451 -0.414 0 C-N-CA 124.518 1.127 . . . . 2.96 108.75 163.195 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 11.3 t-20 -144.37 -43.27 0.25 Allowed 'General case' 0 C--N 1.339 0.14 0 N-CA-C 112.331 0.493 . . . . 2.44 112.331 -169.402 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 18.6 mt -62.64 -36.5 83.0 Favored 'General case' 0 N--CA 1.462 0.133 0 O-C-N 121.753 -0.592 . . . . 1.61 111.239 -176.347 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER 175.06 169.84 0.29 Allowed 'General case' 0 CA--C 1.531 0.23 0 C-N-CA 125.989 1.716 . . . . 1.61 107.48 -177.338 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 14.5 m -61.13 -36.46 79.81 Favored 'General case' 0 N--CA 1.455 -0.2 0 C-N-CA 123.092 0.557 . . . . 1.41 110.557 169.497 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 1.6 m-85 -68.08 -9.23 44.57 Favored 'General case' 0 N--CA 1.466 0.34 0 O-C-N 121.927 -0.483 . . . . 3.07 112.182 173.473 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -90.25 2.41 81.15 Favored Glycine 0 N--CA 1.443 -0.845 0 CA-C-O 118.828 -0.985 . . . . 0.47 111.06 173.54 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 3.2 tmt_? -125.91 -13.79 6.26 Favored 'General case' 0 C--O 1.226 -0.136 0 CA-C-N 119.157 1.479 . . . . 3.15 112.925 -176.888 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 3.6 p -59.67 -104.09 0.0 OUTLIER 'General case' 0 C--N 1.333 -0.148 0 C-N-CA 126.656 1.982 . . . . 1.88 110.583 177.175 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 4.5 t30 -93.53 152.23 19.19 Favored 'General case' 0 N--CA 1.45 -0.462 0 N-CA-C 107.681 -1.229 . . . . 2.64 107.681 175.594 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 1.6 tm-20 -58.58 -35.72 72.85 Favored 'General case' 0 CA--C 1.532 0.271 0 CA-C-O 121.422 0.629 . . . . 3.48 109.737 176.205 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -61.43 -31.64 71.58 Favored 'General case' 0 N--CA 1.453 -0.298 0 N-CA-C 113.785 1.032 . . . . 1.71 113.785 176.315 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 10.0 mt-10 -76.47 -41.16 48.19 Favored 'General case' 0 CA--C 1.513 -0.446 0 O-C-N 121.546 -0.721 . . . . 2.25 109.534 176.548 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 66' ' ' PHE . . . . . 0.42 ' CD1' ' HA2' ' A' ' 52' ' ' GLY . 49.4 t80 -53.34 -51.63 61.82 Favored 'General case' 0 N--CA 1.451 -0.394 0 C-N-CA 123.027 0.531 . . . . 0.45 111.251 173.804 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 71.2 t80 -64.94 -49.8 68.95 Favored 'General case' 0 N--CA 1.45 -0.468 0 C-N-CA 122.768 0.427 . . . . 0.55 110.425 -178.283 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -60.11 -47.52 85.54 Favored 'General case' 0 CA--C 1.54 0.581 0 O-C-N 121.607 -0.683 . . . . 1.79 112.274 -177.347 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 6.2 mm-40 -59.68 -41.54 90.9 Favored 'General case' 0 C--N 1.332 -0.167 0 C-N-CA 124.425 1.09 . . . . 4.43 110.468 172.823 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -58.28 -41.84 85.23 Favored 'General case' 0 N--CA 1.453 -0.301 0 O-C-N 121.413 -0.804 . . . . 1.48 109.373 179.67 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -54.59 -52.37 62.35 Favored 'General case' 0 C--O 1.232 0.149 0 C-N-CA 124.678 1.191 . . . . 4.47 111.488 172.016 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 7.6 ttt180 -48.58 -61.35 2.07 Favored 'General case' 0 CA--C 1.529 0.173 0 N-CA-C 109.432 -0.581 . . . . 3.25 109.432 177.151 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -61.06 -28.04 68.78 Favored 'General case' 0 C--N 1.327 -0.411 0 C-N-CA 125.127 1.371 . . . . 1.54 111.233 -176.18 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER -62.64 -40.71 97.87 Favored 'General case' 0 C--O 1.234 0.255 0 CA-C-N 118.745 0.702 . . . . 3.24 110.744 -179.273 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 15.4 p80 -95.96 -20.48 18.7 Favored 'General case' 0 C--O 1.228 -0.067 0 CA-C-O 116.628 -1.653 . . . . 1.22 113.259 -179.109 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 33.2 m -31.92 115.22 0.16 Allowed 'General case' 0 C--O 1.221 -0.425 0 C-N-CA 125.776 1.63 . . . . 1.79 111.823 -172.085 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 1.2 p -45.83 -39.58 8.66 Favored 'General case' 0 C--N 1.329 -0.291 0 C-N-CA 125.908 1.683 . . . . 1.99 110.994 -177.367 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 12.6 t0 -63.48 104.87 0.68 Allowed 'General case' 0 N--CA 1.449 -0.514 0 CA-C-O 121.912 0.863 . . . . 2.48 109.872 167.402 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 9.1 m-70 -52.07 -33.87 41.06 Favored 'General case' 0 N--CA 1.457 -0.118 0 CA-C-O 118.596 -0.716 . . . . 6.11 111.613 175.438 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -59.06 -54.11 50.72 Favored 'General case' 0 N--CA 1.448 -0.534 0 CA-C-O 118.04 -0.981 . . . . 2.16 109.957 178.988 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 4.4 mt-10 -42.73 -46.31 5.07 Favored 'General case' 0 CA--C 1.516 -0.352 0 C-N-CA 124.593 1.157 . . . . 2.71 111.055 178.561 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 12.4 mtp-105 -64.24 -51.2 64.79 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.162 -0.927 . . . . 4.42 109.423 -176.532 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 1.2 mm? -66.39 -18.88 65.62 Favored 'General case' 0 N--CA 1.451 -0.39 0 CA-C-O 117.674 -1.155 . . . . 1.85 113.054 176.708 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -67.37 -44.19 79.56 Favored 'General case' 0 C--O 1.221 -0.445 0 CA-C-N 121.377 1.899 . . . . 3.05 107.106 168.893 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 93.8 t -63.95 -46.08 95.05 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.564 0 CA-C-O 117.559 -1.21 . . . . 1.49 111.556 177.069 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 7.2 mt-30 -63.03 -49.62 73.9 Favored 'General case' 0 N--CA 1.463 0.217 0 CA-C-N 121.864 2.12 . . . . 2.34 111.737 178.636 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 44.9 tttt -57.83 -52.26 66.19 Favored 'General case' 0 N--CA 1.449 -0.497 0 O-C-N 121.769 -0.582 . . . . 3.01 110.325 -176.523 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 8.0 m-20 -67.22 -33.3 75.07 Favored 'General case' 0 N--CA 1.453 -0.315 0 C-N-CA 123.704 0.802 . . . . 1.52 110.394 -179.147 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -136.04 84.24 31.54 Favored Pre-proline 0 C--O 1.236 0.373 0 C-N-CA 125.984 1.714 . . . . 1.36 110.233 -173.728 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 97.4 Cg_endo -81.48 48.78 2.98 Favored 'Trans proline' 0 CA--C 1.538 0.683 0 C-N-CA 123.567 2.845 . . . . 1.64 111.333 -175.791 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 2.3 ptmt -168.5 -53.55 0.02 OUTLIER 'General case' 0 N--CA 1.454 -0.231 0 C-N-CA 125.813 1.645 . . . . 3.08 110.173 -174.025 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 6.6 m -51.21 -46.6 62.27 Favored 'General case' 0 N--CA 1.464 0.274 0 CA-C-N 118.874 0.761 . . . . 1.83 111.674 179.404 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 7.6 t80 -57.47 -47.07 82.85 Favored 'General case' 0 CA--C 1.511 -0.544 0 CA-C-O 121.486 0.66 . . . . 3.03 111.149 178.678 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 12.6 tt0 -61.06 -31.1 70.77 Favored 'General case' 0 N--CA 1.441 -0.889 0 CA-C-N 115.052 -0.976 . . . . 2.32 110.185 -179.41 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -60.69 -60.21 4.16 Favored 'General case' 0 N--CA 1.46 0.047 0 C-N-CA 123.663 0.785 . . . . 1.43 109.09 -176.64 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 3.0 mp -53.81 -44.21 59.09 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.302 0 N-CA-C 108.783 -0.821 . . . . 1.91 108.783 175.964 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 52.6 t30 -60.34 -37.58 81.07 Favored 'General case' 0 CA--C 1.535 0.401 0 C-N-CA 120.336 -0.546 . . . . 1.94 112.137 -177.306 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 . . . . . 0 CA--C 1.533 0.317 0 C-N-CA 126.878 2.071 . . . . 3.15 108.946 -179.999 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.451 -0.407 0 CA-C-O 122.266 1.031 . . . . 5.11 108.441 . . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 0.6 OUTLIER -69.41 -24.88 28.01 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.306 0 CA-C-N 115.815 -0.63 . . . . 2.09 112.317 179.631 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 16' ' ' HIS . . . . . 0.417 ' HD1' ' CD ' ' A' ' 69' ' ' GLU . 1.0 OUTLIER -59.41 -54.14 50.13 Favored 'General case' 0 N--CA 1.455 -0.215 0 N-CA-C 106.753 -1.573 . . . . 0.71 106.753 175.28 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 2.6 mt-10 -59.45 -35.56 74.27 Favored 'General case' 0 CA--C 1.516 -0.348 0 CA-C-O 118.254 -0.879 . . . . 3.58 111.189 179.22 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 10.0 t80 -52.43 -47.47 66.35 Favored 'General case' 0 C--N 1.333 -0.146 0 CA-C-N 119.001 0.819 . . . . 4.68 110.815 173.984 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -49.75 -48.8 36.03 Favored Glycine 0 CA--C 1.525 0.658 0 N-CA-C 111.478 -0.649 . . . . 0.45 111.478 172.148 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 1.8 t-160 -63.01 -41.74 99.64 Favored 'General case' 0 N--CA 1.454 -0.274 0 O-C-N 121.66 -0.906 . . . . 2.72 111.663 -178.504 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -62.14 -32.98 73.64 Favored 'General case' 0 N--CA 1.449 -0.482 0 N-CA-C 109.684 -0.487 . . . . 1.6 109.684 178.817 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 93.9 t -67.44 -40.35 84.38 Favored 'Isoleucine or valine' 0 C--O 1.233 0.209 0 C-N-CA 119.611 -0.836 . . . . 1.74 110.121 175.112 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 CA--C 1.527 0.088 0 CA-C-O 119.46 -0.305 . . . . 2.2 111.292 176.145 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 10.0 t0 . . . . . 0 N--CA 1.465 0.278 0 CA-C-O 121.951 0.881 . . . . 2.19 109.608 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 9.4 mm -51.4 -51.8 22.82 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.481 0 C-N-CA 125.711 1.604 . . . . 1.68 108.651 173.79 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 32.5 t80 -62.5 -32.4 73.3 Favored 'General case' 0 N--CA 1.45 -0.448 0 O-C-N 120.422 -1.424 . . . . 0.48 113.357 175.728 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -63.42 -50.93 67.85 Favored 'General case' 0 N--CA 1.455 -0.186 0 C-N-CA 118.209 -1.396 . . . . 2.36 110.116 -176.135 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 31.3 mt-10 -79.94 -66.59 0.86 Allowed 'General case' 0 N--CA 1.454 -0.275 0 N-CA-C 108.669 -0.863 . . . . 3.71 108.669 -178.699 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 17.1 mp0 -71.83 -28.44 63.57 Favored 'General case' 0 C--O 1.236 0.384 0 O-C-N 121.865 -0.522 . . . . 2.63 110.589 -165.808 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . 0.406 ' HA2' ' CD1' ' A' ' 66' ' ' PHE . . . -70.6 38.74 0.48 Allowed Glycine 0 CA--C 1.529 0.91 0 C-N-CA 124.874 1.226 . . . . 0.35 113.686 169.603 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 36.1 p -148.88 29.94 0.81 Allowed 'General case' 0 N--CA 1.446 -0.645 0 O-C-N 120.832 -1.393 . . . . 2.5 109.983 158.328 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 2.7 t-20 -141.04 -42.1 0.39 Allowed 'General case' 0 CA--C 1.52 -0.199 0 N-CA-C 113.005 0.743 . . . . 2.78 113.005 -170.946 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 31.1 mt -59.18 -38.05 78.89 Favored 'General case' 0 N--CA 1.463 0.199 0 CA-C-O 120.874 0.369 . . . . 1.84 111.2 -175.66 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -179.12 171.1 1.38 Allowed 'General case' 0 CA--C 1.533 0.312 0 C-N-CA 125.356 1.462 . . . . 1.77 107.35 -179.585 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 13.3 m -61.63 -36.41 80.69 Favored 'General case' 0 CA--C 1.53 0.209 0 O-C-N 121.648 -0.657 . . . . 1.28 110.506 169.413 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -69.13 -4.31 16.87 Favored 'General case' 0 CA--C 1.533 0.321 0 N-CA-C 112.346 0.499 . . . . 2.05 112.346 172.82 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -91.87 -7.88 64.02 Favored Glycine 0 N--CA 1.444 -0.817 0 CA-C-O 118.66 -1.078 . . . . 0.62 111.071 173.632 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 4.1 tmt_? -111.8 -12.86 13.77 Favored 'General case' 0 C--N 1.338 0.082 0 CA-C-N 119.095 1.447 . . . . 3.62 112.162 -178.656 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 17.6 p -64.57 -161.09 0.01 OUTLIER 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 124.372 1.069 . . . . 1.94 109.542 168.439 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 85.8 m-20 -51.87 147.51 6.88 Favored 'General case' 0 C--N 1.34 0.165 0 O-C-N 120.699 -1.251 . . . . 2.06 111.162 -176.651 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 28.6 tt0 -60.74 -25.0 66.15 Favored 'General case' 0 CA--C 1.536 0.415 0 CA-C-O 121.775 0.798 . . . . 3.32 111.094 -175.829 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -58.39 -47.16 84.77 Favored 'General case' 0 N--CA 1.452 -0.374 0 C-N-CA 124.823 1.249 . . . . 1.54 112.829 169.86 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 12.3 mt-10 -69.48 -42.52 74.7 Favored 'General case' 0 CA--C 1.514 -0.409 0 O-C-N 121.466 -0.771 . . . . 2.08 110.258 179.148 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 66' ' ' PHE . . . . . 0.406 ' CD1' ' HA2' ' A' ' 52' ' ' GLY . 53.9 t80 -49.34 -52.54 27.37 Favored 'General case' 0 N--CA 1.453 -0.297 0 C-N-CA 123.288 0.635 . . . . 0.39 110.814 174.462 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 75.8 t80 -59.78 -43.65 94.3 Favored 'General case' 0 N--CA 1.451 -0.415 0 C-N-CA 122.581 0.352 . . . . 0.46 110.842 177.55 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -62.27 -45.62 92.46 Favored 'General case' 0 CA--C 1.54 0.572 0 O-C-N 121.404 -0.81 . . . . 1.61 111.762 -176.404 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . 0.417 ' CD ' ' HD1' ' A' ' 16' ' ' HIS . 15.2 mm-40 -59.93 -43.43 94.95 Favored 'General case' 0 CA--C 1.521 -0.141 0 C-N-CA 123.505 0.722 . . . . 4.13 109.651 173.318 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -55.77 -43.51 76.81 Favored 'General case' 0 N--CA 1.451 -0.412 0 N-CA-C 109.791 -0.448 . . . . 1.59 109.791 -179.705 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 7.2 t80 -61.28 -50.4 73.16 Favored 'General case' 0 CA--C 1.531 0.232 0 C-N-CA 123.065 0.546 . . . . 3.72 111.578 178.332 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 17.2 ttt180 -46.76 -59.36 3.1 Favored 'General case' 0 N--CA 1.468 0.426 0 C-N-CA 124.225 1.01 . . . . 2.88 109.789 175.251 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -65.16 -27.78 68.95 Favored 'General case' 0 N--CA 1.451 -0.412 0 C-N-CA 124.729 1.212 . . . . 2.04 110.748 -175.351 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 2.0 ttp -58.43 -39.93 81.12 Favored 'General case' 0 C--O 1.234 0.272 0 CA-C-O 121.306 0.574 . . . . 3.47 111.552 -178.052 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 15.1 p80 -94.46 -42.96 8.58 Favored 'General case' 0 C--O 1.223 -0.31 0 CA-C-O 116.063 -1.923 . . . . 2.74 112.561 178.283 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 53.6 p 3.56 112.58 0.0 OUTLIER 'General case' 0 N--CA 1.472 0.643 0 C-N-CA 128.617 2.767 . . . . 3.22 114.602 -171.288 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 2.3 p -41.05 -44.43 2.43 Favored 'General case' 0 N--CA 1.455 -0.209 0 C-N-CA 125.703 1.601 . . . . 2.22 111.678 178.677 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 57.1 t0 -76.56 106.31 8.13 Favored 'General case' 0 N--CA 1.452 -0.349 0 C-N-CA 117.072 -1.851 . . . . 2.11 108.649 166.886 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 5.3 p-80 -42.44 -35.63 1.09 Allowed 'General case' 0 N--CA 1.454 -0.258 0 C-N-CA 124.474 1.11 . . . . 5.64 112.758 171.415 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -56.61 -47.88 78.67 Favored 'General case' 0 N--CA 1.449 -0.485 0 C-N-CA 123.149 0.58 . . . . 1.83 110.415 -178.955 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -54.37 -34.36 61.02 Favored 'General case' 0 CA--C 1.515 -0.374 0 C-N-CA 122.489 0.316 . . . . 3.75 111.343 -179.286 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 3.5 mtp-105 -63.28 -51.97 63.96 Favored 'General case' 0 N--CA 1.447 -0.588 0 N-CA-C 108.642 -0.873 . . . . 4.62 108.642 177.937 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 2.4 mm? -61.42 -25.81 67.45 Favored 'General case' 0 N--CA 1.453 -0.315 0 CA-C-O 118.092 -0.956 . . . . 1.95 112.276 177.908 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 2.4 mptm? -62.53 -46.0 90.42 Favored 'General case' 0 CA--C 1.52 -0.19 0 CA-C-N 120.37 1.441 . . . . 2.41 108.504 173.681 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 86.3 t -62.66 -63.75 0.77 Allowed 'Isoleucine or valine' 0 C--O 1.217 -0.652 0 CA-C-O 118.356 -0.831 . . . . 1.53 109.795 174.712 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -47.82 -51.01 24.28 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 119.53 1.059 . . . . 2.3 111.514 -171.869 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 13.5 pttp -66.06 -40.08 90.63 Favored 'General case' 0 CA--C 1.532 0.276 0 O-C-N 121.991 -0.443 . . . . 5.03 110.722 -177.24 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 55.1 m-20 -82.07 -7.43 59.61 Favored 'General case' 0 CA--C 1.534 0.351 0 CA-C-N 118.178 0.445 . . . . 1.43 111.244 -179.776 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -158.57 74.51 3.65 Favored Pre-proline 0 N--CA 1.448 -0.553 0 C-N-CA 125.477 1.511 . . . . 1.27 108.907 -170.326 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 67.8 Cg_endo -81.6 44.17 1.68 Allowed 'Trans proline' 0 CA--C 1.537 0.641 0 C-N-CA 124.234 3.289 . . . . 1.59 111.254 -174.947 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -160.95 -56.31 0.05 Allowed 'General case' 0 N--CA 1.451 -0.382 0 C-N-CA 125.636 1.574 . . . . 3.38 108.66 -176.1 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 2.5 m -49.22 -48.6 45.35 Favored 'General case' 0 N--CA 1.464 0.256 0 C-N-CA 123.822 0.849 . . . . 1.47 111.359 176.603 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 6.5 t80 -59.55 -51.19 70.89 Favored 'General case' 0 CA--C 1.509 -0.61 0 CA-C-O 121.348 0.594 . . . . 3.18 110.561 -179.301 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 32.2 tt0 -59.93 -28.19 67.41 Favored 'General case' 0 N--CA 1.442 -0.847 0 CA-C-N 114.928 -1.033 . . . . 2.18 110.207 -178.315 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 8.4 t80 -65.35 -56.93 9.87 Favored 'General case' 0 N--CA 1.452 -0.333 0 C-N-CA 124.068 0.947 . . . . 1.91 109.423 -175.136 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 3.4 mp -59.06 -41.51 83.65 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.161 0 N-CA-C 108.924 -0.769 . . . . 2.14 108.924 174.832 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -60.13 -30.44 69.29 Favored 'General case' 0 CA--C 1.536 0.419 0 CA-C-N 118.03 0.377 . . . . 2.34 111.208 -178.85 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 10.3 t70 . . . . . 0 CA--C 1.522 -0.102 0 C-N-CA 123.771 0.828 . . . . 2.34 109.302 177.104 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 C--O 1.224 -0.277 0 N-CA-C 110.464 -0.198 . . . . 5.26 110.464 . . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 0.5 OUTLIER -61.92 -34.67 64.03 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.348 0 O-C-N 121.709 -0.619 . . . . 1.59 111.948 -176.505 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 6.6 t60 -60.05 -55.52 32.92 Favored 'General case' 0 CA--C 1.532 0.269 0 N-CA-C 107.207 -1.405 . . . . 0.73 107.207 178.051 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 31.7 mt-10 -56.87 -38.29 72.53 Favored 'General case' 0 N--CA 1.453 -0.301 0 C-N-CA 124.152 0.981 . . . . 1.94 111.832 178.654 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 1.7 m-85 -54.94 -49.17 72.01 Favored 'General case' 0 CA--C 1.517 -0.295 0 CA-C-N 119.42 1.009 . . . . 4.39 109.661 176.165 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -50.01 -45.87 41.75 Favored Glycine 0 CA--C 1.525 0.694 0 N-CA-C 110.804 -0.918 . . . . 0.46 110.804 174.866 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 1.8 t60 -62.16 -45.6 92.69 Favored 'General case' 0 N--CA 1.451 -0.398 0 O-C-N 121.896 -0.767 . . . . 2.55 111.783 179.458 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -64.61 -28.0 69.33 Favored 'General case' 0 N--CA 1.454 -0.271 0 O-C-N 121.199 -0.938 . . . . 1.56 110.228 179.619 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 92.7 t -71.67 -37.45 63.04 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.168 0 O-C-N 120.921 -1.112 . . . . 1.79 109.682 176.242 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 8.6 t70 . . . . . 0 C--N 1.334 -0.101 0 CA-C-O 121.179 0.514 . . . . 2.23 111.136 172.895 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 6.8 m-20 . . . . . 0 N--CA 1.463 0.177 0 CA-C-O 121.077 0.465 . . . . 3.61 111.271 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 3.2 mm -53.13 -50.96 43.35 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.232 0 C-N-CA 124.268 1.027 . . . . 1.63 109.416 -176.259 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 24.6 t80 -64.07 -36.76 85.07 Favored 'General case' 0 N--CA 1.451 -0.378 0 O-C-N 121.614 -0.679 . . . . 0.43 111.396 177.15 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . 0.463 ' HA ' ' HE2' ' A' ' 49' ' ' LYS . 0.3 OUTLIER -60.3 -47.2 87.04 Favored 'General case' 0 C--N 1.33 -0.246 0 C-N-CA 118.791 -1.164 . . . . 2.17 111.615 -177.292 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 3.5 tp10 -86.42 -59.64 2.22 Favored 'General case' 0 CA--C 1.532 0.268 0 CA-C-O 121.871 0.843 . . . . 2.89 109.598 -176.27 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 19.2 mm-40 -73.57 -28.84 62.06 Favored 'General case' 0 CA--C 1.535 0.402 0 O-C-N 121.654 -0.654 . . . . 2.19 110.621 -170.131 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . 0.402 ' HA2' ' CD1' ' A' ' 66' ' ' PHE . . . -68.06 40.57 0.26 Allowed Glycine 0 CA--C 1.531 1.05 0 C-N-CA 126.509 2.004 . . . . 0.34 114.715 172.332 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 20.9 t -146.45 22.59 1.31 Allowed 'General case' 0 N--CA 1.45 -0.432 0 O-C-N 120.778 -1.425 . . . . 2.81 110.019 156.679 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -135.53 -23.3 1.44 Allowed 'General case' 0 C--N 1.342 0.282 0 N-CA-C 113.712 1.005 . . . . 3.64 113.712 -167.539 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 22.0 mt -71.48 -41.65 69.09 Favored 'General case' 0 C--N 1.331 -0.233 0 O-C-N 121.404 -0.81 . . . . 1.61 109.919 175.99 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 1.7 t 179.13 175.16 0.67 Allowed 'General case' 0 CA--C 1.533 0.305 0 C-N-CA 125.408 1.483 . . . . 1.54 107.939 -174.741 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 39.4 t -60.88 -36.02 78.13 Favored 'General case' 0 CA--C 1.532 0.288 0 O-C-N 121.688 -0.632 . . . . 2.6 109.781 168.888 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -65.59 -11.64 46.05 Favored 'General case' 0 N--CA 1.465 0.285 0 N-CA-C 112.468 0.544 . . . . 1.49 112.468 174.581 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -88.61 -7.17 72.2 Favored Glycine 0 C--O 1.221 -0.688 0 CA-C-O 119.124 -0.82 . . . . 0.43 111.117 176.31 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 64.1 ttt180 -113.52 -14.1 12.72 Favored 'General case' 0 N--CA 1.458 -0.07 0 CA-C-N 118.875 1.337 . . . . 4.36 112.036 -178.672 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 19.9 p -64.48 -159.03 0.01 OUTLIER 'General case' 0 CA--C 1.539 0.536 0 C-N-CA 123.408 0.683 . . . . 1.84 109.432 168.582 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 3.8 t-20 -53.05 145.85 12.35 Favored 'General case' 0 CA--C 1.53 0.196 0 O-C-N 120.403 -1.436 . . . . 1.87 110.271 -176.305 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -59.56 -31.87 69.83 Favored 'General case' 0 CA--C 1.535 0.368 0 CA-C-O 121.461 0.648 . . . . 3.36 110.663 -176.278 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -58.59 -36.19 73.6 Favored 'General case' 0 N--CA 1.453 -0.311 0 N-CA-C 112.968 0.729 . . . . 1.7 112.968 174.531 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 8.1 mt-10 -70.93 -48.57 52.79 Favored 'General case' 0 CA--C 1.511 -0.533 0 CA-C-O 118.301 -0.857 . . . . 2.22 110.261 174.599 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 66' ' ' PHE . . . . . 0.402 ' CD1' ' HA2' ' A' ' 52' ' ' GLY . 30.6 t80 -46.49 -47.05 19.42 Favored 'General case' 0 CA--C 1.533 0.305 0 C-N-CA 124.385 1.074 . . . . 0.35 111.448 175.145 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 78.9 t80 -65.33 -44.38 87.96 Favored 'General case' 0 CA--C 1.537 0.447 0 O-C-N 121.172 -0.955 . . . . 0.55 111.12 177.29 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -66.16 -51.34 58.77 Favored 'General case' 0 CA--C 1.539 0.554 0 C-N-CA 123.959 0.904 . . . . 1.45 112.668 -174.331 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -60.72 -40.06 90.92 Favored 'General case' 0 C--N 1.332 -0.186 0 O-C-N 120.858 -1.151 . . . . 3.59 110.618 172.451 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -56.18 -40.68 74.31 Favored 'General case' 0 C--O 1.222 -0.362 0 CA-C-N 118.727 0.694 . . . . 1.8 110.176 174.72 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -55.75 -49.89 71.88 Favored 'General case' 0 N--CA 1.465 0.298 0 C-N-CA 124.513 1.125 . . . . 4.72 111.833 172.137 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -50.8 -56.65 11.11 Favored 'General case' 0 CA--C 1.531 0.236 0 N-CA-C 109.222 -0.659 . . . . 5.18 109.222 176.739 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -66.4 -25.91 66.99 Favored 'General case' 0 C--N 1.327 -0.402 0 C-N-CA 124.346 1.059 . . . . 1.58 111.236 -175.511 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -63.49 -39.16 93.71 Favored 'General case' 0 C--O 1.231 0.125 0 CA-C-N 118.646 0.657 . . . . 3.09 109.912 -179.42 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 7.1 p80 -97.62 -9.72 26.4 Favored 'General case' 0 CA--C 1.531 0.246 0 CA-C-O 116.277 -1.821 . . . . 1.21 114.191 179.331 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 5.1 m -36.2 114.88 0.31 Allowed 'General case' 0 CA--C 1.512 -0.511 0 CA-C-N 120.698 1.59 . . . . 1.79 111.162 -173.303 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -51.62 -37.25 49.3 Favored 'General case' 0 N--CA 1.448 -0.568 0 CA-C-N 114.259 -1.337 . . . . 2.01 110.7 -173.67 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 53.9 t0 -73.41 107.19 5.57 Favored 'General case' 0 N--CA 1.452 -0.365 0 C-N-CA 116.95 -1.9 . . . . 2.4 109.563 164.955 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 20.9 p-80 -38.97 -38.22 0.43 Allowed 'General case' 0 N--CA 1.454 -0.234 0 C-N-CA 125.247 1.419 . . . . 5.76 112.5 169.431 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -53.89 -54.67 35.48 Favored 'General case' 0 N--CA 1.449 -0.485 0 CA-C-N 118.197 0.453 . . . . 1.32 109.789 -179.23 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -57.06 -35.88 69.86 Favored 'General case' 0 CA--C 1.514 -0.431 0 C-N-CA 122.957 0.503 . . . . 4.58 111.852 -175.238 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 22.0 mtp180 -61.97 -50.03 73.74 Favored 'General case' 0 N--CA 1.449 -0.52 0 C-N-CA 119.744 -0.783 . . . . 3.09 109.397 175.987 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 1.6 mm? -67.24 -18.54 65.27 Favored 'General case' 0 N--CA 1.456 -0.17 0 CA-C-O 118.093 -0.956 . . . . 1.79 113.41 176.743 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 2.5 mptm? -65.44 -50.47 65.27 Favored 'General case' 0 CA--C 1.517 -0.294 0 CA-C-N 120.65 1.568 . . . . 2.04 107.413 169.827 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 94.4 t -57.39 -50.17 77.81 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.528 0 CA-C-O 118.85 -0.595 . . . . 1.68 110.458 176.387 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -62.38 -52.56 63.13 Favored 'General case' 0 N--CA 1.45 -0.432 0 CA-C-N 119.472 1.033 . . . . 3.19 111.223 -173.518 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 29.5 pttt -63.58 -40.25 96.47 Favored 'General case' 0 CA--C 1.53 0.176 0 O-C-N 121.78 -0.575 . . . . 3.66 109.96 -175.531 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 50.8 m-20 -72.14 -28.47 63.28 Favored 'General case' 0 C--O 1.224 -0.249 0 C-N-CA 122.763 0.425 . . . . 1.37 110.635 -178.855 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -141.43 74.7 23.64 Favored Pre-proline 0 C--O 1.237 0.419 0 C-N-CA 125.901 1.68 . . . . 1.73 108.914 -170.559 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 85.5 Cg_endo -78.29 68.55 7.9 Favored 'Trans proline' 0 N--CA 1.457 -0.655 0 C-N-CA 123.874 3.05 . . . . 1.86 110.146 -171.307 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 1.2 ptmt 166.47 -55.23 0.0 OUTLIER 'General case' 0 C--O 1.224 -0.272 0 C-N-CA 126.432 1.893 . . . . 2.77 111.204 -167.083 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 6.0 m -56.47 -44.03 80.18 Favored 'General case' 0 CA--C 1.518 -0.265 0 CA-C-N 120.071 1.305 . . . . 1.64 110.514 -178.404 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 13.9 t80 -57.16 -48.87 77.65 Favored 'General case' 0 CA--C 1.513 -0.475 0 C-N-CA 120.073 -0.651 . . . . 3.1 110.68 175.865 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 19.3 tt0 -59.87 -28.97 67.99 Favored 'General case' 0 N--CA 1.443 -0.779 0 CA-C-N 114.93 -1.032 . . . . 1.98 110.844 -179.104 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 2.6 t80 -63.26 -57.02 11.81 Favored 'General case' 0 N--CA 1.457 -0.113 0 C-N-CA 124.258 1.023 . . . . 1.36 109.133 -176.213 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 3.3 mp -60.24 -42.69 91.35 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.302 0 N-CA-C 108.498 -0.927 . . . . 1.89 108.498 177.069 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 12.8 t-20 -56.89 -36.34 70.0 Favored 'General case' 0 CA--C 1.537 0.466 0 CA-C-N 117.836 0.289 . . . . 2.93 111.589 -177.892 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.462 0.144 0 C-N-CA 125.172 1.389 . . . . 2.13 109.399 175.756 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 CA--C 1.52 -0.175 0 CA-C-O 120.904 0.383 . . . . 5.15 110.638 . . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 0.7 OUTLIER -64.59 -38.88 83.77 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.303 0 N-CA-C 112.069 0.396 . . . . 1.45 112.069 179.354 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 12.4 t60 -59.29 -56.18 25.37 Favored 'General case' 0 CA--C 1.53 0.184 0 N-CA-C 107.741 -1.207 . . . . 0.84 107.741 -179.67 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 34.3 mt-10 -57.87 -37.55 74.13 Favored 'General case' 0 N--CA 1.451 -0.418 0 C-N-CA 124.406 1.083 . . . . 2.42 111.057 178.507 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -54.47 -52.15 62.77 Favored 'General case' 0 CA--C 1.521 -0.165 0 CA-C-N 119.457 1.026 . . . . 4.98 109.871 173.878 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -47.82 -46.37 25.23 Favored Glycine 0 CA--C 1.526 0.75 0 N-CA-C 110.696 -0.961 . . . . 0.63 110.696 173.849 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 2.6 t60 -65.66 -45.97 80.9 Favored 'General case' 0 N--CA 1.454 -0.248 0 O-C-N 121.951 -0.735 . . . . 2.54 112.272 -177.883 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -61.78 -34.32 75.68 Favored 'General case' 0 N--CA 1.452 -0.353 0 O-C-N 120.925 -1.109 . . . . 2.03 109.123 179.298 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 94.2 t -76.77 -26.88 16.48 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.428 0 C-N-CA 120.233 -0.587 . . . . 2.77 110.284 179.509 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 34.7 t0 . . . . . 0 N--CA 1.456 -0.171 0 CA-C-O 121.953 0.883 . . . . 2.35 110.328 172.141 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 2.5 m-20 . . . . . 0 CA--C 1.521 -0.169 0 N-CA-C 109.072 -0.714 . . . . 3.28 109.072 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 11.3 mm -49.52 -56.6 2.81 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.229 0 C-N-CA 125.329 1.451 . . . . 1.8 108.922 -178.443 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 28.9 t80 -61.69 -37.5 84.37 Favored 'General case' 0 N--CA 1.453 -0.311 0 C-N-CA 124.614 1.166 . . . . 0.55 112.337 175.551 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . 0.418 ' HA ' ' HE2' ' A' ' 49' ' ' LYS . 0.2 OUTLIER -62.0 -45.17 94.77 Favored 'General case' 0 CA--C 1.519 -0.218 0 CA-C-N 119.652 1.115 . . . . 2.12 111.1 -175.502 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 2.9 tp10 -80.19 -67.51 0.76 Allowed 'General case' 0 N--CA 1.451 -0.425 0 CA-C-O 122.387 1.089 . . . . 2.62 108.962 179.074 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . 0.566 ' OE2' ' HE2' ' A' ' 91' ' ' LYS . 59.2 mm-40 -76.45 -19.69 57.8 Favored 'General case' 0 N--CA 1.453 -0.293 0 C-N-CA 123.389 0.675 . . . . 3.05 111.51 -164.773 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -68.83 36.31 0.28 Allowed Glycine 0 CA--C 1.532 1.145 0 C-N-CA 124.393 0.997 . . . . 0.63 113.12 167.684 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 59.9 p -148.84 23.63 0.97 Allowed 'General case' 0 N--CA 1.448 -0.532 0 O-C-N 120.444 -1.621 . . . . 2.37 110.855 161.488 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 58.7 t-20 -135.51 -43.52 0.69 Allowed 'General case' 0 CA--C 1.52 -0.209 0 CA-C-O 120.896 0.379 . . . . 2.95 111.444 -160.15 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 20.6 mt -66.14 -37.16 85.0 Favored 'General case' 0 C--N 1.331 -0.205 0 C-N-CA 120.445 -0.502 . . . . 1.7 110.674 -179.41 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 2.7 t 175.78 173.1 0.32 Allowed 'General case' 0 CA--C 1.533 0.301 0 C-N-CA 125.269 1.428 . . . . 1.56 108.193 -173.136 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 8.8 p -64.04 -36.3 83.54 Favored 'General case' 0 N--CA 1.455 -0.188 0 C-N-CA 123.889 0.876 . . . . 2.88 110.504 172.666 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -64.38 -14.8 58.52 Favored 'General case' 0 N--CA 1.464 0.266 0 N-CA-C 112.041 0.385 . . . . 1.47 112.041 172.247 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -75.57 -13.6 82.8 Favored Glycine 0 N--CA 1.443 -0.885 0 N-CA-C 110.848 -0.901 . . . . 0.44 110.848 174.339 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 3.6 tmt_? -113.75 -8.65 13.21 Favored 'General case' 0 CA--C 1.52 -0.174 0 CA-C-N 118.967 1.384 . . . . 3.51 113.028 -171.34 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 18.8 p -69.09 -115.21 0.0 OUTLIER 'General case' 0 C--N 1.327 -0.377 0 C-N-CA 124.368 1.067 . . . . 1.8 110.042 177.215 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 9.8 t-20 -86.94 154.1 21.07 Favored 'General case' 0 N--CA 1.454 -0.228 0 O-C-N 120.553 -1.342 . . . . 2.35 107.724 177.829 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 78.8 tt0 -58.68 -34.57 71.41 Favored 'General case' 0 CA--C 1.535 0.383 0 CA-C-N 118.87 0.759 . . . . 2.95 109.731 175.416 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -65.93 -29.04 69.39 Favored 'General case' 0 N--CA 1.455 -0.215 0 N-CA-C 113.128 0.788 . . . . 1.49 113.128 177.521 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 11.9 mt-10 -77.42 -45.68 25.05 Favored 'General case' 0 CA--C 1.513 -0.471 0 O-C-N 121.075 -1.016 . . . . 2.22 110.05 175.856 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 49.8 t80 -47.64 -48.71 28.55 Favored 'General case' 0 C--N 1.33 -0.271 0 C-N-CA 125.717 1.607 . . . . 0.65 111.27 172.19 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 56.5 t80 -63.26 -43.78 97.0 Favored 'General case' 0 CA--C 1.538 0.517 0 O-C-N 121.174 -0.954 . . . . 1.02 110.833 177.013 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -66.49 -52.33 47.22 Favored 'General case' 0 CA--C 1.539 0.534 0 O-C-N 121.114 -0.991 . . . . 1.6 112.851 -174.185 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -57.63 -39.8 77.75 Favored 'General case' 0 C--N 1.331 -0.215 0 O-C-N 120.701 -1.249 . . . . 4.0 111.017 170.382 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -56.71 -44.0 81.12 Favored 'General case' 0 N--CA 1.451 -0.416 0 CA-C-O 118.4 -0.81 . . . . 1.61 110.251 176.648 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 71.3 t80 -55.92 -49.98 71.95 Favored 'General case' 0 N--CA 1.466 0.371 0 CA-C-N 119.725 1.148 . . . . 4.26 111.672 173.517 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 64.1 ttt180 -47.98 -57.59 5.55 Favored 'General case' 0 CA--C 1.533 0.325 0 CA-C-N 118.568 0.622 . . . . 3.12 109.899 177.537 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -67.3 -27.6 67.31 Favored 'General case' 0 C--N 1.327 -0.385 0 C-N-CA 124.538 1.135 . . . . 1.78 111.263 -176.476 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 1.2 ttp -62.29 -38.32 88.91 Favored 'General case' 0 N--CA 1.454 -0.244 0 C-N-CA 122.814 0.445 . . . . 3.24 109.852 179.763 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 23.1 p80 -91.27 -36.61 13.8 Favored 'General case' 0 N--CA 1.452 -0.334 0 CA-C-O 115.886 -2.007 . . . . 1.12 111.572 -175.083 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 18.6 m -6.11 118.4 0.01 OUTLIER 'General case' 0 C--N 1.347 0.492 0 C-N-CA 128.493 2.717 . . . . 1.59 114.575 -174.655 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 4.9 p -46.21 -47.24 17.91 Favored 'General case' 0 N--CA 1.451 -0.376 0 C-N-CA 125.234 1.414 . . . . 1.83 109.638 175.136 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 12.9 t0 -70.36 114.18 8.23 Favored 'General case' 0 N--CA 1.451 -0.393 0 CA-C-O 122.13 0.967 . . . . 2.39 109.929 169.7 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 13.2 m170 -63.04 -29.41 70.8 Favored 'General case' 0 N--CA 1.451 -0.377 0 CA-C-N 115.779 -0.646 . . . . 7.51 111.189 176.964 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -63.21 -46.1 88.59 Favored 'General case' 0 N--CA 1.453 -0.29 0 CA-C-N 119.313 0.96 . . . . 2.57 110.07 179.369 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 81' ' ' GLU . . . . . 0.411 ' OE1' ' NZ ' ' A' ' 84' ' ' LYS . 0.2 OUTLIER -48.66 -41.99 33.09 Favored 'General case' 0 C--O 1.231 0.13 0 C-N-CA 124.554 1.142 . . . . 4.23 110.771 175.105 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -64.35 -52.52 57.94 Favored 'General case' 0 C--N 1.33 -0.247 0 N-CA-C 109.417 -0.586 . . . . 4.21 109.417 179.39 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 1.3 mm? -66.19 -16.88 64.36 Favored 'General case' 0 CA--C 1.522 -0.128 0 N-CA-C 112.861 0.689 . . . . 2.42 112.861 179.239 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 84' ' ' LYS . . . . . 0.411 ' NZ ' ' OE1' ' A' ' 81' ' ' GLU . 33.5 mttt -66.4 -51.24 59.04 Favored 'General case' 0 N--CA 1.45 -0.454 0 N-CA-C 106.953 -1.499 . . . . 3.15 106.953 168.865 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 98.8 t -56.18 -46.3 81.17 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.449 0 CA-C-O 118.195 -0.907 . . . . 1.74 111.994 174.557 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 1.6 mt-30 -66.84 -49.89 64.27 Favored 'General case' 0 C--O 1.224 -0.252 0 CA-C-N 120.662 1.574 . . . . 2.91 112.183 -175.589 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 5.3 pttp -68.11 -38.39 82.22 Favored 'General case' 0 C--O 1.226 -0.161 0 O-C-N 121.178 -0.951 . . . . 4.89 109.978 -174.678 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 3.1 m120 -62.38 -45.42 93.24 Favored 'General case' 0 N--CA 1.453 -0.322 0 N-CA-C 108.866 -0.79 . . . . 1.57 108.866 175.883 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -128.53 86.19 58.35 Favored Pre-proline 0 N--CA 1.451 -0.385 0 C-N-CA 126.324 1.85 . . . . 1.44 109.755 -172.467 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 92.1 Cg_endo -80.46 46.18 2.18 Favored 'Trans proline' 0 CA--C 1.539 0.737 0 C-N-CA 123.361 2.707 . . . . 1.85 111.596 -176.899 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 91' ' ' LYS . . . . . 0.566 ' HE2' ' OE2' ' A' ' 51' ' ' GLU . 21.1 pttt -160.88 -53.2 0.05 OUTLIER 'General case' 0 N--CA 1.452 -0.339 0 C-N-CA 125.443 1.497 . . . . 3.48 110.743 177.27 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 3.4 m -50.43 -47.06 56.83 Favored 'General case' 0 N--CA 1.464 0.228 0 C-N-CA 123.649 0.78 . . . . 1.75 111.781 -178.135 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 12.2 t80 -57.47 -49.56 75.89 Favored 'General case' 0 CA--C 1.516 -0.343 0 CA-C-O 121.793 0.806 . . . . 3.85 110.883 178.845 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 1.4 mt-30 -59.69 -26.48 65.61 Favored 'General case' 0 N--CA 1.446 -0.634 0 CA-C-N 114.657 -1.156 . . . . 2.04 110.773 -179.027 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 3.6 t80 -66.93 -58.39 5.07 Favored 'General case' 0 N--CA 1.451 -0.383 0 C-N-CA 123.586 0.755 . . . . 1.2 110.227 -178.16 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 3.3 mp -55.63 -42.54 69.41 Favored 'Isoleucine or valine' 0 CA--C 1.528 0.098 0 N-CA-C 108.701 -0.852 . . . . 2.15 108.701 175.638 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 21.8 t-20 -55.8 -43.91 77.33 Favored 'General case' 0 CA--C 1.537 0.452 0 CA-C-O 120.886 0.374 . . . . 2.34 111.181 -179.869 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 CA--C 1.533 0.318 0 C-N-CA 124.44 1.096 . . . . 2.27 110.178 177.523 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 9.2 t80 . . . . . 0 C--O 1.219 -0.541 0 N-CA-C 108.71 -0.848 . . . . 3.94 108.71 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -59.19 -37.16 67.01 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.389 0 N-CA-C 113.087 0.773 . . . . 1.62 113.087 176.421 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 6.4 t60 -61.03 -54.01 50.09 Favored 'General case' 0 N--CA 1.465 0.277 0 N-CA-C 106.354 -1.721 . . . . 0.67 106.354 177.775 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 67.9 mt-10 -53.26 -40.64 64.8 Favored 'General case' 0 C--O 1.223 -0.333 0 C-N-CA 122.698 0.399 . . . . 2.55 110.512 176.988 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -60.84 -50.17 74.54 Favored 'General case' 0 CA--C 1.518 -0.251 0 C-N-CA 125.173 1.389 . . . . 3.22 109.379 -175.291 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -49.04 -46.33 33.11 Favored Glycine 0 CA--C 1.528 0.9 0 N-CA-C 110.447 -1.061 . . . . 0.51 110.447 173.161 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 2.1 t60 -63.34 -42.15 98.93 Favored 'General case' 0 N--CA 1.451 -0.417 0 O-C-N 122.035 -0.685 . . . . 2.57 111.784 179.571 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -65.5 -30.42 71.18 Favored 'General case' 0 N--CA 1.452 -0.372 0 O-C-N 121.378 -0.826 . . . . 1.68 109.956 -179.938 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 82.5 t -70.01 -40.05 78.1 Favored 'Isoleucine or valine' 0 C--O 1.232 0.165 0 O-C-N 121.328 -0.857 . . . . 2.03 109.609 176.355 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 3.6 m-20 . . . . . 0 C--N 1.334 -0.099 0 N-CA-C 112.047 0.388 . . . . 2.5 112.047 172.375 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 12.8 t70 . . . . . 0 N--CA 1.465 0.308 0 CA-C-O 121.597 0.713 . . . . 2.37 111.032 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 5.7 mm -50.63 -52.59 15.81 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.308 0 C-N-CA 124.559 1.144 . . . . 1.85 108.677 177.461 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 20.0 t80 -67.52 -33.7 75.6 Favored 'General case' 0 N--CA 1.452 -0.332 0 C-N-CA 123.403 0.681 . . . . 0.93 112.043 177.201 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . 0.506 ' HE2' ' N ' ' A' ' 49' ' ' LYS . 0.6 OUTLIER -61.93 -49.16 77.25 Favored 'General case' 0 CA--C 1.519 -0.235 0 CA-C-N 119.899 1.227 . . . . 2.58 109.195 -174.44 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 7.3 mm-40 -80.08 -66.17 0.91 Allowed 'General case' 0 N--CA 1.448 -0.563 0 CA-C-O 122.14 0.971 . . . . 3.16 109.089 -178.461 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 17.8 mm-40 -73.79 -21.52 60.14 Favored 'General case' 0 C--O 1.235 0.298 0 C-N-CA 123.442 0.697 . . . . 2.57 110.659 -164.791 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . 0.412 ' HA2' ' CD1' ' A' ' 66' ' ' PHE . . . -68.2 37.52 0.25 Allowed Glycine 0 CA--C 1.531 1.064 0 C-N-CA 125.429 1.49 . . . . 0.42 113.454 169.073 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 61.5 p -148.94 23.25 0.97 Allowed 'General case' 0 N--CA 1.446 -0.663 0 O-C-N 120.673 -1.486 . . . . 2.66 110.839 163.388 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 3.2 t-20 -136.19 -39.84 0.67 Allowed 'General case' 0 CA--C 1.517 -0.301 0 N-CA-C 113.147 0.795 . . . . 2.44 113.147 -164.799 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 16.2 mt -66.96 -36.86 83.15 Favored 'General case' 0 C--N 1.332 -0.194 0 C-N-CA 120.214 -0.594 . . . . 1.58 110.473 -178.533 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 1.2 t 178.83 170.3 0.87 Allowed 'General case' 0 C--N 1.331 -0.206 0 C-N-CA 125.451 1.5 . . . . 1.62 107.637 -178.581 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 9.6 m -57.56 -35.35 70.22 Favored 'General case' 0 N--CA 1.453 -0.279 0 C-N-CA 123.175 0.59 . . . . 1.29 110.554 170.056 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -58.5 -33.84 70.27 Favored 'General case' 0 C--N 1.34 0.154 0 CA-C-N 117.837 0.289 . . . . 1.9 110.418 173.842 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -63.96 -16.36 59.48 Favored Glycine 0 C--O 1.22 -0.74 0 CA-C-O 119.106 -0.83 . . . . 0.55 111.792 178.481 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 50.7 ttt-85 -104.6 -8.55 18.88 Favored 'General case' 0 N--CA 1.457 -0.111 0 CA-C-N 119.184 1.492 . . . . 2.76 113.735 178.942 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 44.0 p -67.65 -139.12 0.0 OUTLIER 'General case' 0 CA--C 1.54 0.596 0 CA-C-O 121.205 0.526 . . . . 1.87 110.585 174.567 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 1.1 t-20 -65.22 149.48 49.86 Favored 'General case' 0 N--CA 1.453 -0.307 0 O-C-N 120.067 -1.646 . . . . 1.95 108.703 178.473 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 3.4 tm-20 -60.58 -32.69 71.78 Favored 'General case' 0 CA--C 1.532 0.282 0 O-C-N 121.915 -0.491 . . . . 3.15 110.259 179.454 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -61.62 -29.76 70.26 Favored 'General case' 0 N--CA 1.454 -0.246 0 N-CA-C 113.798 1.036 . . . . 1.84 113.798 175.166 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 2.1 mt-10 -81.44 -41.03 22.44 Favored 'General case' 0 CA--C 1.508 -0.653 0 O-C-N 121.169 -0.957 . . . . 2.52 110.597 176.776 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 66' ' ' PHE . . . . . 0.412 ' CD1' ' HA2' ' A' ' 52' ' ' GLY . 37.3 t80 -50.42 -47.7 56.52 Favored 'General case' 0 N--CA 1.45 -0.437 0 C-N-CA 124.194 0.997 . . . . 0.35 111.155 170.283 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 42.1 t80 -64.59 -46.02 84.48 Favored 'General case' 0 CA--C 1.538 0.504 0 O-C-N 121.34 -0.85 . . . . 0.85 109.98 176.979 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -61.28 -54.61 41.88 Favored 'General case' 0 CA--C 1.539 0.53 0 O-C-N 121.082 -1.011 . . . . 1.55 113.061 -174.297 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -57.28 -39.86 76.56 Favored 'General case' 0 C--N 1.331 -0.211 0 O-C-N 121.008 -1.057 . . . . 3.9 110.86 171.511 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -56.69 -42.18 78.64 Favored 'General case' 0 N--CA 1.453 -0.316 0 CA-C-N 119.15 0.886 . . . . 1.5 110.806 175.995 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 76.7 t80 -58.53 -49.66 76.59 Favored 'General case' 0 N--CA 1.464 0.261 0 CA-C-N 119.912 1.233 . . . . 4.26 111.633 172.821 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 22.8 ttp180 -47.84 -57.75 5.24 Favored 'General case' 0 N--CA 1.465 0.284 0 CA-C-N 119.238 0.926 . . . . 3.42 110.203 177.449 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -63.6 -30.15 71.3 Favored 'General case' 0 C--N 1.326 -0.414 0 C-N-CA 124.838 1.255 . . . . 1.8 111.104 -177.153 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 1.2 ttp -59.2 -42.23 90.45 Favored 'General case' 0 C--O 1.233 0.227 0 C-N-CA 122.756 0.422 . . . . 3.31 110.488 -179.938 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 8.9 p80 -96.7 -6.12 37.17 Favored 'General case' 0 N--CA 1.455 -0.183 0 CA-C-O 116.365 -1.779 . . . . 1.12 113.68 -177.181 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 16.6 m -36.94 126.93 0.91 Allowed 'General case' 0 N--CA 1.453 -0.29 0 CA-C-O 123.267 1.508 . . . . 1.67 111.905 -171.697 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 7.8 p -52.83 -44.95 67.08 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 112.849 -1.978 . . . . 2.18 108.207 177.133 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 13.0 t0 -65.68 107.52 1.78 Allowed 'General case' 0 N--CA 1.45 -0.459 0 CA-C-O 121.863 0.84 . . . . 2.14 108.91 166.687 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -57.58 -33.01 67.74 Favored 'General case' 0 N--CA 1.454 -0.266 0 CA-C-N 116.068 -0.515 . . . . 6.81 110.432 177.452 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -61.95 -47.4 85.06 Favored 'General case' 0 N--CA 1.451 -0.38 0 CA-C-N 118.567 0.621 . . . . 1.95 110.745 179.952 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 5.7 mt-10 -49.1 -41.44 35.66 Favored 'General case' 0 CA--C 1.519 -0.245 0 C-N-CA 123.943 0.897 . . . . 2.6 110.908 178.444 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 2.2 mtp180 -62.45 -50.2 72.4 Favored 'General case' 0 C--N 1.327 -0.396 0 N-CA-C 109.056 -0.72 . . . . 3.85 109.056 178.484 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 1.3 mm? -64.99 -18.18 65.06 Favored 'General case' 0 N--CA 1.451 -0.398 0 CA-C-O 117.682 -1.152 . . . . 1.63 113.487 176.51 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 6.6 mttt -69.32 -48.8 60.38 Favored 'General case' 0 C--O 1.224 -0.27 0 CA-C-N 121.404 1.911 . . . . 2.11 107.511 168.774 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 33.4 t -58.57 -42.61 85.19 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.596 0 CA-C-O 118.112 -0.947 . . . . 1.94 111.449 176.237 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 1.3 mt-30 -69.44 -52.77 23.67 Favored 'General case' 0 C--O 1.224 -0.255 0 CA-C-N 121.253 1.842 . . . . 2.72 111.741 -179.949 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 35.6 tttt -51.96 -50.8 60.52 Favored 'General case' 0 N--CA 1.451 -0.393 0 C-N-CA 123.436 0.694 . . . . 3.05 110.075 -177.661 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 4.0 m-20 -65.93 -46.08 79.51 Favored 'General case' 0 N--CA 1.449 -0.479 0 C-N-CA 123.389 0.676 . . . . 1.57 109.565 179.276 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -130.63 78.1 74.55 Favored Pre-proline 0 C--O 1.238 0.45 0 C-N-CA 125.672 1.589 . . . . 1.31 110.847 -168.634 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 73.9 Cg_endo -74.7 15.9 0.66 Allowed 'Trans proline' 0 CA--C 1.536 0.594 0 C-N-CA 123.062 2.508 . . . . 1.51 112.683 -175.233 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 7.9 ptmt -128.69 -46.43 1.29 Allowed 'General case' 0 N--CA 1.451 -0.421 0 C-N-CA 125.773 1.629 . . . . 3.69 109.526 -177.751 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 3.3 m -54.61 -49.4 70.56 Favored 'General case' 0 N--CA 1.464 0.242 0 CA-C-N 119.533 1.061 . . . . 1.69 111.067 176.227 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 22.5 t80 -59.01 -50.48 73.92 Favored 'General case' 0 CA--C 1.51 -0.583 0 C-N-CA 119.927 -0.709 . . . . 2.97 110.428 -179.724 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 22.4 tt0 -57.72 -29.63 64.89 Favored 'General case' 0 N--CA 1.444 -0.732 0 CA-C-N 114.69 -1.141 . . . . 3.14 110.1 -177.158 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 13.1 t80 -66.07 -58.42 5.52 Favored 'General case' 0 N--CA 1.45 -0.45 0 C-N-CA 123.358 0.663 . . . . 1.85 109.34 -177.882 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 3.2 mp -55.02 -41.99 62.03 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.217 0 N-CA-C 109.297 -0.631 . . . . 1.93 109.297 175.718 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 14.0 t-20 -60.98 -35.73 77.58 Favored 'General case' 0 N--CA 1.455 -0.187 0 C-N-CA 123.382 0.673 . . . . 3.58 111.772 -175.957 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 27.0 t70 . . . . . 0 CA--C 1.528 0.126 0 C-N-CA 123.585 0.754 . . . . 2.17 110.333 174.481 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 16.0 t80 . . . . . 0 C--O 1.223 -0.303 0 N-CA-C 109.504 -0.554 . . . . 4.88 109.504 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER -60.74 -33.9 56.86 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.328 0 O-C-N 121.724 -0.61 . . . . 1.8 111.708 -179.894 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 13.6 t60 -61.7 -51.56 67.88 Favored 'General case' 0 CA--C 1.536 0.442 0 N-CA-C 107.796 -1.186 . . . . 1.11 107.796 177.607 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 43.6 mt-10 -54.13 -40.69 67.61 Favored 'General case' 0 C--O 1.225 -0.22 0 O-C-N 121.013 -1.054 . . . . 2.29 110.668 175.173 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 1.3 t80 -58.23 -41.37 83.96 Favored 'General case' 0 N--CA 1.453 -0.314 0 C-N-CA 123.244 0.618 . . . . 3.52 109.931 178.752 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -49.87 -49.71 34.4 Favored Glycine 0 CA--C 1.529 0.927 0 N-CA-C 111.226 -0.75 . . . . 0.75 111.226 170.47 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 70.8 m-70 -57.15 -52.16 66.42 Favored 'General case' 0 C--O 1.227 -0.11 0 CA-C-N 117.93 0.865 . . . . 5.41 110.917 176.833 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -60.59 -27.42 67.71 Favored 'General case' 0 N--CA 1.454 -0.226 0 CA-C-N 117.802 0.273 . . . . 1.57 111.691 -177.904 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 54.2 t -71.83 -40.12 68.71 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.212 0 O-C-N 121.15 -0.969 . . . . 2.17 109.563 176.51 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 3.2 t0 . . . . . 0 N--CA 1.451 -0.419 0 N-CA-C 112.215 0.45 . . . . 2.49 112.215 179.837 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 94.7 m-20 . . . . . 0 N--CA 1.465 0.291 0 CA-C-O 120.431 0.158 . . . . 3.81 111.11 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 8.8 mm -47.65 -60.58 0.59 Allowed 'Isoleucine or valine' 0 CA--C 1.536 0.406 0 C-N-CA 125.692 1.597 . . . . 2.0 108.955 175.963 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 23.7 t80 -65.35 -30.6 71.45 Favored 'General case' 0 N--CA 1.454 -0.257 0 O-C-N 121.031 -1.043 . . . . 0.72 112.304 178.185 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -65.22 -49.55 69.26 Favored 'General case' 0 N--CA 1.454 -0.251 0 O-C-N 120.256 -1.527 . . . . 2.14 109.76 -176.942 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 26.8 mm-40 -85.94 -57.14 3.15 Favored 'General case' 0 N--CA 1.449 -0.499 0 CA-C-O 121.452 0.644 . . . . 4.33 109.557 -171.98 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 37.3 mt-10 -80.95 -23.32 38.92 Favored 'General case' 0 C--O 1.235 0.329 0 O-C-N 121.775 -0.578 . . . . 3.54 110.502 -171.692 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . 0.425 ' HA2' ' CD1' ' A' ' 66' ' ' PHE . . . -71.17 43.52 0.67 Allowed Glycine 0 CA--C 1.531 1.039 0 C-N-CA 125.791 1.662 . . . . 0.43 113.776 168.934 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 34.6 t -160.25 35.79 0.17 Allowed 'General case' 0 N--CA 1.447 -0.62 0 C-N-CA 125.022 1.329 . . . . 2.52 108.023 162.9 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 31.9 t30 -146.34 -34.76 0.29 Allowed 'General case' 0 C--N 1.341 0.228 0 N-CA-C 113.589 0.959 . . . . 2.76 113.589 -169.699 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 18.8 mt -64.01 -41.28 97.52 Favored 'General case' 0 CA--C 1.53 0.187 0 O-C-N 121.4 -0.813 . . . . 1.79 110.124 174.912 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 1.6 t 177.7 174.67 0.5 Allowed 'General case' 0 CA--C 1.534 0.337 0 C-N-CA 125.907 1.683 . . . . 1.64 107.67 -177.116 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 74.5 m -59.57 -31.5 69.49 Favored 'General case' 0 CA--C 1.529 0.166 0 O-C-N 121.584 -0.697 . . . . 1.83 110.472 166.935 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -64.65 -19.87 65.97 Favored 'General case' 0 CA--C 1.535 0.403 0 CA-C-N 118.066 0.394 . . . . 1.95 111.755 176.112 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -84.29 -11.9 77.21 Favored Glycine 0 N--CA 1.446 -0.642 0 CA-C-O 119.177 -0.791 . . . . 0.49 111.394 176.494 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 3.9 tmt_? -107.18 -13.85 15.05 Favored 'General case' 0 N--CA 1.455 -0.194 0 CA-C-N 118.29 1.045 . . . . 3.33 112.132 -178.106 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 1.1 p -62.73 -165.76 0.01 OUTLIER 'General case' 0 CA--C 1.538 0.501 0 C-N-CA 123.752 0.821 . . . . 1.81 110.162 164.987 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 14.6 m-20 -49.52 148.53 2.77 Favored 'General case' 0 CA--C 1.528 0.122 0 O-C-N 121.268 -0.895 . . . . 2.85 110.879 -178.679 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 60.4 tt0 -62.83 -27.86 69.61 Favored 'General case' 0 CA--C 1.533 0.322 0 CA-C-O 121.298 0.57 . . . . 2.64 111.117 -177.547 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -54.46 -40.43 68.42 Favored 'General case' 0 N--CA 1.455 -0.201 0 O-C-N 121.553 -0.717 . . . . 1.81 112.152 169.429 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 1.3 mt-10 -78.25 -39.37 40.39 Favored 'General case' 0 CA--C 1.507 -0.68 0 CA-C-O 118.418 -0.801 . . . . 2.85 110.022 -178.059 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 66' ' ' PHE . . . . . 0.425 ' CD1' ' HA2' ' A' ' 52' ' ' GLY . 56.5 t80 -51.47 -50.87 58.98 Favored 'General case' 0 N--CA 1.452 -0.354 0 C-N-CA 123.863 0.865 . . . . 0.52 111.354 171.735 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 79.1 t80 -62.89 -44.23 96.65 Favored 'General case' 0 CA--C 1.541 0.619 0 O-C-N 121.473 -0.767 . . . . 0.62 110.132 177.426 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -64.57 -55.54 19.79 Favored 'General case' 0 CA--C 1.537 0.448 0 N-CA-C 113.795 1.035 . . . . 1.5 113.795 -174.438 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -54.8 -39.44 68.47 Favored 'General case' 0 C--N 1.33 -0.244 0 O-C-N 120.665 -1.272 . . . . 3.85 111.404 169.047 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -59.02 -35.58 73.52 Favored 'General case' 0 CA--C 1.534 0.345 0 CA-C-N 119.63 1.104 . . . . 1.64 110.789 174.465 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -61.52 -53.33 57.87 Favored 'General case' 0 C--O 1.233 0.194 0 CA-C-N 119.085 0.857 . . . . 5.02 111.481 171.202 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 2.3 ttt180 -45.39 -64.53 0.7 Allowed 'General case' 0 CA--C 1.528 0.129 0 C-N-CA 123.202 0.601 . . . . 3.17 109.966 177.548 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -51.08 -53.51 33.4 Favored 'General case' 0 C--N 1.326 -0.448 0 C-N-CA 126.363 1.865 . . . . 1.64 110.063 -179.296 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -61.92 -30.15 70.7 Favored 'General case' 0 CA--C 1.535 0.37 0 O-C-N 121.742 -0.599 . . . . 3.66 112.238 -172.43 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 1.7 p80 -90.9 -18.71 24.3 Favored 'General case' 0 N--CA 1.463 0.201 0 CA-C-O 118.049 -0.977 . . . . 1.26 112.215 176.115 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 5.1 m -55.36 112.69 1.16 Allowed 'General case' 0 N--CA 1.446 -0.63 0 CA-C-N 119.82 1.191 . . . . 2.04 107.963 -173.989 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -44.74 -37.43 3.74 Favored 'General case' 0 C--N 1.325 -0.497 0 C-N-CA 125.684 1.593 . . . . 3.77 110.908 -178.051 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 19.1 t0 -55.33 99.23 0.03 OUTLIER 'General case' 0 N--CA 1.449 -0.493 0 CA-C-O 122.721 1.248 . . . . 2.14 111.439 168.348 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 14.2 p-80 -44.42 -36.73 3.01 Favored 'General case' 0 N--CA 1.449 -0.482 0 CA-C-N 114.467 -1.242 . . . . 6.07 112.558 171.251 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -63.23 -53.71 48.84 Favored 'General case' 0 N--CA 1.449 -0.507 0 CA-C-N 119.365 0.984 . . . . 1.61 110.746 -178.202 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -50.21 -44.37 53.16 Favored 'General case' 0 N--CA 1.465 0.276 0 CA-C-N 119.235 0.925 . . . . 3.56 109.525 178.287 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 44.0 mtp180 -62.59 -56.64 16.01 Favored 'General case' 0 N--CA 1.452 -0.327 0 CA-C-N 115.99 -0.55 . . . . 3.66 110.576 -177.812 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 1.1 mm? -63.72 -17.81 63.38 Favored 'General case' 0 N--CA 1.448 -0.538 0 C-N-CA 123.516 0.727 . . . . 1.66 112.634 179.491 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 45.5 mttt -70.09 -45.64 66.55 Favored 'General case' 0 CA--C 1.511 -0.552 0 CA-C-N 119.835 1.198 . . . . 1.91 108.567 170.51 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 57.2 t -54.28 -51.52 47.38 Favored 'Isoleucine or valine' 0 C--O 1.214 -0.791 0 C-N-CA 119.538 -0.865 . . . . 1.98 109.241 170.062 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 4.2 tm0? -67.06 -51.59 52.71 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 119.583 1.083 . . . . 3.53 111.927 -167.598 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 7.8 ttmm -55.38 -44.81 76.45 Favored 'General case' 0 C--N 1.331 -0.22 0 C-N-CA 124.651 1.18 . . . . 3.47 110.828 175.427 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 15.9 m-20 -77.63 -22.45 50.72 Favored 'General case' 0 CA--C 1.532 0.266 0 C-N-CA 122.732 0.413 . . . . 1.41 111.458 -177.068 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -155.9 69.7 5.14 Favored Pre-proline 0 C--O 1.238 0.459 0 C-N-CA 125.492 1.517 . . . . 1.35 109.365 -165.367 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 30.8 Cg_endo -61.22 -34.82 87.83 Favored 'Trans proline' 0 N--CA 1.449 -1.126 0 C-N-CA 121.873 1.716 . . . . 2.2 109.911 -175.388 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 11.1 tttt -79.45 -44.05 22.1 Favored 'General case' 0 N--CA 1.448 -0.545 0 C-N-CA 124.974 1.31 . . . . 5.57 110.414 -174.375 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 7.2 m -58.16 -47.4 83.49 Favored 'General case' 0 N--CA 1.464 0.269 0 CA-C-N 119.217 0.917 . . . . 1.67 108.983 176.384 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 12.9 t80 -59.59 -45.39 92.01 Favored 'General case' 0 CA--C 1.501 -0.931 0 O-C-N 122.018 -0.426 . . . . 3.09 111.543 -178.265 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 46.8 tt0 -48.99 -44.26 40.97 Favored 'General case' 0 N--CA 1.443 -0.795 0 O-C-N 124.332 1.02 . . . . 3.64 109.333 176.511 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 4.0 t80 -61.99 -54.31 43.46 Favored 'General case' 0 CA--C 1.529 0.148 0 N-CA-C 109.695 -0.483 . . . . 1.99 109.695 -177.378 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 34.8 mm -59.72 -29.41 42.77 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.199 0 C-N-CA 123.518 0.727 . . . . 2.95 111.512 -178.361 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -78.36 -33.89 48.71 Favored 'General case' 0 N--CA 1.453 -0.282 0 O-C-N 121.195 -0.941 . . . . 2.59 110.324 178.863 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 CA--C 1.53 0.199 0 C-N-CA 124.747 1.219 . . . . 2.13 108.799 177.404 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 72.8 t80 . . . . . 0 N--CA 1.455 -0.22 0 CA-C-O 121.497 0.665 . . . . 3.66 110.31 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER -66.29 -28.95 45.1 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.259 0 O-C-N 121.177 -0.952 . . . . 2.25 112.745 179.105 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 1.6 t-160 -58.82 -53.76 54.75 Favored 'General case' 0 C--N 1.342 0.248 0 N-CA-C 105.938 -1.875 . . . . 0.8 105.938 174.607 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 7.4 mt-10 -53.74 -43.01 68.77 Favored 'General case' 0 C--O 1.223 -0.308 0 CA-C-O 118.824 -0.607 . . . . 2.56 111.175 177.208 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 7.2 t80 -56.83 -44.94 82.58 Favored 'General case' 0 C--N 1.333 -0.137 0 CA-C-N 119.156 0.889 . . . . 3.32 111.228 178.498 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -51.49 -49.64 44.89 Favored Glycine 0 CA--C 1.524 0.645 0 N-CA-C 110.198 -1.161 . . . . 0.63 110.198 170.837 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 2.0 t60 -59.28 -44.46 92.47 Favored 'General case' 0 N--CA 1.45 -0.473 0 O-C-N 121.59 -0.947 . . . . 2.52 111.641 -178.72 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -61.29 -32.56 72.4 Favored 'General case' 0 N--CA 1.452 -0.343 0 CA-C-N 118.398 0.544 . . . . 1.58 109.849 178.212 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 3.5 t -67.16 -38.66 81.53 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.213 0 O-C-N 121.191 -0.943 . . . . 2.29 111.501 175.122 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 6.8 t0 . . . . . 0 C--N 1.333 -0.149 0 CA-C-O 120.9 0.381 . . . . 1.99 110.702 175.02 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 5.8 t70 . . . . . 0 N--CA 1.47 0.561 0 CA-C-O 121.344 0.592 . . . . 2.32 109.483 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 47' ' ' ILE . . . . . 0.457 ' HA ' ' HE2' ' A' ' 91' ' ' LYS . 3.4 mm -50.99 -52.0 19.13 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.238 0 C-N-CA 124.989 1.316 . . . . 1.72 107.989 -179.967 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 28.5 t80 -61.82 -36.18 80.41 Favored 'General case' 0 N--CA 1.45 -0.469 0 C-N-CA 124.852 1.261 . . . . 0.45 113.665 173.845 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . 0.409 ' HA ' ' HE2' ' A' ' 49' ' ' LYS . 1.0 OUTLIER -59.54 -49.15 78.91 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 120.025 1.284 . . . . 1.94 110.926 -175.23 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 9.5 mm-40 -81.94 -64.02 1.27 Allowed 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 121.902 0.858 . . . . 2.7 109.302 178.708 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 25.6 mm-40 -75.04 -24.05 58.24 Favored 'General case' 0 C--O 1.235 0.341 0 O-C-N 121.703 -0.623 . . . . 2.82 111.208 -164.933 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -72.79 45.2 1.05 Allowed Glycine 0 N--CA 1.442 -0.956 0 C-N-CA 124.622 1.106 . . . . 0.37 112.551 168.716 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 22.2 t -153.2 32.9 0.47 Allowed 'General case' 0 N--CA 1.449 -0.492 0 O-C-N 121.147 -1.208 . . . . 3.08 109.058 151.89 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 2.2 t-20 -133.71 -45.56 0.81 Allowed 'General case' 0 CA--C 1.521 -0.171 0 CA-C-O 120.638 0.256 . . . . 2.5 111.276 -168.433 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 21.2 mt -59.86 -37.22 78.69 Favored 'General case' 0 CA--C 1.529 0.147 0 O-C-N 122.128 -0.357 . . . . 1.59 111.273 -177.275 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER 178.27 173.15 0.66 Allowed 'General case' 0 CA--C 1.533 0.294 0 C-N-CA 126.031 1.733 . . . . 1.74 107.171 -177.889 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 15.5 m -61.94 -35.08 77.38 Favored 'General case' 0 N--CA 1.455 -0.188 0 O-C-N 121.6 -0.687 . . . . 1.44 110.719 169.178 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 1.1 m-85 -69.31 -8.05 42.68 Favored 'General case' 0 N--CA 1.467 0.401 0 O-C-N 121.804 -0.56 . . . . 1.67 112.096 172.32 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -80.65 -18.39 70.77 Favored Glycine 0 N--CA 1.445 -0.72 0 N-CA-C 110.693 -0.963 . . . . 0.45 110.693 170.544 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -104.09 -16.34 15.3 Favored 'General case' 0 CA--C 1.518 -0.254 0 CA-C-N 118.719 1.259 . . . . 3.43 113.128 -176.132 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 41.6 p -64.43 -161.17 0.01 OUTLIER 'General case' 0 CA--C 1.539 0.535 0 N-CA-C 108.972 -0.751 . . . . 1.77 108.972 169.925 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 39.6 m-80 -51.47 145.53 8.57 Favored 'General case' 0 CA--C 1.53 0.21 0 O-C-N 120.369 -1.457 . . . . 2.74 111.011 -176.867 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 47.4 tt0 -60.21 -19.37 53.98 Favored 'General case' 0 CA--C 1.541 0.623 0 C-N-CA 124.223 1.009 . . . . 2.95 111.938 -177.703 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -61.24 -47.92 83.84 Favored 'General case' 0 N--CA 1.453 -0.315 0 C-N-CA 125.973 1.709 . . . . 1.61 112.022 168.688 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 5.2 mt-10 -70.39 -42.23 71.99 Favored 'General case' 0 CA--C 1.51 -0.587 0 O-C-N 121.548 -0.72 . . . . 1.7 111.036 177.935 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 63.6 t80 -45.89 -53.26 10.12 Favored 'General case' 0 N--CA 1.45 -0.45 0 C-N-CA 123.397 0.679 . . . . 0.46 110.896 172.385 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 82.0 t80 -64.35 -41.14 96.9 Favored 'General case' 0 CA--C 1.534 0.332 0 O-C-N 122.131 -0.356 . . . . 1.28 111.62 176.523 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -61.38 -50.56 72.4 Favored 'General case' 0 CA--C 1.537 0.462 0 O-C-N 121.022 -1.049 . . . . 1.56 111.262 -174.935 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 5.4 mm-40 -53.69 -43.71 69.17 Favored 'General case' 0 CA--C 1.521 -0.157 0 C-N-CA 124.653 1.181 . . . . 4.17 110.466 168.524 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -55.87 -39.93 72.22 Favored 'General case' 0 N--CA 1.453 -0.3 0 CA-C-N 118.487 0.585 . . . . 1.74 110.214 179.437 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 2.7 t80 -65.04 -51.59 60.64 Favored 'General case' 0 CA--C 1.53 0.2 0 CA-C-N 119.239 0.927 . . . . 3.34 110.921 175.247 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 12.5 ttt180 -43.72 -56.87 3.52 Favored 'General case' 0 N--CA 1.469 0.499 0 C-N-CA 123.849 0.86 . . . . 3.41 110.558 177.134 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -59.67 -52.91 63.5 Favored 'General case' 0 N--CA 1.452 -0.371 0 C-N-CA 125.664 1.585 . . . . 1.85 109.819 179.679 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 0.6 OUTLIER -58.26 -37.57 75.22 Favored 'General case' 0 CA--C 1.531 0.22 0 CA-C-N 118.94 0.791 . . . . 3.46 111.899 -171.667 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 2.6 p80 -85.49 -14.9 44.59 Favored 'General case' 0 N--CA 1.461 0.091 0 CA-C-O 118.356 -0.83 . . . . 1.6 111.735 -179.849 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 1.1 t -56.5 117.05 3.48 Favored 'General case' 0 N--CA 1.443 -0.809 0 N-CA-C 106.616 -1.624 . . . . 2.45 106.616 -174.65 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -53.39 -32.83 51.31 Favored 'General case' 0 C--N 1.319 -0.757 0 CA-C-N 115.351 -0.84 . . . . 3.72 110.997 -178.838 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 24.4 t0 -55.51 106.26 0.23 Allowed 'General case' 0 N--CA 1.447 -0.584 0 CA-C-O 122.73 1.252 . . . . 2.03 110.247 165.312 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 32.7 m80 -63.12 -29.31 70.7 Favored 'General case' 0 N--CA 1.449 -0.514 0 CA-C-N 115.151 -0.931 . . . . 6.82 110.189 178.985 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -59.81 -56.69 18.66 Favored 'General case' 0 N--CA 1.448 -0.557 0 CA-C-N 119.093 0.86 . . . . 1.63 109.714 177.323 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -43.47 -47.62 7.13 Favored 'General case' 0 C--O 1.232 0.15 0 C-N-CA 124.98 1.312 . . . . 2.78 110.778 179.13 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 35.8 mtp180 -63.83 -54.14 39.64 Favored 'General case' 0 N--CA 1.451 -0.407 0 CA-C-N 114.857 -1.065 . . . . 3.1 110.036 -177.721 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -63.35 -17.67 62.84 Favored 'General case' 0 N--CA 1.45 -0.46 0 CA-C-O 117.97 -1.014 . . . . 2.1 112.603 176.439 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 2.0 mptm? -66.39 -46.64 75.93 Favored 'General case' 0 CA--C 1.516 -0.329 0 CA-C-N 121.29 1.859 . . . . 2.2 107.731 169.066 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 56.4 t -56.36 -50.93 69.62 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.657 0 CA-C-O 117.607 -1.187 . . . . 2.12 109.822 174.7 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 1.9 mt-30 -59.12 -57.23 13.96 Favored 'General case' 0 N--CA 1.466 0.374 0 CA-C-N 121.475 1.943 . . . . 2.85 112.304 -178.684 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 11.4 tttm -57.25 -38.27 73.6 Favored 'General case' 0 C--N 1.329 -0.292 0 C-N-CA 123.41 0.684 . . . . 3.32 111.602 -175.116 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 17.0 m-80 -84.51 -20.88 30.92 Favored 'General case' 0 C--O 1.222 -0.372 0 CA-C-O 118.476 -0.774 . . . . 3.12 110.705 179.387 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -144.68 81.48 10.93 Favored Pre-proline 0 C--O 1.237 0.403 0 C-N-CA 125.417 1.487 . . . . 1.33 109.907 -174.152 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 84.5 Cg_endo -78.53 35.35 0.54 Allowed 'Trans proline' 0 CA--C 1.54 0.805 0 C-N-CA 123.509 2.806 . . . . 1.82 112.476 -175.205 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 91' ' ' LYS . . . . . 0.457 ' HE2' ' HA ' ' A' ' 47' ' ' ILE . 14.4 ptmt -149.87 -52.41 0.15 Allowed 'General case' 0 N--CA 1.454 -0.232 0 C-N-CA 125.72 1.608 . . . . 3.71 109.628 -179.655 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 3.3 m -50.36 -47.21 56.17 Favored 'General case' 0 N--CA 1.462 0.149 0 O-C-N 121.419 -0.801 . . . . 1.7 111.379 178.2 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 16.6 t80 -58.64 -49.28 78.12 Favored 'General case' 0 CA--C 1.508 -0.659 0 C-N-CA 120.277 -0.569 . . . . 3.03 112.095 -177.901 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 39.8 tt0 -53.02 -36.57 60.66 Favored 'General case' 0 N--CA 1.446 -0.647 0 CA-C-N 115.115 -0.948 . . . . 1.81 109.507 -179.88 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -60.61 -59.87 4.7 Favored 'General case' 0 N--CA 1.45 -0.43 0 C-N-CA 123.296 0.639 . . . . 1.47 109.424 -178.455 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 23.4 mm -47.98 -46.59 12.61 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.249 0 C-N-CA 124.01 0.924 . . . . 2.89 110.428 175.728 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 1.4 t30 -61.21 -35.29 76.81 Favored 'General case' 0 CA--C 1.53 0.186 0 C-N-CA 123.413 0.685 . . . . 2.0 111.175 -176.969 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 35.7 t0 . . . . . 0 CA--C 1.52 -0.2 0 C-N-CA 124.152 0.981 . . . . 2.14 108.855 174.919 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 25.5 t80 . . . . . 0 N--CA 1.454 -0.239 0 CA-C-O 121.143 0.497 . . . . 3.43 111.487 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 0.7 OUTLIER -66.02 -32.34 57.68 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.217 0 O-C-N 121.232 -0.918 . . . . 1.48 111.934 179.001 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 3.4 t60 -58.4 -52.28 66.29 Favored 'General case' 0 C--N 1.342 0.279 0 N-CA-C 106.993 -1.484 . . . . 0.72 106.993 176.064 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 44.7 mt-10 -57.47 -41.49 80.74 Favored 'General case' 0 N--CA 1.454 -0.258 0 CA-C-O 118.69 -0.671 . . . . 2.01 111.108 179.298 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -51.66 -47.29 63.84 Favored 'General case' 0 N--CA 1.464 0.269 0 CA-C-N 119.126 0.875 . . . . 4.32 111.72 175.396 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -48.0 -49.91 22.61 Favored Glycine 0 CA--C 1.528 0.895 0 N-CA-C 110.482 -1.047 . . . . 0.46 110.482 174.328 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 1.7 t-160 -62.11 -40.64 96.59 Favored 'General case' 0 N--CA 1.451 -0.408 0 O-C-N 122.033 -0.687 . . . . 2.67 111.817 178.701 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -60.5 -32.5 71.5 Favored 'General case' 0 N--CA 1.454 -0.244 0 O-C-N 121.002 -1.061 . . . . 1.57 109.971 179.452 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 58.0 t -70.67 -34.43 56.84 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.222 0 O-C-N 121.293 -0.879 . . . . 1.82 111.142 178.041 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 80.0 m-20 . . . . . 0 N--CA 1.468 0.441 0 CA-C-N 118.744 0.702 . . . . 2.42 111.33 172.205 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 20.0 t70 . . . . . 0 N--CA 1.479 0.98 0 N-CA-C 112.517 0.562 . . . . 3.03 112.517 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 10.5 mm -38.05 -65.66 0.07 OUTLIER 'Isoleucine or valine' 0 N--CA 1.449 -0.521 0 C-N-CA 129.84 3.256 . . . . 1.71 109.912 173.453 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 24.2 t80 -64.74 -26.67 68.46 Favored 'General case' 0 N--CA 1.453 -0.3 0 O-C-N 120.98 -1.075 . . . . 0.52 112.363 179.775 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . 0.527 ' HA ' ' HE2' ' A' ' 49' ' ' LYS . 10.2 mmpt? -69.4 -47.79 63.1 Favored 'General case' 0 N--CA 1.452 -0.362 0 O-C-N 120.092 -1.63 . . . . 2.14 111.07 -176.195 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -89.31 -63.36 1.3 Allowed 'General case' 0 C--N 1.33 -0.274 0 N-CA-C 108.077 -1.082 . . . . 3.36 108.077 -177.721 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 7.8 mm-40 -67.16 -33.05 74.59 Favored 'General case' 0 CA--C 1.532 0.278 0 N-CA-C 109.193 -0.669 . . . . 2.2 109.193 -169.221 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -68.13 39.97 0.26 Allowed Glycine 0 CA--C 1.531 1.036 0 C-N-CA 125.836 1.684 . . . . 0.35 114.308 167.646 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 26.4 m -146.75 24.36 1.21 Allowed 'General case' 0 CA--C 1.533 0.29 0 O-C-N 120.771 -1.429 . . . . 3.02 110.66 154.026 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -131.14 -36.67 1.3 Allowed 'General case' 0 C--N 1.341 0.218 0 N-CA-C 113.283 0.845 . . . . 4.18 113.283 -170.81 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 32.7 mt -66.23 -35.47 80.52 Favored 'General case' 0 N--CA 1.465 0.281 0 CA-C-N 119.383 0.992 . . . . 1.99 110.876 -176.873 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 1.3 t 177.98 172.87 0.62 Allowed 'General case' 0 CA--C 1.531 0.246 0 C-N-CA 125.403 1.481 . . . . 1.71 107.837 -178.438 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 6.4 m -57.91 -34.98 70.41 Favored 'General case' 0 N--CA 1.452 -0.34 0 C-N-CA 123.364 0.666 . . . . 1.37 110.544 166.851 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -65.89 -16.54 63.94 Favored 'General case' 0 CA--C 1.534 0.349 0 N-CA-C 112.253 0.464 . . . . 1.56 112.253 175.312 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -85.29 -11.48 75.44 Favored Glycine 0 N--CA 1.444 -0.776 0 N-CA-C 110.786 -0.926 . . . . 0.41 110.786 175.334 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 4.5 tmt_? -105.81 -19.88 13.62 Favored 'General case' 0 C--O 1.228 -0.062 0 CA-C-N 119.025 1.412 . . . . 4.15 112.112 179.556 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 1.6 p -59.46 -164.12 0.01 OUTLIER 'General case' 0 CA--C 1.536 0.442 0 C-N-CA 124.998 1.319 . . . . 1.99 110.723 170.88 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 50.9 t30 -54.46 149.58 10.2 Favored 'General case' 0 CA--C 1.529 0.172 0 O-C-N 120.635 -1.29 . . . . 2.94 110.158 -176.429 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 14.8 tm-20 -56.85 -39.46 74.32 Favored 'General case' 0 C--O 1.222 -0.348 0 CA-C-O 120.995 0.426 . . . . 3.57 110.24 -173.492 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -56.83 -29.18 62.56 Favored 'General case' 0 C--N 1.328 -0.333 0 N-CA-C 113.421 0.897 . . . . 1.73 113.421 178.857 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 6.2 mt-10 -76.95 -42.87 37.39 Favored 'General case' 0 N--CA 1.452 -0.365 0 O-C-N 121.085 -1.009 . . . . 2.15 110.499 175.839 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 27.8 t80 -52.51 -49.63 64.4 Favored 'General case' 0 CA--C 1.532 0.261 0 C-N-CA 125.03 1.332 . . . . 0.34 111.299 172.585 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 47.8 t80 -64.65 -47.01 80.06 Favored 'General case' 0 CA--C 1.534 0.361 0 O-C-N 120.898 -1.126 . . . . 0.6 110.239 177.031 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -57.68 -56.14 25.73 Favored 'General case' 0 CA--C 1.536 0.412 0 O-C-N 121.243 -0.911 . . . . 1.48 111.927 -175.198 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -59.99 -34.0 72.74 Favored 'General case' 0 CA--C 1.53 0.208 0 C-N-CA 123.713 0.805 . . . . 3.7 111.7 174.384 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -56.27 -46.19 79.81 Favored 'General case' 0 C--O 1.221 -0.443 0 CA-C-N 119.155 0.889 . . . . 1.67 109.856 172.211 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 2.2 t80 -55.73 -49.02 74.18 Favored 'General case' 0 N--CA 1.463 0.202 0 CA-C-N 119.355 0.979 . . . . 4.35 111.371 179.539 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 32.6 ttt180 -47.93 -59.67 3.17 Favored 'General case' 0 N--CA 1.466 0.363 0 N-CA-C 109.419 -0.585 . . . . 2.96 109.419 174.04 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -63.1 -30.62 71.73 Favored 'General case' 0 C--N 1.33 -0.252 0 C-N-CA 124.594 1.158 . . . . 1.65 111.579 -175.043 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -62.92 -41.42 99.46 Favored 'General case' 0 C--N 1.328 -0.366 0 C-N-CA 124.416 1.086 . . . . 3.87 110.14 -175.282 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 7.9 p80 -95.81 -4.11 44.42 Favored 'General case' 0 N--CA 1.452 -0.342 0 CA-C-O 116.312 -1.804 . . . . 1.1 112.928 -179.19 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 3.2 m -37.73 125.74 1.15 Allowed 'General case' 0 CA--C 1.516 -0.336 0 CA-C-N 120.296 1.407 . . . . 1.66 111.645 -166.781 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -51.94 -40.57 61.02 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 113.418 -1.719 . . . . 1.91 109.38 178.987 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 14.6 t0 -72.19 110.44 6.64 Favored 'General case' 0 N--CA 1.446 -0.651 0 C-N-CA 119.357 -0.937 . . . . 1.82 109.448 163.793 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 1.8 p80 -47.44 -39.61 16.07 Favored 'General case' 0 N--CA 1.454 -0.246 0 CA-C-N 115.82 -0.627 . . . . 5.87 112.091 170.869 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -61.6 -48.3 81.56 Favored 'General case' 0 N--CA 1.452 -0.374 0 CA-C-N 118.127 0.422 . . . . 1.39 110.036 -174.873 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 32.1 mt-10 -48.17 -39.39 20.67 Favored 'General case' 0 N--CA 1.452 -0.368 0 C-N-CA 124.22 1.008 . . . . 2.75 111.644 176.588 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 4.8 mtp180 -65.64 -47.26 76.19 Favored 'General case' 0 C--N 1.326 -0.415 0 C-N-CA 119.604 -0.838 . . . . 3.59 108.878 179.545 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 1.5 mm? -61.79 -26.57 68.17 Favored 'General case' 0 N--CA 1.453 -0.285 0 CA-C-O 117.674 -1.155 . . . . 1.66 112.321 174.779 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -62.77 -42.05 99.51 Favored 'General case' 0 C--O 1.224 -0.257 0 CA-C-N 121.231 1.832 . . . . 2.04 108.329 172.773 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 56.0 t -63.41 -61.79 1.5 Allowed 'Isoleucine or valine' 0 C--O 1.22 -0.48 0 CA-C-O 117.425 -1.274 . . . . 1.5 111.148 173.273 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 3.9 mt-30 -49.33 -49.71 42.87 Favored 'General case' 0 N--CA 1.466 0.328 0 CA-C-N 121.024 1.738 . . . . 3.18 111.103 -175.258 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 37.1 tttt -56.85 -53.27 59.79 Favored 'General case' 0 N--CA 1.447 -0.606 0 C-N-CA 123.764 0.826 . . . . 2.58 111.192 178.243 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 56.1 m-20 -88.43 9.75 22.46 Favored 'General case' 0 C--N 1.332 -0.166 0 C-N-CA 122.696 0.398 . . . . 1.7 111.245 -172.986 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -164.82 68.91 1.39 Allowed Pre-proline 0 N--CA 1.446 -0.642 0 C-N-CA 124.52 1.128 . . . . 1.28 109.013 -177.385 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 93.0 Cg_endo -80.86 57.51 6.57 Favored 'Trans proline' 0 CA--C 1.535 0.535 0 C-N-CA 124.737 3.625 . . . . 2.09 111.939 -170.556 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 5.0 ptmt 174.72 -47.48 0.01 OUTLIER 'General case' 0 CA--C 1.533 0.315 0 C-N-CA 128.299 2.639 . . . . 3.09 109.847 -170.268 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 13.8 m -55.56 -45.81 77.25 Favored 'General case' 0 N--CA 1.465 0.321 0 O-C-N 121.093 -1.004 . . . . 1.7 111.067 176.627 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 29.4 t80 -55.16 -47.24 75.41 Favored 'General case' 0 CA--C 1.513 -0.462 0 CA-C-O 121.584 0.707 . . . . 3.25 110.595 176.684 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 4.3 mt-30 -57.49 -29.2 64.07 Favored 'General case' 0 N--CA 1.443 -0.783 0 CA-C-N 114.427 -1.26 . . . . 3.04 111.443 178.787 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 8.3 t80 -62.91 -55.29 27.37 Favored 'General case' 0 CA--C 1.528 0.119 0 CA-C-N 118.939 0.791 . . . . 1.52 110.093 -179.468 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 3.6 mp -61.2 -41.47 89.64 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.186 0 N-CA-C 108.34 -0.985 . . . . 2.23 108.34 177.121 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 7.0 t30 -58.93 -37.78 77.48 Favored 'General case' 0 CA--C 1.532 0.255 0 N-CA-C 111.884 0.327 . . . . 2.7 111.884 -178.125 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--N 1.333 -0.143 0 C-N-CA 125.729 1.611 . . . . 2.73 109.04 175.045 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 8.5 t80 . . . . . 0 N--CA 1.452 -0.345 0 CA-C-O 120.756 0.312 . . . . 3.82 111.122 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 0.5 OUTLIER -67.47 -33.69 63.92 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.314 0 O-C-N 121.538 -0.726 . . . . 1.59 112.205 -179.597 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 8.2 t60 -62.21 -55.89 24.06 Favored 'General case' 0 CA--C 1.53 0.183 0 N-CA-C 107.351 -1.351 . . . . 0.71 107.351 179.558 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 41.6 mt-10 -55.03 -39.33 69.03 Favored 'General case' 0 N--CA 1.449 -0.493 0 C-N-CA 126.051 1.74 . . . . 2.32 110.823 178.222 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 36.4 t80 -56.69 -52.41 65.03 Favored 'General case' 0 C--N 1.333 -0.144 0 CA-C-N 119.222 0.919 . . . . 4.16 109.813 175.828 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -48.15 -45.61 27.17 Favored Glycine 0 CA--C 1.526 0.756 0 N-CA-C 111.498 -0.641 . . . . 0.6 111.498 172.375 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 3.0 t60 -61.67 -49.96 74.42 Favored 'General case' 0 N--CA 1.448 -0.56 0 O-C-N 121.631 -0.923 . . . . 2.7 111.456 -179.68 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -59.83 -31.7 69.97 Favored 'General case' 0 N--CA 1.449 -0.479 0 C-N-CA 123.825 0.85 . . . . 1.68 109.643 -176.592 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 93.3 t -62.88 -51.9 66.19 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.24 0 C-N-CA 120.309 -0.556 . . . . 1.77 109.844 177.409 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--N 1.328 -0.332 0 CA-C-N 116.361 -0.381 . . . . 3.15 111.376 179.072 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 6.8 m-20 . . . . . 0 N--CA 1.464 0.267 0 N-CA-C 108.374 -0.973 . . . . 3.25 108.374 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 11.9 mm -48.18 -52.97 6.64 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.243 0 C-N-CA 125.298 1.439 . . . . 1.65 109.292 -177.743 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 33.1 t80 -64.42 -33.98 77.14 Favored 'General case' 0 N--CA 1.449 -0.487 0 N-CA-C 112.821 0.674 . . . . 0.52 112.821 179.407 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . 0.518 ' HA ' ' HE2' ' A' ' 49' ' ' LYS . 9.4 mmpt? -67.85 -46.28 72.19 Favored 'General case' 0 C--N 1.331 -0.228 0 O-C-N 119.938 -1.726 . . . . 2.36 110.669 -177.994 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 11.8 mm-40 -82.27 -65.97 0.95 Allowed 'General case' 0 N--CA 1.452 -0.359 0 N-CA-C 108.429 -0.952 . . . . 3.93 108.429 -175.887 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 3.7 mm-40 -68.44 -35.37 77.51 Favored 'General case' 0 N--CA 1.451 -0.405 0 C-N-CA 123.935 0.894 . . . . 2.95 109.432 -169.567 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -67.29 38.23 0.21 Allowed Glycine 0 CA--C 1.532 1.136 0 C-N-CA 126.286 1.898 . . . . 0.47 114.035 170.231 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 60.6 p -146.62 22.43 1.29 Allowed 'General case' 0 N--CA 1.449 -0.503 0 O-C-N 120.342 -1.681 . . . . 2.85 112.07 159.747 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -127.29 -46.17 1.5 Allowed 'General case' 0 CA--C 1.518 -0.267 0 CA-C-O 118.936 -0.554 . . . . 4.24 111.62 -176.558 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 29.2 mt -57.13 -35.97 70.11 Favored 'General case' 0 N--CA 1.467 0.395 0 CA-C-N 118.802 0.728 . . . . 1.66 110.896 -169.187 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER 179.53 175.72 0.7 Allowed 'General case' 0 C--O 1.233 0.221 0 C-N-CA 125.508 1.523 . . . . 1.54 107.203 175.233 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 7.9 m -55.86 -32.66 63.84 Favored 'General case' 0 N--CA 1.452 -0.326 0 O-C-N 121.597 -0.689 . . . . 1.59 110.582 165.15 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -63.28 -26.77 68.93 Favored 'General case' 0 C--N 1.342 0.271 0 CA-C-O 121.142 0.496 . . . . 1.59 111.828 175.304 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -75.32 -8.83 84.09 Favored Glycine 0 N--CA 1.442 -0.958 0 CA-C-O 118.24 -1.311 . . . . 0.54 111.465 176.704 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 10.9 ttt-85 -113.06 -17.21 12.48 Favored 'General case' 0 CA--C 1.522 -0.097 0 CA-C-N 119.564 1.682 . . . . 3.64 112.579 -177.493 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -61.27 -168.14 0.01 OUTLIER 'General case' 0 CA--C 1.534 0.358 0 C-N-CA 123.537 0.735 . . . . 2.17 110.115 163.503 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -47.51 148.78 1.3 Allowed 'General case' 0 N--CA 1.464 0.244 0 O-C-N 121.561 -0.712 . . . . 2.89 111.665 -174.311 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 5.0 mt-10 -55.56 -30.26 60.46 Favored 'General case' 0 CA--C 1.534 0.361 0 CA-C-O 121.285 0.564 . . . . 4.68 110.759 -179.862 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -66.18 -35.08 79.53 Favored 'General case' 0 N--CA 1.453 -0.281 0 C-N-CA 124.044 0.938 . . . . 1.78 113.056 176.484 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 6.4 mt-10 -76.27 -41.37 49.14 Favored 'General case' 0 CA--C 1.516 -0.331 0 O-C-N 121.48 -0.763 . . . . 1.89 110.626 176.943 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 50.4 t80 -50.41 -51.85 42.71 Favored 'General case' 0 N--CA 1.451 -0.395 0 C-N-CA 124.441 1.097 . . . . 0.59 110.68 170.024 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 58.0 t80 -65.79 -46.63 77.98 Favored 'General case' 0 CA--C 1.537 0.457 0 O-C-N 121.34 -0.85 . . . . 0.73 110.824 -179.472 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -61.27 -48.97 78.96 Favored 'General case' 0 CA--C 1.535 0.392 0 O-C-N 121.195 -0.94 . . . . 1.73 112.045 -175.345 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -61.96 -37.54 85.14 Favored 'General case' 0 N--CA 1.454 -0.245 0 O-C-N 121.346 -0.846 . . . . 3.58 110.58 173.487 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -55.26 -42.79 73.97 Favored 'General case' 0 C--O 1.22 -0.472 0 CA-C-N 119.009 0.822 . . . . 1.55 109.979 175.329 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -55.8 -51.11 68.57 Favored 'General case' 0 N--CA 1.466 0.339 0 CA-C-N 119.263 0.938 . . . . 5.22 112.147 172.464 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 23.3 ttt180 -50.88 -57.14 9.23 Favored 'General case' 0 CA--C 1.535 0.374 0 N-CA-C 109.409 -0.589 . . . . 3.01 109.409 179.007 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -66.37 -28.42 68.64 Favored 'General case' 0 C--N 1.326 -0.423 0 C-N-CA 125.128 1.371 . . . . 1.77 111.686 -177.197 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 2.1 ttp -64.66 -36.45 84.32 Favored 'General case' 0 N--CA 1.452 -0.372 0 O-C-N 121.98 -0.45 . . . . 3.9 109.971 -178.832 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 26.2 p80 -88.04 -39.85 14.31 Favored 'General case' 0 N--CA 1.452 -0.369 0 CA-C-O 115.827 -2.035 . . . . 1.31 110.591 -178.977 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 21.9 m -5.51 113.37 0.01 OUTLIER 'General case' 0 C--N 1.346 0.443 0 C-N-CA 128.254 2.621 . . . . 1.72 114.361 -171.403 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 3.0 p -47.07 -44.61 21.09 Favored 'General case' 0 N--CA 1.451 -0.401 0 C-N-CA 124.975 1.31 . . . . 2.11 110.27 179.692 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 9.9 t0 -65.86 106.58 1.58 Allowed 'General case' 0 N--CA 1.449 -0.482 0 CA-C-O 121.827 0.822 . . . . 1.91 109.141 166.105 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 54.8 m170 -57.11 -33.04 66.93 Favored 'General case' 0 N--CA 1.454 -0.27 0 CA-C-O 118.974 -0.536 . . . . 6.81 111.04 177.667 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -59.65 -46.74 88.1 Favored 'General case' 0 N--CA 1.45 -0.451 0 CA-C-N 118.713 0.688 . . . . 1.54 110.397 -179.743 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 5.7 mt-10 -48.71 -41.64 32.47 Favored 'General case' 0 C--O 1.232 0.148 0 C-N-CA 123.901 0.88 . . . . 2.68 111.008 176.952 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -64.37 -47.52 78.97 Favored 'General case' 0 C--N 1.329 -0.31 0 N-CA-C 108.518 -0.919 . . . . 4.14 108.518 179.123 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 1.3 mm? -64.99 -18.9 65.69 Favored 'General case' 0 N--CA 1.453 -0.285 0 CA-C-O 117.119 -1.419 . . . . 1.74 113.087 175.573 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -63.69 -49.83 71.61 Favored 'General case' 0 CA--C 1.519 -0.24 0 CA-C-N 122.077 2.217 . . . . 2.48 107.034 167.516 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 58.9 t -55.07 -41.33 58.75 Favored 'Isoleucine or valine' 0 C--O 1.214 -0.776 0 CA-C-O 118.486 -0.768 . . . . 1.74 110.846 175.747 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 2.2 tm0? -77.94 -47.61 18.2 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 120.434 1.47 . . . . 3.76 111.844 -171.027 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 20.8 ttmt -54.58 -49.29 70.75 Favored 'General case' 0 C--O 1.226 -0.137 0 O-C-N 121.6 -0.688 . . . . 3.26 109.905 175.721 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 17.2 m120 -72.73 -41.3 65.32 Favored 'General case' 0 C--O 1.225 -0.213 0 CA-C-O 119.703 -0.189 . . . . 3.37 111.159 -177.728 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -129.56 75.62 79.64 Favored Pre-proline 0 C--O 1.238 0.478 0 C-N-CA 125.832 1.653 . . . . 1.65 110.236 -173.509 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 27.2 Cg_endo -59.58 -33.28 96.92 Favored 'Trans proline' 0 N--CA 1.446 -1.284 0 C-N-CA 121.341 1.361 . . . . 2.02 110.288 -177.244 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 9.1 tttp -80.44 -51.6 8.63 Favored 'General case' 0 N--CA 1.45 -0.47 0 C-N-CA 125.177 1.391 . . . . 5.97 111.13 -173.524 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 5.7 m -54.19 -42.77 70.09 Favored 'General case' 0 N--CA 1.469 0.523 0 CA-C-N 119.378 0.99 . . . . 1.57 110.801 -179.53 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 21.0 t80 -57.52 -47.14 82.78 Favored 'General case' 0 CA--C 1.509 -0.626 0 CA-C-O 121.19 0.519 . . . . 3.22 111.644 179.32 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 21.0 tt0 -56.03 -36.18 67.71 Favored 'General case' 0 N--CA 1.443 -0.798 0 CA-C-N 115.02 -0.991 . . . . 2.27 109.929 178.993 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 9.1 t80 -66.45 -53.59 33.74 Favored 'General case' 0 N--CA 1.455 -0.187 0 C-N-CA 124.158 0.983 . . . . 1.28 110.275 -176.175 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 44.3 mm -59.4 -42.19 86.79 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.209 0 O-C-N 121.828 -0.545 . . . . 2.91 109.78 179.083 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 9.2 m-20 -58.36 -36.19 73.09 Favored 'General case' 0 CA--C 1.528 0.127 0 O-C-N 122.128 -0.357 . . . . 3.09 111.306 177.96 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 1.6 t0 . . . . . 0 CA--C 1.53 0.188 0 CA-C-O 121.963 0.887 . . . . 2.01 109.327 177.466 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 N--CA 1.458 -0.071 0 CA-C-O 121.666 0.746 . . . . 4.42 110.884 . . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER -67.09 -33.46 63.35 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.434 0 O-C-N 121.99 -0.443 . . . . 1.72 111.314 -176.733 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 3.7 t-160 -62.63 -52.95 61.35 Favored 'General case' 0 N--CA 1.45 -0.472 0 N-CA-C 107.584 -1.265 . . . . 1.52 107.584 -178.765 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 20.2 mt-10 -60.51 -34.51 74.19 Favored 'General case' 0 N--CA 1.45 -0.456 0 C-N-CA 124.244 1.018 . . . . 2.83 110.566 179.132 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -52.3 -54.03 36.61 Favored 'General case' 0 CA--C 1.517 -0.29 0 CA-C-N 119.288 0.949 . . . . 3.53 110.512 171.429 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -47.63 -50.29 19.63 Favored Glycine 0 C--N 1.336 0.535 0 N-CA-C 110.277 -1.129 . . . . 0.76 110.277 172.459 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 1.8 t-160 -62.26 -35.96 80.57 Favored 'General case' 0 N--CA 1.452 -0.341 0 O-C-N 121.918 -0.754 . . . . 2.88 112.676 -177.555 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -65.68 -32.2 73.64 Favored 'General case' 0 N--CA 1.45 -0.475 0 CA-C-N 119.068 0.849 . . . . 2.37 109.194 178.291 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 17.6 t -66.08 -38.64 82.46 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.239 0 C-N-CA 118.14 -1.424 . . . . 2.5 111.417 173.975 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 11.7 t70 . . . . . 0 N--CA 1.464 0.267 0 CA-C-O 121.863 0.84 . . . . 2.54 110.647 173.689 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 5.0 t70 . . . . . 0 N--CA 1.464 0.271 0 CA-C-O 122.327 1.061 . . . . 2.31 111.445 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 6.1 mm -58.6 -54.42 33.57 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.402 0 CA-C-N 115.046 -0.979 . . . . 1.96 108.547 179.14 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 28.8 t80 -60.9 -28.95 69.28 Favored 'General case' 0 C--O 1.226 -0.182 0 C-N-CA 124.967 1.307 . . . . 0.62 111.86 176.758 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . 0.417 ' CA ' ' HE2' ' A' ' 49' ' ' LYS . 0.1 OUTLIER -66.48 -46.86 74.88 Favored 'General case' 0 N--CA 1.453 -0.324 0 O-C-N 120.854 -1.154 . . . . 2.26 110.191 -172.643 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 6.4 tp10 -84.0 -57.72 3.08 Favored 'General case' 0 N--CA 1.451 -0.412 0 CA-C-O 121.903 0.859 . . . . 2.31 108.984 -179.712 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 20.6 mm-40 -82.62 -20.83 35.62 Favored 'General case' 0 C--O 1.234 0.279 0 O-C-N 121.631 -0.668 . . . . 2.65 111.385 -165.132 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -73.13 41.97 0.93 Allowed Glycine 0 CA--C 1.529 0.953 0 C-N-CA 124.729 1.157 . . . . 0.42 113.365 172.116 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 27.9 m -152.69 33.93 0.49 Allowed 'General case' 0 N--CA 1.453 -0.318 0 C-N-CA 126.57 1.948 . . . . 2.81 107.789 160.508 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 9.7 t-20 -144.73 -38.72 0.27 Allowed 'General case' 0 C--N 1.341 0.213 0 N-CA-C 113.242 0.83 . . . . 3.11 113.242 -161.928 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 16.2 mt -72.01 -38.59 69.58 Favored 'General case' 0 C--N 1.33 -0.257 0 O-C-N 122.236 -0.29 . . . . 1.78 110.947 179.167 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 4.4 t 171.03 172.72 0.07 Allowed 'General case' 0 N--CA 1.467 0.377 0 C-N-CA 125.579 1.551 . . . . 1.68 108.709 -171.412 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 7.6 m -61.56 -36.49 80.78 Favored 'General case' 0 N--CA 1.455 -0.224 0 C-N-CA 124.228 1.011 . . . . 1.81 111.037 172.587 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -65.86 -17.8 64.9 Favored 'General case' 0 CA--C 1.535 0.377 0 CA-C-N 118.107 0.412 . . . . 2.06 111.456 173.818 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -78.8 -12.81 83.79 Favored Glycine 0 N--CA 1.443 -0.85 0 CA-C-O 118.938 -0.923 . . . . 0.55 111.31 174.512 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 4.2 tmt_? -110.08 -15.6 13.99 Favored 'General case' 0 CA--C 1.523 -0.092 0 CA-C-N 119.149 1.475 . . . . 3.32 112.661 -176.946 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 1.3 p -61.8 -168.38 0.01 OUTLIER 'General case' 0 CA--C 1.537 0.447 0 C-N-CA 123.397 0.679 . . . . 1.74 109.798 162.332 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 9.7 m-20 -48.17 145.75 3.03 Favored 'General case' 0 N--CA 1.463 0.222 0 O-C-N 121.359 -0.838 . . . . 2.19 110.882 -177.95 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -50.51 -31.99 16.99 Favored 'General case' 0 CA--C 1.534 0.349 0 C-N-CA 123.99 0.916 . . . . 5.56 111.884 175.177 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -61.11 -42.06 97.83 Favored 'General case' 0 N--CA 1.451 -0.418 0 C-N-CA 124.263 1.025 . . . . 1.55 110.438 178.311 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 7.9 mt-10 -69.82 -45.26 68.24 Favored 'General case' 0 N--CA 1.448 -0.528 0 CA-C-O 117.921 -1.038 . . . . 1.89 110.477 177.073 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 35.7 t80 -51.45 -45.01 62.53 Favored 'General case' 0 CA--C 1.533 0.315 0 C-N-CA 126.041 1.737 . . . . 0.42 112.005 175.303 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 90.4 t80 -69.23 -45.81 68.87 Favored 'General case' 0 C--N 1.328 -0.349 0 O-C-N 120.859 -1.151 . . . . 0.58 109.847 178.267 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -65.02 -39.4 93.36 Favored 'General case' 0 CA--C 1.542 0.65 0 O-C-N 121.495 -0.753 . . . . 1.73 112.058 -174.806 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -72.15 -33.78 68.01 Favored 'General case' 0 C--N 1.333 -0.135 0 O-C-N 121.092 -1.005 . . . . 3.8 110.266 175.233 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -54.01 -42.42 69.06 Favored 'General case' 0 C--O 1.223 -0.313 0 CA-C-N 119.114 0.87 . . . . 1.5 110.419 171.706 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 47.4 t80 -56.65 -49.94 73.55 Favored 'General case' 0 N--CA 1.466 0.357 0 CA-C-N 119.954 1.252 . . . . 5.81 111.315 171.667 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -49.45 -58.77 4.55 Favored 'General case' 0 C--N 1.34 0.157 0 CA-C-N 118.649 0.659 . . . . 4.94 109.791 -179.98 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -63.78 -27.89 69.5 Favored 'General case' 0 N--CA 1.45 -0.454 0 C-N-CA 124.888 1.275 . . . . 1.6 110.997 -175.429 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 1.5 tmt? -68.64 -36.03 78.06 Favored 'General case' 0 N--CA 1.448 -0.558 0 C-N-CA 122.695 0.398 . . . . 3.43 111.725 -178.988 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 10.8 p80 -93.94 -10.6 33.23 Favored 'General case' 0 C--O 1.231 0.08 0 CA-C-O 117.384 -1.293 . . . . 1.41 113.169 -179.535 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 60.1 m -39.01 126.9 1.63 Allowed 'General case' 0 N--CA 1.449 -0.505 0 CA-C-O 123.028 1.394 . . . . 1.66 112.554 -169.488 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 4.1 p -53.53 -44.48 69.22 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 113.254 -1.793 . . . . 2.36 108.588 176.404 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 12.3 t0 -65.8 107.23 1.74 Allowed 'General case' 0 N--CA 1.447 -0.612 0 N-CA-C 108.717 -0.846 . . . . 2.37 108.717 167.151 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -55.9 -33.19 64.42 Favored 'General case' 0 N--CA 1.454 -0.267 0 CA-C-N 116.028 -0.533 . . . . 6.59 110.626 176.304 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -61.06 -49.51 77.06 Favored 'General case' 0 N--CA 1.447 -0.615 0 CA-C-O 118.205 -0.902 . . . . 1.61 110.323 -179.831 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 1.2 mt-10 -46.58 -42.56 16.2 Favored 'General case' 0 C--N 1.34 0.185 0 CA-C-N 119.263 0.938 . . . . 2.74 110.061 179.371 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 2.2 mtp180 -64.87 -54.0 37.89 Favored 'General case' 0 CA--C 1.517 -0.314 0 CA-C-N 115.714 -0.675 . . . . 4.03 109.556 -179.268 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 1.4 mm? -65.68 -17.33 64.52 Favored 'General case' 0 N--CA 1.452 -0.344 0 CA-C-O 117.774 -1.108 . . . . 1.72 112.774 179.89 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 2.5 mptm? -67.54 -48.12 67.9 Favored 'General case' 0 CA--C 1.517 -0.297 0 CA-C-N 121.175 1.807 . . . . 2.42 107.407 168.49 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 93.0 t -57.37 -45.62 85.38 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.692 0 C-N-CA 120.452 -0.499 . . . . 1.71 110.689 175.942 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -71.18 -48.76 49.78 Favored 'General case' 0 N--CA 1.45 -0.447 0 CA-C-N 119.667 1.122 . . . . 2.32 110.857 -172.487 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 51.2 tttt -55.41 -51.81 65.63 Favored 'General case' 0 N--CA 1.451 -0.384 0 C-N-CA 124.34 1.056 . . . . 3.45 110.506 177.92 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 12.2 m-20 -64.64 -40.42 95.42 Favored 'General case' 0 N--CA 1.454 -0.262 0 C-N-CA 123.174 0.59 . . . . 1.54 109.967 -179.813 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -137.83 74.21 45.23 Favored Pre-proline 0 C--O 1.238 0.498 0 C-N-CA 125.961 1.705 . . . . 1.79 111.173 -165.136 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 40.5 Cg_endo -64.24 -16.79 56.95 Favored 'Trans proline' 0 N--CA 1.453 -0.908 0 C-N-CA 122.315 2.01 . . . . 1.98 111.934 -175.547 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 22.5 pttt -95.48 -40.28 9.55 Favored 'General case' 0 CA--C 1.531 0.231 0 C-N-CA 123.203 0.601 . . . . 4.22 112.352 -179.125 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 3.3 m -62.46 -45.3 93.69 Favored 'General case' 0 CA--C 1.521 -0.135 0 O-C-N 120.739 -1.225 . . . . 1.6 110.628 -179.522 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 10.3 t80 -61.22 -45.37 94.86 Favored 'General case' 0 CA--C 1.508 -0.659 0 C-N-CA 119.965 -0.694 . . . . 2.96 110.946 -179.906 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 36.7 tt0 -53.88 -37.56 63.84 Favored 'General case' 0 N--CA 1.44 -0.938 0 CA-C-N 114.995 -1.002 . . . . 1.89 110.097 177.212 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 4.9 t80 -60.69 -56.99 14.67 Favored 'General case' 0 N--CA 1.453 -0.276 0 N-CA-C 109.135 -0.691 . . . . 1.44 109.135 -177.74 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 33.9 mm -53.4 -44.07 53.88 Favored 'Isoleucine or valine' 0 C--O 1.227 -0.118 0 O-C-N 121.992 -0.443 . . . . 2.98 110.201 178.05 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 14.7 t30 -62.36 -30.81 71.45 Favored 'General case' 0 CA--C 1.531 0.225 0 C-N-CA 122.886 0.474 . . . . 2.11 111.999 -178.075 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 26.9 t70 . . . . . 0 C--O 1.231 0.095 0 C-N-CA 123.124 0.57 . . . . 2.64 110.273 174.989 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 N--CA 1.454 -0.226 0 CA-C-O 122.038 0.923 . . . . 4.37 109.319 . . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 15' ' ' ILE . . . . . 0.42 HG13 ' CG ' ' A' ' 72' ' ' ARG . 0.7 OUTLIER -64.56 -32.28 57.15 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.302 0 O-C-N 121.334 -0.854 . . . . 1.68 111.768 177.807 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 5.0 t60 -59.96 -47.68 84.82 Favored 'General case' 0 CA--C 1.532 0.268 0 N-CA-C 107.828 -1.175 . . . . 0.76 107.828 176.353 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 20.3 mt-10 -60.8 -38.55 85.72 Favored 'General case' 0 N--CA 1.454 -0.248 0 C-N-CA 124.321 1.048 . . . . 2.59 110.157 179.527 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 1.3 t80 -53.07 -45.99 68.36 Favored 'General case' 0 C--N 1.332 -0.169 0 C-N-CA 123.155 0.582 . . . . 3.44 110.028 172.856 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -48.57 -50.3 25.16 Favored Glycine 0 CA--C 1.529 0.94 0 N-CA-C 111.473 -0.651 . . . . 0.57 111.473 171.923 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 40.6 m-70 -58.84 -50.49 73.78 Favored 'General case' 0 C--O 1.224 -0.247 0 O-C-N 121.148 -1.207 . . . . 4.73 112.205 176.931 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -59.78 -27.92 66.97 Favored 'General case' 0 N--CA 1.453 -0.286 0 CA-C-N 118.227 0.467 . . . . 1.72 110.854 -176.938 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 53.9 t -69.11 -45.18 80.26 Favored 'Isoleucine or valine' 0 C--O 1.232 0.153 0 O-C-N 121.208 -0.933 . . . . 1.77 109.935 174.042 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 1.9 t0 . . . . . 0 C--N 1.327 -0.38 0 C-N-CA 124.453 1.101 . . . . 1.86 111.78 178.0 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 4.5 t0 . . . . . 0 N--CA 1.473 0.714 0 N-CA-C 109.048 -0.723 . . . . 2.74 109.048 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 5.8 mm -53.75 -56.07 10.71 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.331 0 N-CA-C 108.108 -1.071 . . . . 1.52 108.108 -174.801 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 48' ' ' PHE . . . . . 0.437 ' CD2' ' HG2' ' A' ' 63' ' ' GLU . 29.2 t80 -57.73 -34.36 69.42 Favored 'General case' 0 N--CA 1.452 -0.364 0 N-CA-C 113.068 0.766 . . . . 0.45 113.068 174.21 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . 0.492 ' HA ' ' HE2' ' A' ' 49' ' ' LYS . 9.3 mmpt? -62.88 -48.33 79.46 Favored 'General case' 0 N--CA 1.454 -0.234 0 O-C-N 120.531 -1.355 . . . . 2.27 111.575 -172.465 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -88.32 -62.95 1.37 Allowed 'General case' 0 C--N 1.329 -0.316 0 N-CA-C 107.226 -1.398 . . . . 4.04 107.226 -177.806 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 13.9 mm-40 -66.21 -34.56 78.3 Favored 'General case' 0 C--O 1.235 0.31 0 CA-C-O 121.369 0.604 . . . . 2.48 109.869 -167.954 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -69.37 34.47 0.33 Allowed Glycine 0 CA--C 1.531 1.071 0 C-N-CA 125.447 1.498 . . . . 0.49 113.328 169.463 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 60.8 p -146.57 27.93 1.09 Allowed 'General case' 0 N--CA 1.451 -0.383 0 O-C-N 120.195 -1.768 . . . . 2.34 110.585 157.152 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 52.5 t-20 -134.48 -47.06 0.75 Allowed 'General case' 0 N--CA 1.453 -0.284 0 CA-C-O 120.725 0.298 . . . . 2.3 111.149 -165.83 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 14.5 mt -63.42 -35.06 79.18 Favored 'General case' 0 C--N 1.333 -0.142 0 O-C-N 121.865 -0.522 . . . . 1.81 111.125 -176.666 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 1.5 t 175.19 167.88 0.31 Allowed 'General case' 0 CA--C 1.531 0.237 0 C-N-CA 125.488 1.515 . . . . 1.61 108.148 -178.272 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 9.7 m -59.53 -33.63 71.63 Favored 'General case' 0 N--CA 1.453 -0.281 0 C-N-CA 123.44 0.696 . . . . 1.41 110.827 168.835 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -66.83 -14.23 62.46 Favored 'General case' 0 CA--C 1.535 0.377 0 C-N-CA 122.775 0.43 . . . . 2.95 111.672 175.842 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -90.26 -11.59 62.63 Favored Glycine 0 N--CA 1.445 -0.733 0 C-N-CA 124.415 1.007 . . . . 0.66 111.105 175.239 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -104.41 -13.93 15.91 Favored 'General case' 0 CA--C 1.521 -0.166 0 CA-C-N 118.711 1.255 . . . . 4.15 112.314 179.177 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 1.3 p -59.83 -173.1 0.02 OUTLIER 'General case' 0 CA--C 1.541 0.607 0 C-N-CA 123.205 0.602 . . . . 2.03 110.006 161.834 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 98.1 m-20 -49.59 153.05 1.24 Allowed 'General case' 0 N--CA 1.467 0.409 0 O-C-N 121.347 -0.846 . . . . 1.91 111.793 -172.8 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . 0.437 ' HG2' ' CD2' ' A' ' 48' ' ' PHE . 42.0 mt-10 -54.32 -34.24 60.59 Favored 'General case' 0 CA--C 1.533 0.321 0 O-C-N 122.299 -0.251 . . . . 3.13 111.34 -179.684 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -56.12 -39.36 72.11 Favored 'General case' 0 C--N 1.334 -0.078 0 O-C-N 121.552 -0.718 . . . . 1.72 112.558 176.058 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 1.8 mm-40 -80.19 -34.92 37.08 Favored 'General case' 0 CA--C 1.508 -0.65 0 CA-C-O 118.664 -0.684 . . . . 2.98 110.592 -178.203 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 62.7 t80 -55.15 -48.9 73.07 Favored 'General case' 0 N--CA 1.449 -0.51 0 C-N-CA 123.928 0.891 . . . . 0.63 111.13 170.929 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 82.5 t80 -63.13 -44.7 94.84 Favored 'General case' 0 CA--C 1.535 0.371 0 O-C-N 121.028 -1.045 . . . . 0.81 110.398 175.648 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -60.94 -52.53 64.65 Favored 'General case' 0 CA--C 1.539 0.543 0 O-C-N 121.077 -1.015 . . . . 1.71 112.58 -175.213 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 1.9 pp20? -63.41 -33.29 75.22 Favored 'General case' 0 C--N 1.331 -0.196 0 C-N-CA 124.426 1.09 . . . . 3.73 111.213 174.915 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -53.09 -58.74 5.99 Favored 'General case' 0 C--O 1.222 -0.37 0 CA-C-O 118.075 -0.964 . . . . 1.69 108.741 170.331 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 44.5 t80 -48.5 -48.01 38.33 Favored 'General case' 0 N--CA 1.468 0.445 0 CA-C-N 119.654 1.115 . . . . 3.33 112.01 179.454 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 72' ' ' ARG . . . . . 0.42 ' CG ' HG13 ' A' ' 15' ' ' ILE . 2.4 tmm_? -48.34 -51.46 26.11 Favored 'General case' 0 CA--C 1.539 0.522 0 C-N-CA 122.544 0.338 . . . . 4.38 110.238 176.331 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -75.7 -27.35 58.2 Favored 'General case' 0 C--O 1.225 -0.186 0 C-N-CA 124.5 1.12 . . . . 1.73 111.924 -176.711 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 34.0 mmt -58.52 -40.82 83.98 Favored 'General case' 0 CA--C 1.516 -0.349 0 CA-C-N 118.931 0.787 . . . . 6.77 109.627 -179.941 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 22.9 p80 -90.2 -39.6 12.71 Favored 'General case' 0 N--CA 1.449 -0.483 0 CA-C-O 115.815 -2.04 . . . . 1.1 110.758 -176.975 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 3.6 m -3.18 112.46 0.01 OUTLIER 'General case' 0 C--N 1.349 0.569 0 C-N-CA 128.156 2.582 . . . . 1.6 114.445 -172.636 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 2.6 p -46.64 -43.91 17.96 Favored 'General case' 0 N--CA 1.451 -0.396 0 C-N-CA 125.366 1.466 . . . . 1.81 110.836 178.713 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 61.9 t0 -72.35 108.1 5.29 Favored 'General case' 0 N--CA 1.453 -0.313 0 C-N-CA 119.055 -1.058 . . . . 1.91 108.629 167.708 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 92.8 m-70 -50.39 -34.08 22.99 Favored 'General case' 0 N--CA 1.453 -0.292 0 C-N-CA 123.478 0.711 . . . . 6.77 110.93 175.14 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -53.57 -48.94 68.71 Favored 'General case' 0 N--CA 1.45 -0.435 0 CA-C-O 119.205 -0.426 . . . . 1.47 111.039 176.659 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -56.17 -38.52 71.03 Favored 'General case' 0 CA--C 1.52 -0.188 0 CA-C-N 118.363 0.529 . . . . 3.74 110.641 -178.847 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -64.86 -50.32 67.08 Favored 'General case' 0 N--CA 1.452 -0.335 0 N-CA-C 109.068 -0.716 . . . . 4.26 109.068 179.111 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 1.2 mm? -65.11 -21.75 66.85 Favored 'General case' 0 N--CA 1.451 -0.378 0 CA-C-O 118.166 -0.921 . . . . 1.63 112.548 178.241 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 30.6 mttt -66.98 -46.62 74.05 Favored 'General case' 0 C--O 1.222 -0.387 0 N-CA-C 107.083 -1.451 . . . . 2.57 107.083 171.889 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 86.8 t -59.87 -43.32 91.76 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.688 0 C-N-CA 119.541 -0.864 . . . . 1.62 112.183 173.965 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 86' ' ' GLN . . . . . 0.42 ' HG2' ' CG ' ' A' ' 93' ' ' PHE . 1.4 mm-40 -67.76 -53.13 29.75 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 120.554 1.525 . . . . 2.79 110.735 -174.994 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 18.6 tttm -52.82 -50.47 63.62 Favored 'General case' 0 N--CA 1.453 -0.279 0 C-N-CA 125.148 1.379 . . . . 2.8 110.431 177.606 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 5.8 m-20 -67.27 -36.03 80.74 Favored 'General case' 0 N--CA 1.452 -0.327 0 CA-C-O 118.894 -0.574 . . . . 1.55 110.501 -179.034 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -141.06 80.8 16.65 Favored Pre-proline 0 C--O 1.238 0.491 0 C-N-CA 126.266 1.826 . . . . 1.31 110.968 -168.686 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 92.6 Cg_endo -80.26 37.97 0.71 Allowed 'Trans proline' 0 CA--C 1.541 0.837 0 C-N-CA 123.525 2.817 . . . . 1.53 111.974 -176.498 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 2.0 ptmt -155.51 -47.88 0.08 Allowed 'General case' 0 CA--C 1.531 0.225 0 C-N-CA 125.431 1.492 . . . . 3.48 110.079 -175.34 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 3.6 m -53.94 -45.21 71.19 Favored 'General case' 0 N--CA 1.463 0.187 0 O-C-N 121.041 -1.037 . . . . 1.66 110.323 171.957 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 93' ' ' PHE . . . . . 0.42 ' CG ' ' HG2' ' A' ' 86' ' ' GLN . 7.8 t80 -56.82 -47.92 79.16 Favored 'General case' 0 CA--C 1.505 -0.755 0 C-N-CA 120.281 -0.568 . . . . 3.8 111.396 178.582 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 56.3 tt0 -51.27 -35.67 38.47 Favored 'General case' 0 N--CA 1.447 -0.624 0 CA-C-N 115.533 -0.758 . . . . 2.64 110.655 179.934 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 9.0 t80 -55.68 -59.6 4.63 Favored 'General case' 0 CA--C 1.532 0.252 0 CA-C-N 118.534 0.606 . . . . 1.9 110.83 -176.907 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 3.8 mp -69.43 -32.86 54.77 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.202 0 O-C-N 121.624 -0.673 . . . . 2.06 109.297 -178.846 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 47.2 t30 -60.37 -31.78 70.66 Favored 'General case' 0 N--CA 1.453 -0.284 0 O-C-N 121.807 -0.558 . . . . 2.78 110.606 -179.243 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 N--CA 1.456 -0.126 0 C-N-CA 124.688 1.195 . . . . 2.18 108.67 171.15 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 28.2 t80 . . . . . 0 C--O 1.226 -0.172 0 N-CA-C 108.813 -0.81 . . . . 4.72 108.813 . . . . . . . . . 0 0 . 1 . 021 nuclear orig core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 0.5 OUTLIER -64.19 -32.51 57.72 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.229 0 CA-C-O 118.832 -0.604 . . . . 1.76 112.456 178.705 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 1.6 t-160 -55.47 -57.91 9.95 Favored 'General case' 0 C--N 1.342 0.261 0 N-CA-C 106.78 -1.563 . . . . 0.64 106.78 176.23 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 6.5 mt-10 -58.84 -36.35 74.41 Favored 'General case' 0 C--O 1.223 -0.307 0 C-N-CA 124.078 0.951 . . . . 3.06 110.624 -178.619 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 1.8 t80 -56.81 -51.33 69.38 Favored 'General case' 0 CA--C 1.521 -0.158 0 C-N-CA 124.075 0.95 . . . . 3.12 110.386 176.907 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -51.79 -45.15 55.49 Favored Glycine 0 CA--C 1.526 0.746 0 N-CA-C 110.309 -1.116 . . . . 0.72 110.309 175.681 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 2.7 t60 -62.35 -42.91 99.78 Favored 'General case' 0 N--CA 1.451 -0.384 0 O-C-N 122.075 -0.662 . . . . 2.56 111.401 179.445 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -65.42 -30.0 70.75 Favored 'General case' 0 N--CA 1.452 -0.339 0 O-C-N 121.242 -0.911 . . . . 1.85 110.02 179.175 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 71.2 t -71.92 -34.73 51.99 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.175 0 O-C-N 121.067 -1.021 . . . . 2.31 110.278 177.121 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 18.0 t70 . . . . . 0 C--O 1.233 0.203 0 CA-C-O 120.952 0.406 . . . . 1.84 111.581 172.787 . . . . . . . . 0 0 . 1 . 021 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 26.6 p-10 . . . . . 0 CA--C 1.533 0.322 0 CA-C-O 120.699 0.285 . . . . 3.94 110.584 . . . . . . . . . 0 0 . 1 . 021 nuclear orig core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 4.6 mm -55.7 -49.97 70.68 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.416 0 C-N-CA 127.316 2.246 . . . . 1.83 107.504 176.138 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 26.5 t80 -60.58 -36.63 79.0 Favored 'General case' 0 N--CA 1.449 -0.498 0 C-N-CA 123.874 0.87 . . . . 0.59 112.866 174.155 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . 0.483 ' HA ' ' HE2' ' A' ' 49' ' ' LYS . 10.2 mmpt? -62.61 -46.8 86.62 Favored 'General case' 0 CA--C 1.519 -0.248 0 C-N-CA 118.576 -1.25 . . . . 2.09 110.542 -173.41 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 4.6 tp10 -85.05 -64.76 1.1 Allowed 'General case' 0 N--CA 1.449 -0.479 0 CA-C-O 121.916 0.865 . . . . 2.43 108.669 -177.825 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 14.2 mm-40 -72.52 -29.58 63.72 Favored 'General case' 0 CA--C 1.533 0.324 0 O-C-N 121.609 -0.682 . . . . 2.54 110.331 -167.835 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -70.57 37.8 0.47 Allowed Glycine 0 CA--C 1.528 0.902 0 C-N-CA 125.844 1.688 . . . . 0.39 113.869 169.487 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 63.8 p -142.41 23.89 1.96 Allowed 'General case' 0 N--CA 1.447 -0.624 0 O-C-N 121.085 -1.244 . . . . 2.45 110.152 157.497 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -134.26 -39.45 0.83 Allowed 'General case' 0 C--N 1.341 0.209 0 N-CA-C 112.842 0.682 . . . . 2.56 112.842 -164.541 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 25.7 mt -65.91 -36.6 83.83 Favored 'General case' 0 N--CA 1.463 0.175 0 C-N-CA 120.118 -0.633 . . . . 1.61 110.495 -177.988 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER 178.23 169.65 0.77 Allowed 'General case' 0 CA--C 1.533 0.32 0 C-N-CA 125.622 1.569 . . . . 1.66 107.908 -178.762 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 16.4 m -59.19 -37.88 78.5 Favored 'General case' 0 CA--C 1.529 0.15 0 C-N-CA 124.026 0.93 . . . . 1.44 110.994 171.628 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -60.13 -32.92 71.46 Favored 'General case' 0 C--O 1.223 -0.34 0 C-N-CA 123.784 0.834 . . . . 1.73 109.175 172.53 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -64.06 -6.16 18.05 Favored Glycine 0 CA--C 1.524 0.594 0 O-C-N 121.196 -0.94 . . . . 0.49 112.442 176.46 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -121.57 0.88 10.0 Favored 'General case' 0 N--CA 1.454 -0.27 0 CA-C-N 119.01 1.405 . . . . 5.63 112.491 -177.49 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 58.9 p -73.92 -127.58 0.01 OUTLIER 'General case' 0 CA--C 1.534 0.359 0 N-CA-C 108.881 -0.785 . . . . 1.76 108.881 174.834 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 1.7 m120 -74.63 150.91 39.43 Favored 'General case' 0 CA--C 1.531 0.23 0 O-C-N 120.072 -1.642 . . . . 2.45 108.822 176.484 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 31.0 tt0 -62.41 -24.23 67.28 Favored 'General case' 0 CA--C 1.539 0.523 0 O-C-N 121.596 -0.69 . . . . 3.34 111.191 179.615 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -67.33 -33.89 76.19 Favored 'General case' 0 N--CA 1.454 -0.241 0 C-N-CA 124.15 0.98 . . . . 1.81 112.132 173.364 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 3.3 mt-10 -75.97 -49.61 17.22 Favored 'General case' 0 C--O 1.219 -0.525 0 N-CA-C 108.23 -1.026 . . . . 2.07 108.23 177.778 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 59.8 t80 -40.06 -51.31 2.59 Favored 'General case' 0 CA--C 1.537 0.464 0 C-N-CA 123.885 0.874 . . . . 0.45 111.874 170.932 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 62.9 t80 -60.82 -43.89 97.61 Favored 'General case' 0 CA--C 1.539 0.54 0 O-C-N 121.705 -0.622 . . . . 0.56 111.887 174.927 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -62.11 -52.07 65.34 Favored 'General case' 0 CA--C 1.535 0.368 0 C-N-CA 124.647 1.179 . . . . 1.58 112.352 -177.951 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 4.5 mp0 -57.29 -43.69 83.38 Favored 'General case' 0 CA--C 1.515 -0.402 0 O-C-N 121.075 -1.015 . . . . 4.46 109.89 172.56 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -57.49 -34.57 69.19 Favored 'General case' 0 N--CA 1.451 -0.396 0 CA-C-N 118.286 0.494 . . . . 1.61 110.421 -179.544 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -60.51 -55.67 30.58 Favored 'General case' 0 CA--C 1.534 0.363 0 C-N-CA 124.057 0.943 . . . . 4.2 111.385 169.917 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -48.92 -53.8 18.1 Favored 'General case' 0 CA--C 1.536 0.408 0 O-C-N 121.513 -0.742 . . . . 5.1 110.407 178.61 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -68.69 -49.16 61.14 Favored 'General case' 0 N--CA 1.449 -0.521 0 C-N-CA 126.465 1.906 . . . . 1.48 109.586 -171.509 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -63.16 -26.5 68.84 Favored 'General case' 0 CA--C 1.529 0.158 0 O-C-N 120.719 -1.238 . . . . 3.69 111.895 -178.506 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -91.23 -13.97 31.8 Favored 'General case' 0 C--N 1.338 0.106 0 CA-C-O 117.627 -1.177 . . . . 1.16 111.736 175.974 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 73.5 p -46.61 123.72 5.27 Favored 'General case' 0 N--CA 1.447 -0.585 0 CA-C-O 122.819 1.295 . . . . 2.91 108.611 -168.666 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -52.82 -39.75 62.7 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 113.604 -1.635 . . . . 2.24 109.206 -179.254 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 17.3 t0 -68.1 104.45 1.79 Allowed 'General case' 0 N--CA 1.444 -0.759 0 CA-C-O 122.411 1.1 . . . . 2.03 110.466 167.816 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 9.0 p-80 -39.46 -40.9 0.9 Allowed 'General case' 0 N--CA 1.453 -0.299 0 CA-C-N 114.904 -1.044 . . . . 5.75 113.362 168.609 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -65.15 -48.23 74.26 Favored 'General case' 0 N--CA 1.45 -0.469 0 CA-C-N 119.159 0.891 . . . . 1.43 110.273 -176.001 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 3.6 mt-10 -50.28 -38.14 39.65 Favored 'General case' 0 N--CA 1.454 -0.256 0 CA-C-N 118.884 0.766 . . . . 2.88 110.949 175.631 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 2.6 mtp180 -63.97 -52.51 59.32 Favored 'General case' 0 CA--C 1.516 -0.33 0 C-N-CA 119.156 -1.018 . . . . 3.3 109.733 177.8 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 1.3 mm? -60.19 -23.68 64.18 Favored 'General case' 0 N--CA 1.452 -0.356 0 CA-C-O 117.819 -1.086 . . . . 1.79 112.267 178.778 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 2.7 mptm? -61.46 -43.9 98.05 Favored 'General case' 0 C--O 1.224 -0.283 0 CA-C-N 120.811 1.641 . . . . 2.07 108.791 172.061 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 61.7 t -62.22 -61.83 1.44 Allowed 'Isoleucine or valine' 0 C--O 1.221 -0.431 0 CA-C-N 118.898 0.772 . . . . 1.72 109.745 171.321 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -55.12 -30.55 59.98 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 119.046 0.839 . . . . 3.65 113.073 -168.274 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 43.1 tttt -75.98 -60.17 2.44 Favored 'General case' 0 N--CA 1.451 -0.402 0 C-N-CA 125.526 1.531 . . . . 3.45 109.932 173.117 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 10.0 m-20 -76.79 6.51 5.96 Favored 'General case' 0 CA--C 1.533 0.303 0 C-N-CA 123.776 0.83 . . . . 1.47 111.917 -172.798 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -162.21 73.66 2.26 Favored Pre-proline 0 N--CA 1.445 -0.724 0 C-N-CA 125.657 1.583 . . . . 1.3 108.625 -176.85 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 68.7 Cg_endo -81.82 49.85 3.3 Favored 'Trans proline' 0 CA--C 1.539 0.749 0 C-N-CA 124.041 3.161 . . . . 2.04 111.513 -172.726 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 1.2 ptmt -175.01 -49.99 0.01 OUTLIER 'General case' 0 C--O 1.225 -0.229 0 C-N-CA 126.972 2.109 . . . . 3.16 109.407 -173.783 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 3.2 m -53.2 -41.97 65.83 Favored 'General case' 0 N--CA 1.462 0.163 0 O-C-N 121.293 -0.879 . . . . 1.54 111.448 176.694 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 34.2 t80 -57.88 -52.46 65.4 Favored 'General case' 0 CA--C 1.503 -0.854 0 C-N-CA 120.127 -0.629 . . . . 3.52 110.971 177.251 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 32.2 tt0 -53.22 -34.11 55.67 Favored 'General case' 0 N--CA 1.444 -0.764 0 CA-C-N 115.148 -0.933 . . . . 1.97 110.043 178.152 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 6.0 t80 -61.7 -58.13 9.23 Favored 'General case' 0 N--CA 1.451 -0.408 0 C-N-CA 123.138 0.575 . . . . 1.26 110.393 -176.711 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 4.2 mp -63.21 -33.87 63.58 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.195 0 O-C-N 120.912 -1.117 . . . . 1.91 109.695 176.912 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -60.89 -33.06 72.54 Favored 'General case' 0 CA--C 1.535 0.382 0 CA-C-N 118.814 0.734 . . . . 2.54 110.839 -178.592 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 28.0 t70 . . . . . 0 N--CA 1.464 0.257 0 C-N-CA 124.542 1.137 . . . . 2.98 110.009 172.794 . . . . . . . . 0 0 . 1 . 022 nuclear orig core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 1.1 t80 . . . . . 0 N--CA 1.455 -0.176 0 N-CA-C 109.139 -0.689 . . . . 3.81 109.139 . . . . . . . . . 0 0 . 1 . 022 nuclear orig core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 1.1 pt -62.11 -36.37 73.9 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.301 0 CA-C-O 119.12 -0.467 . . . . 1.65 112.057 175.625 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 3.5 t60 -58.25 -54.52 46.05 Favored 'General case' 0 CA--C 1.534 0.363 0 N-CA-C 107.286 -1.376 . . . . 0.6 107.286 176.99 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 5.6 mt-10 -50.14 -49.05 53.28 Favored 'General case' 0 C--O 1.224 -0.255 0 C-N-CA 124.755 1.222 . . . . 3.03 109.38 176.673 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -53.72 -47.98 70.05 Favored 'General case' 0 CA--C 1.518 -0.265 0 C-N-CA 124.829 1.252 . . . . 3.43 110.933 -178.931 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -49.06 -49.65 29.48 Favored Glycine 0 CA--C 1.524 0.617 0 N-CA-C 110.393 -1.083 . . . . 0.48 110.393 173.614 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 2.1 t-160 -61.33 -43.25 99.19 Favored 'General case' 0 N--CA 1.452 -0.331 0 O-C-N 121.901 -0.764 . . . . 2.75 111.413 178.041 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -61.94 -29.6 70.34 Favored 'General case' 0 N--CA 1.45 -0.464 0 O-C-N 120.909 -1.12 . . . . 1.57 110.396 -179.474 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 90.2 t -68.01 -41.11 84.25 Favored 'Isoleucine or valine' 0 CA--C 1.52 -0.201 0 O-C-N 121.332 -0.855 . . . . 1.91 110.07 174.594 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 17.0 t0 . . . . . 0 C--O 1.234 0.263 0 CA-C-O 121.779 0.8 . . . . 2.1 111.087 173.9 . . . . . . . . 0 0 . 1 . 022 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 2.9 t70 . . . . . 0 C--O 1.225 -0.203 0 N-CA-C 109.319 -0.623 . . . . 2.31 109.319 . . . . . . . . . 0 0 . 1 . 022 nuclear orig core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 7.9 mm -44.78 -57.19 0.75 Allowed 'Isoleucine or valine' 0 CA--C 1.539 0.53 0 C-N-CA 125.53 1.532 . . . . 1.92 109.075 169.799 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 18.0 t80 -60.2 -32.44 71.1 Favored 'General case' 0 C--O 1.222 -0.36 0 O-C-N 120.219 -1.551 . . . . 0.48 112.778 176.253 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . 0.488 ' HA ' ' HE2' ' A' ' 49' ' ' LYS . 7.0 mmpt? -66.17 -48.57 70.29 Favored 'General case' 0 C--N 1.327 -0.401 0 O-C-N 119.964 -1.71 . . . . 2.18 111.227 -177.259 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 6.2 tp10 -86.96 -62.96 1.39 Allowed 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 108.117 -1.068 . . . . 2.41 108.117 -175.162 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 29.8 mp0 -68.45 -30.3 69.13 Favored 'General case' 0 C--O 1.235 0.338 0 O-C-N 121.701 -0.624 . . . . 2.38 111.041 -173.361 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . 0.41 ' HA2' ' CD1' ' A' ' 66' ' ' PHE . . . -70.37 44.67 0.59 Allowed Glycine 0 CA--C 1.529 0.948 0 C-N-CA 125.154 1.359 . . . . 0.4 113.927 169.123 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 52.3 p -150.72 31.77 0.63 Allowed 'General case' 0 N--CA 1.448 -0.563 0 O-C-N 120.879 -1.365 . . . . 2.42 109.942 159.962 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 3.4 t-20 -143.85 -44.28 0.27 Allowed 'General case' 0 N--CA 1.454 -0.269 0 N-CA-C 112.4 0.519 . . . . 2.47 112.4 -166.151 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 15.4 mt -59.96 -35.62 75.36 Favored 'General case' 0 N--CA 1.464 0.235 0 O-C-N 122.324 -0.235 . . . . 1.59 111.124 -176.714 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER 178.15 171.61 0.7 Allowed 'General case' 0 CA--C 1.532 0.257 0 C-N-CA 126.148 1.779 . . . . 1.63 106.886 179.961 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 13.2 m -61.24 -35.15 76.47 Favored 'General case' 0 N--CA 1.455 -0.214 0 O-C-N 121.599 -0.688 . . . . 1.46 110.442 168.391 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -69.3 -4.06 16.51 Favored 'General case' 0 CA--C 1.535 0.383 0 N-CA-C 112.315 0.487 . . . . 1.75 112.315 173.182 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -93.73 -6.97 61.86 Favored Glycine 0 N--CA 1.446 -0.681 0 CA-C-O 118.771 -1.016 . . . . 0.54 111.084 173.131 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 54.1 ttt180 -111.15 -17.52 13.2 Favored 'General case' 0 C--O 1.23 0.076 0 CA-C-N 119.14 1.47 . . . . 4.23 111.832 179.555 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 21.7 p -61.56 -163.95 0.01 OUTLIER 'General case' 0 CA--C 1.54 0.57 0 C-N-CA 123.532 0.733 . . . . 1.98 109.73 167.976 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 2.8 m-20 -46.37 144.2 2.2 Favored 'General case' 0 CA--C 1.53 0.189 0 O-C-N 120.682 -1.262 . . . . 1.71 111.455 -176.951 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -55.38 -32.1 62.33 Favored 'General case' 0 CA--C 1.532 0.267 0 CA-C-O 121.811 0.815 . . . . 2.83 110.493 -179.604 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -59.1 -39.68 82.95 Favored 'General case' 0 N--CA 1.448 -0.572 0 C-N-CA 123.74 0.816 . . . . 1.89 112.382 176.538 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 9.3 mt-10 -71.81 -43.02 66.35 Favored 'General case' 0 C--O 1.223 -0.315 0 O-C-N 121.306 -0.871 . . . . 2.21 110.618 175.67 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 66' ' ' PHE . . . . . 0.41 ' CD1' ' HA2' ' A' ' 52' ' ' GLY . 53.3 t80 -50.01 -50.36 47.57 Favored 'General case' 0 CA--C 1.531 0.215 0 C-N-CA 123.524 0.73 . . . . 0.52 110.764 175.125 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 72.2 t80 -62.91 -45.05 94.33 Favored 'General case' 0 N--CA 1.451 -0.418 0 C-N-CA 123.738 0.815 . . . . 0.52 110.928 177.298 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -61.31 -48.89 79.29 Favored 'General case' 0 CA--C 1.537 0.455 0 O-C-N 121.078 -1.013 . . . . 1.54 111.464 -176.051 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 6.4 mm-40 -56.02 -44.12 78.41 Favored 'General case' 0 CA--C 1.515 -0.381 0 C-N-CA 124.244 1.018 . . . . 4.01 110.732 170.394 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -54.37 -43.71 71.59 Favored 'General case' 0 N--CA 1.451 -0.408 0 CA-C-O 118.662 -0.685 . . . . 1.46 109.423 -178.423 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 14.9 t80 -58.02 -52.28 66.19 Favored 'General case' 0 N--CA 1.463 0.188 0 C-N-CA 123.756 0.823 . . . . 3.22 111.995 171.849 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 4.0 tmm_? -47.14 -52.57 15.11 Favored 'General case' 0 N--CA 1.465 0.321 0 C-N-CA 123.592 0.757 . . . . 3.84 110.191 179.917 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -66.44 -37.96 86.34 Favored 'General case' 0 C--N 1.329 -0.298 0 C-N-CA 126.55 1.94 . . . . 1.74 111.003 178.297 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER -58.7 -37.57 76.38 Favored 'General case' 0 C--O 1.233 0.193 0 C-N-CA 123.385 0.674 . . . . 3.2 111.506 -172.093 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 10.0 p80 -95.43 -7.81 37.28 Favored 'General case' 0 CA--C 1.529 0.145 0 CA-C-O 116.395 -1.764 . . . . 1.25 113.503 -179.979 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 7.6 m -38.53 125.01 1.36 Allowed 'General case' 0 C--N 1.342 0.277 0 CA-C-N 120.413 1.461 . . . . 1.58 111.861 -167.006 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 2.7 p -51.94 -43.4 63.45 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 113.491 -1.686 . . . . 1.95 109.045 176.7 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 10.6 t0 -66.84 106.15 1.8 Allowed 'General case' 0 N--CA 1.448 -0.531 0 N-CA-C 108.565 -0.902 . . . . 1.97 108.565 164.132 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 5.0 t-80 -62.36 -25.47 67.93 Favored 'General case' 0 N--CA 1.454 -0.264 0 O-C-N 121.373 -0.829 . . . . 7.65 111.213 179.491 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -64.24 -43.76 93.94 Favored 'General case' 0 N--CA 1.452 -0.33 0 CA-C-N 118.988 0.813 . . . . 1.54 110.529 176.87 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 81' ' ' GLU . . . . . 0.493 ' HA ' ' HE3' ' A' ' 84' ' ' LYS . 7.5 mt-10 -49.77 -39.06 36.66 Favored 'General case' 0 CA--C 1.513 -0.451 0 C-N-CA 124.094 0.958 . . . . 2.6 111.521 176.738 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 8.4 mtp180 -62.61 -47.68 82.71 Favored 'General case' 0 C--N 1.325 -0.482 0 N-CA-C 108.707 -0.849 . . . . 3.43 108.707 177.765 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 1.6 mm? -64.81 -21.09 66.71 Favored 'General case' 0 N--CA 1.453 -0.316 0 CA-C-O 117.163 -1.398 . . . . 1.82 113.671 173.887 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 84' ' ' LYS . . . . . 0.493 ' HE3' ' HA ' ' A' ' 81' ' ' GLU . 0.0 OUTLIER -64.61 -43.52 93.48 Favored 'General case' 0 N--CA 1.463 0.202 0 CA-C-N 122.234 2.288 . . . . 3.67 107.594 170.053 . . . . . . . . 3 3 . 1 . 022 nuclear orig core ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 68.3 t -63.18 -59.23 4.69 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.603 0 CA-C-O 117.267 -1.349 . . . . 1.53 110.792 173.786 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 15.5 mt-30 -53.84 -44.15 70.05 Favored 'General case' 0 N--CA 1.465 0.286 0 CA-C-N 122.14 2.246 . . . . 2.28 112.29 -176.415 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 34.2 tttm -57.33 -48.24 79.48 Favored 'General case' 0 N--CA 1.449 -0.493 0 O-C-N 121.306 -0.871 . . . . 2.95 110.903 178.139 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 6.3 m-20 -90.12 -0.37 57.57 Favored 'General case' 0 C--N 1.328 -0.327 0 C-N-CA 122.584 0.353 . . . . 1.48 111.037 -174.635 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -168.48 57.62 0.35 Allowed Pre-proline 0 CA--C 1.536 0.418 0 C-N-CA 124.876 1.27 . . . . 1.76 109.764 -163.789 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 34.3 Cg_endo -61.12 -36.33 81.87 Favored 'Trans proline' 0 N--CA 1.455 -0.744 0 C-N-CA 121.87 1.713 . . . . 2.32 109.501 -174.302 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 2.6 ptpt -75.82 -44.85 39.07 Favored 'General case' 0 N--CA 1.449 -0.489 0 C-N-CA 124.498 1.119 . . . . 3.35 112.342 177.706 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 3.6 m -58.64 -45.13 89.95 Favored 'General case' 0 N--CA 1.463 0.178 0 CA-C-N 120.355 1.434 . . . . 1.52 110.675 -176.424 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 17.2 t80 -59.46 -49.53 77.44 Favored 'General case' 0 CA--C 1.508 -0.657 0 CA-C-O 120.99 0.424 . . . . 3.67 110.083 178.267 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 26.1 tt0 -57.79 -28.72 64.26 Favored 'General case' 0 N--CA 1.445 -0.713 0 CA-C-N 115.283 -0.871 . . . . 1.77 110.449 -178.64 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 8.7 t80 -64.37 -57.79 8.33 Favored 'General case' 0 N--CA 1.452 -0.348 0 C-N-CA 123.683 0.793 . . . . 1.62 110.445 -176.579 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 3.7 mp -58.05 -39.45 72.5 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.187 0 N-CA-C 108.894 -0.78 . . . . 1.99 108.894 174.79 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 14.4 t30 -62.6 -30.83 71.63 Favored 'General case' 0 CA--C 1.536 0.412 0 O-C-N 121.55 -0.719 . . . . 2.15 111.601 -178.869 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 2.1 t0 . . . . . 0 C--O 1.23 0.079 0 C-N-CA 125.306 1.442 . . . . 2.23 108.544 174.899 . . . . . . . . 0 0 . 1 . 023 nuclear orig core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 36.1 t80 . . . . . 0 CA--C 1.515 -0.4 0 N-CA-C 109.689 -0.485 . . . . 5.61 109.689 . . . . . . . . . 0 0 . 1 . 023 nuclear orig core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER -62.6 -36.22 74.07 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.32 0 O-C-N 122.064 -0.398 . . . . 1.59 111.815 -178.084 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 9.6 t60 -59.94 -55.49 33.43 Favored 'General case' 0 C--N 1.343 0.305 0 N-CA-C 107.168 -1.419 . . . . 0.65 107.168 176.715 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 43.6 mt-10 -58.7 -32.45 69.18 Favored 'General case' 0 N--CA 1.456 -0.173 0 C-N-CA 123.463 0.705 . . . . 1.96 112.251 -179.626 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 24.8 t80 -59.94 -40.75 90.03 Favored 'General case' 0 CA--C 1.517 -0.292 0 CA-C-N 118.797 0.726 . . . . 5.4 109.2 177.213 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -52.04 -46.98 55.5 Favored Glycine 0 CA--C 1.53 0.981 0 C-N-CA 120.622 -0.799 . . . . 0.67 111.452 170.583 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 42.3 m-70 -58.18 -47.11 84.44 Favored 'General case' 0 N--CA 1.464 0.262 0 CA-C-N 119.119 1.46 . . . . 5.14 111.384 176.121 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -59.43 -30.54 68.55 Favored 'General case' 0 N--CA 1.454 -0.267 0 O-C-N 122.105 -0.372 . . . . 1.96 110.943 -178.619 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 77.1 t -72.21 -42.33 66.51 Favored 'Isoleucine or valine' 0 C--O 1.232 0.146 0 O-C-N 121.205 -0.934 . . . . 2.12 110.5 177.581 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--N 1.329 -0.298 0 C-N-CA 123.195 0.598 . . . . 2.21 110.893 172.011 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 9.1 t70 . . . . . 0 CA--C 1.529 0.147 0 CA-C-O 121.36 0.6 . . . . 2.52 110.057 . . . . . . . . . 0 0 . 1 . 023 nuclear orig core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 3.6 mm -51.1 -59.65 1.19 Allowed 'Isoleucine or valine' 0 CA--C 1.535 0.396 0 C-N-CA 125.81 1.644 . . . . 1.67 109.321 -174.067 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 24.8 t80 -54.94 -34.67 63.44 Favored 'General case' 0 C--N 1.329 -0.316 0 O-C-N 121.365 -0.835 . . . . 0.56 112.558 177.878 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . 0.504 ' HA ' ' HE2' ' A' ' 49' ' ' LYS . 0.1 OUTLIER -65.59 -40.54 92.81 Favored 'General case' 0 N--CA 1.452 -0.356 0 O-C-N 120.365 -1.459 . . . . 2.09 111.581 -176.127 . . . . . . . . 3 3 . 1 . 023 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 4.9 tp10 -89.68 -65.78 0.98 Allowed 'General case' 0 N--CA 1.452 -0.362 0 N-CA-C 108.834 -0.802 . . . . 2.12 108.834 -178.719 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . 0.453 ' OE1' ' HE2' ' A' ' 91' ' ' LYS . 9.9 mp0 -68.49 -27.71 66.37 Favored 'General case' 0 C--O 1.234 0.285 0 O-C-N 121.478 -0.764 . . . . 3.09 111.109 -171.795 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . 0.422 ' HA2' ' CD1' ' A' ' 66' ' ' PHE . . . -67.99 37.29 0.24 Allowed Glycine 0 CA--C 1.53 1.01 0 C-N-CA 125.254 1.407 . . . . 0.36 114.018 169.81 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 59.6 p -146.62 20.77 1.32 Allowed 'General case' 0 N--CA 1.448 -0.559 0 O-C-N 120.695 -1.473 . . . . 2.71 111.485 159.996 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 46.8 t30 -130.93 -38.34 1.26 Allowed 'General case' 0 C--N 1.342 0.245 0 N-CA-C 112.954 0.724 . . . . 2.74 112.954 -165.227 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 22.9 mt -68.36 -36.23 78.91 Favored 'General case' 0 N--CA 1.463 0.198 0 O-C-N 121.434 -0.791 . . . . 1.76 110.615 -178.36 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 1.4 t 176.93 169.95 0.52 Allowed 'General case' 0 CA--C 1.53 0.189 0 C-N-CA 125.313 1.445 . . . . 1.64 108.043 -175.155 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 8.2 m -61.24 -31.3 71.09 Favored 'General case' 0 N--CA 1.453 -0.285 0 C-N-CA 123.466 0.707 . . . . 1.28 110.909 170.296 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -64.63 -23.13 67.16 Favored 'General case' 0 N--CA 1.464 0.237 0 CA-C-O 121.089 0.471 . . . . 1.59 111.253 173.269 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -74.51 -12.77 82.23 Favored Glycine 0 N--CA 1.443 -0.89 0 CA-C-O 118.722 -1.044 . . . . 0.53 111.313 175.156 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 60.0 ttt-85 -110.02 -16.01 13.92 Favored 'General case' 0 C--O 1.23 0.075 0 CA-C-N 119.177 1.489 . . . . 3.17 112.76 -177.623 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 1.5 p -60.71 -169.21 0.01 OUTLIER 'General case' 0 CA--C 1.536 0.436 0 C-N-CA 122.487 0.315 . . . . 2.12 110.281 166.645 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 5.3 m120 -45.92 147.29 1.02 Allowed 'General case' 0 C--N 1.341 0.211 0 O-C-N 121.346 -0.846 . . . . 2.43 111.065 179.606 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 14.1 tm-20 -61.44 -28.89 69.59 Favored 'General case' 0 CA--C 1.533 0.321 0 CA-C-O 120.649 0.261 . . . . 3.38 111.017 -173.999 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -52.36 -37.15 55.49 Favored 'General case' 0 CA--C 1.52 -0.203 0 N-CA-C 113.414 0.894 . . . . 1.67 113.414 171.854 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 2.3 mm-40 -84.89 -35.96 21.83 Favored 'General case' 0 C--N 1.322 -0.613 0 C-N-CA 124.468 1.107 . . . . 2.59 110.039 -173.84 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 66' ' ' PHE . . . . . 0.422 ' CD1' ' HA2' ' A' ' 52' ' ' GLY . 67.9 t80 -53.02 -50.47 64.2 Favored 'General case' 0 N--CA 1.453 -0.284 0 C-N-CA 124.403 1.081 . . . . 0.35 111.219 166.555 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 77.5 t80 -63.03 -48.14 80.03 Favored 'General case' 0 CA--C 1.535 0.375 0 O-C-N 121.237 -0.915 . . . . 0.45 110.432 178.424 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -61.66 -53.47 55.67 Favored 'General case' 0 CA--C 1.536 0.426 0 N-CA-C 114.106 1.151 . . . . 1.51 114.106 -176.524 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -58.81 -40.23 83.48 Favored 'General case' 0 C--N 1.329 -0.29 0 O-C-N 121.019 -1.051 . . . . 3.69 110.821 174.094 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -55.93 -42.04 75.51 Favored 'General case' 0 C--O 1.222 -0.35 0 CA-C-N 118.52 0.6 . . . . 1.93 110.326 174.258 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -54.56 -51.44 65.23 Favored 'General case' 0 N--CA 1.464 0.229 0 C-N-CA 123.943 0.897 . . . . 4.4 111.375 172.45 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 52.2 ttt-85 -51.96 -50.13 61.83 Favored 'General case' 0 N--CA 1.462 0.148 0 CA-C-N 117.918 0.326 . . . . 3.2 110.206 179.363 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -68.7 -30.81 69.55 Favored 'General case' 0 C--N 1.328 -0.351 0 C-N-CA 124.389 1.075 . . . . 1.96 110.938 -178.388 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 2.4 ttp -63.73 -34.54 78.1 Favored 'General case' 0 N--CA 1.454 -0.244 0 C-N-CA 123.267 0.627 . . . . 3.55 111.059 -174.614 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 10.0 p80 -99.21 1.46 44.85 Favored 'General case' 0 CA--C 1.531 0.227 0 CA-C-O 116.663 -1.637 . . . . 1.46 113.724 178.679 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 6.7 m -42.31 120.37 1.62 Allowed 'General case' 0 C--N 1.343 0.304 0 CA-C-N 120.573 1.533 . . . . 2.01 110.473 -171.843 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 2.7 p -48.34 -43.88 33.79 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 113.744 -1.571 . . . . 2.35 109.064 178.449 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 11.7 t0 -69.72 105.91 2.9 Favored 'General case' 0 N--CA 1.446 -0.652 0 CA-C-O 122.006 0.908 . . . . 1.99 109.291 163.942 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 49.4 p-80 -49.38 -38.4 28.46 Favored 'General case' 0 N--CA 1.453 -0.285 0 CA-C-N 115.476 -0.784 . . . . 5.48 111.98 173.605 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -61.52 -42.41 98.77 Favored 'General case' 0 C--N 1.331 -0.209 0 O-C-N 121.689 -0.632 . . . . 1.89 110.778 -177.741 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 18.7 mm-40 -53.77 -36.87 62.86 Favored 'General case' 0 N--CA 1.451 -0.424 0 C-N-CA 123.183 0.593 . . . . 4.41 111.964 175.429 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 14.6 mtp180 -65.06 -46.26 81.93 Favored 'General case' 0 C--N 1.325 -0.471 0 C-N-CA 119.022 -1.071 . . . . 3.17 108.683 176.861 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 1.6 mm? -62.29 -23.17 66.58 Favored 'General case' 0 N--CA 1.455 -0.195 0 CA-C-O 117.724 -1.132 . . . . 1.49 112.909 175.88 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 2.4 mptm? -60.98 -46.15 91.93 Favored 'General case' 0 CA--C 1.516 -0.329 0 CA-C-N 120.922 1.692 . . . . 2.46 108.18 169.891 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 90.3 t -62.12 -61.08 1.79 Allowed 'Isoleucine or valine' 0 N--CA 1.45 -0.463 0 CA-C-O 118.141 -0.933 . . . . 1.81 109.951 176.448 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 2.5 mt-30 -50.03 -49.67 50.16 Favored 'General case' 0 CA--C 1.53 0.183 0 CA-C-N 119.842 1.201 . . . . 2.44 111.88 -173.058 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 13.2 ptpt -65.99 -40.37 91.12 Favored 'General case' 0 N--CA 1.456 -0.157 0 O-C-N 121.896 -0.503 . . . . 5.27 111.055 -176.227 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 52.1 m-20 -79.43 -10.78 59.88 Favored 'General case' 0 N--CA 1.461 0.105 0 N-CA-C 112.051 0.389 . . . . 2.5 112.051 -179.694 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -155.7 71.48 5.38 Favored Pre-proline 0 N--CA 1.446 -0.64 0 C-N-CA 124.409 1.084 . . . . 1.64 109.413 -170.568 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 76.5 Cg_endo -81.13 60.49 7.85 Favored 'Trans proline' 0 N--CA 1.459 -0.552 0 C-N-CA 124.506 3.471 . . . . 1.7 110.822 -173.769 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 91' ' ' LYS . . . . . 0.453 ' HE2' ' OE1' ' A' ' 51' ' ' GLU . 5.4 ptmt 175.03 -51.52 0.01 OUTLIER 'General case' 0 C--O 1.224 -0.287 0 C-N-CA 126.986 2.114 . . . . 2.79 109.716 -170.202 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 2.9 m -57.34 -44.93 84.67 Favored 'General case' 0 CA--C 1.522 -0.116 0 CA-C-N 119.286 0.948 . . . . 1.58 110.245 176.946 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 8.0 t80 -59.25 -47.46 85.27 Favored 'General case' 0 CA--C 1.506 -0.716 0 C-N-CA 120.309 -0.557 . . . . 3.07 110.391 177.709 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 54.4 tt0 -57.34 -33.83 68.16 Favored 'General case' 0 N--CA 1.44 -0.946 0 CA-C-N 115.173 -0.921 . . . . 2.16 110.594 178.085 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 6.2 t80 -62.63 -54.49 38.69 Favored 'General case' 0 C--N 1.333 -0.117 0 N-CA-C 108.645 -0.872 . . . . 1.39 108.645 -175.016 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 3.0 mp -60.34 -42.05 89.39 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.37 0 N-CA-C 108.475 -0.935 . . . . 2.01 108.475 176.677 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 3.2 t30 -62.32 -25.99 68.18 Favored 'General case' 0 CA--C 1.535 0.377 0 CA-C-N 118.413 0.551 . . . . 2.21 111.857 -177.305 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 7.8 t70 . . . . . 0 C--O 1.228 -0.07 0 C-N-CA 124.627 1.171 . . . . 2.17 109.202 176.609 . . . . . . . . 0 0 . 1 . 024 nuclear orig core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.455 -0.193 0 CA-C-O 122.071 0.939 . . . . 4.01 109.17 . . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER -71.4 -29.3 34.86 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.453 0 CA-C-N 115.867 -0.606 . . . . 1.9 111.641 -176.249 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 3.9 t60 -59.96 -53.37 58.69 Favored 'General case' 0 N--CA 1.453 -0.303 0 N-CA-C 106.749 -1.575 . . . . 1.12 106.749 176.759 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 13.0 mm-40 -63.37 -30.72 71.8 Favored 'General case' 0 N--CA 1.449 -0.501 0 CA-C-O 117.943 -1.027 . . . . 4.6 111.672 -177.13 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 1.0 OUTLIER -53.37 -54.55 35.01 Favored 'General case' 0 N--CA 1.464 0.24 0 CA-C-N 119.975 1.261 . . . . 3.58 111.085 168.042 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -48.81 -47.19 31.3 Favored Glycine 0 CA--C 1.524 0.594 0 N-CA-C 109.808 -1.317 . . . . 0.98 109.808 174.997 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 1.8 t-160 -63.28 -41.65 99.03 Favored 'General case' 0 N--CA 1.447 -0.577 0 N-CA-C 113.295 0.85 . . . . 2.65 113.295 -176.565 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -65.93 -30.98 71.65 Favored 'General case' 0 N--CA 1.449 -0.506 0 C-N-CA 123.734 0.814 . . . . 2.22 109.238 -178.759 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 93.5 t -68.52 -37.1 77.25 Favored 'Isoleucine or valine' 0 C--O 1.233 0.222 0 C-N-CA 118.57 -1.252 . . . . 2.48 110.27 173.589 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 1.7 t70 . . . . . 0 C--N 1.331 -0.217 0 N-CA-C 111.968 0.359 . . . . 2.05 111.968 173.291 . . . . . . . . 0 0 . 1 . 024 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 5.0 t70 . . . . . 0 N--CA 1.47 0.553 0 N-CA-C 108.557 -0.905 . . . . 2.54 108.557 . . . . . . . . . 0 0 . 1 . 024 nuclear orig core ' A' A ' 47' ' ' ILE . . . . . 0.414 HD13 ' HE2' ' A' ' 91' ' ' LYS . 5.1 mm -49.17 -56.15 3.03 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.478 0 C-N-CA 125.976 1.71 . . . . 1.84 108.229 176.903 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 26.4 t80 -63.38 -30.35 71.5 Favored 'General case' 0 C--N 1.328 -0.351 0 O-C-N 120.51 -1.369 . . . . 1.03 113.052 175.803 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . 0.435 ' HA ' ' HE2' ' A' ' 49' ' ' LYS . 0.4 OUTLIER -63.67 -50.72 68.13 Favored 'General case' 0 C--N 1.33 -0.252 0 O-C-N 120.138 -1.601 . . . . 2.69 110.76 -178.898 . . . . . . . . 3 3 . 1 . 024 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 17.3 tt0 -90.63 -53.41 4.43 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.957 0.408 . . . . 3.78 110.024 -171.823 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 10.0 mp0 -74.07 -29.66 61.99 Favored 'General case' 0 C--O 1.235 0.303 0 O-C-N 121.249 -0.907 . . . . 2.78 110.6 -176.978 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . 0.438 ' HA2' ' CD1' ' A' ' 66' ' ' PHE . . . -71.16 33.69 0.53 Allowed Glycine 0 CA--C 1.528 0.878 0 C-N-CA 124.613 1.101 . . . . 0.62 114.306 173.462 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 44.7 t -149.15 43.19 0.95 Allowed 'General case' 0 N--CA 1.447 -0.595 0 N-CA-C 107.678 -1.231 . . . . 2.31 107.678 158.592 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -145.4 -44.41 0.22 Allowed 'General case' 0 CA--C 1.518 -0.286 0 N-CA-C 113.226 0.824 . . . . 3.0 113.226 -176.436 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 19.3 mt -55.72 -40.63 72.7 Favored 'General case' 0 N--CA 1.462 0.16 0 CA-C-O 121.118 0.485 . . . . 1.64 111.445 -174.879 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -179.79 162.1 1.03 Allowed 'General case' 0 C--N 1.329 -0.309 0 N-CA-C 106.855 -1.535 . . . . 1.59 106.855 -178.254 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 74.3 m -59.11 -33.47 70.88 Favored 'General case' 0 N--CA 1.456 -0.151 0 O-C-N 122.155 -0.341 . . . . 1.83 110.235 171.779 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -61.71 -39.51 91.74 Favored 'General case' 0 C--O 1.226 -0.161 0 O-C-N 121.786 -0.571 . . . . 1.61 110.255 177.149 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -74.44 -2.02 62.44 Favored Glycine 0 CA--C 1.526 0.737 0 C-N-CA 123.613 0.625 . . . . 1.09 112.313 -179.956 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 59.9 ttt180 -97.33 -7.13 32.71 Favored 'General case' 0 N--CA 1.452 -0.361 0 CA-C-N 117.965 0.883 . . . . 5.22 111.561 174.46 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 1.6 t -63.53 -167.24 0.02 OUTLIER 'General case' 0 CA--C 1.53 0.18 0 CA-C-O 121.574 0.702 . . . . 4.71 110.233 166.908 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 2.3 m120 -46.71 150.56 0.69 Allowed 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 121.279 0.561 . . . . 3.41 111.166 170.344 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 12.6 tm-20 -53.87 -24.38 15.7 Favored 'General case' 0 CA--C 1.537 0.451 0 C-N-CA 124.098 0.959 . . . . 4.28 111.667 -177.877 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -47.11 -57.46 5.06 Favored 'General case' 0 N--CA 1.45 -0.465 0 C-N-CA 125.215 1.406 . . . . 2.23 113.738 169.763 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 3.3 mt-10 -85.55 -19.49 31.04 Favored 'General case' 0 CA--C 1.514 -0.434 0 C-N-CA 118.01 -1.476 . . . . 3.17 110.798 -175.824 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 66' ' ' PHE . . . . . 0.438 ' CD1' ' HA2' ' A' ' 52' ' ' GLY . 68.3 t80 -55.35 -51.56 66.39 Favored 'General case' 0 N--CA 1.449 -0.497 0 CA-C-N 118.277 0.49 . . . . 0.64 110.117 166.883 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 87.7 t80 -69.24 -47.17 65.49 Favored 'General case' 0 N--CA 1.445 -0.692 0 C-N-CA 123.58 0.752 . . . . 0.7 110.188 -176.981 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -65.18 -45.93 82.85 Favored 'General case' 0 CA--C 1.538 0.493 0 O-C-N 121.757 -0.589 . . . . 1.66 111.575 -175.747 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 9.4 mm-40 -61.37 -42.21 98.34 Favored 'General case' 0 N--CA 1.462 0.151 0 O-C-N 121.175 -0.953 . . . . 4.76 110.541 171.442 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -57.36 -41.16 79.59 Favored 'General case' 0 C--O 1.224 -0.285 0 O-C-N 121.25 -0.906 . . . . 1.49 110.23 -179.715 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 51.1 t80 -59.66 -50.13 75.06 Favored 'General case' 0 C--O 1.231 0.083 0 CA-C-N 118.777 0.717 . . . . 5.18 111.0 174.769 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 34.4 ttt180 -47.63 -58.23 4.52 Favored 'General case' 0 N--CA 1.465 0.292 0 O-C-N 121.755 -0.59 . . . . 3.05 109.902 176.281 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -64.23 -27.45 69.06 Favored 'General case' 0 C--N 1.329 -0.325 0 C-N-CA 125.376 1.471 . . . . 1.84 110.923 -177.101 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 1.7 ttp -58.99 -42.97 91.31 Favored 'General case' 0 N--CA 1.452 -0.365 0 C-N-CA 123.12 0.568 . . . . 3.21 110.772 -178.358 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 17.0 p80 -93.55 -37.56 11.84 Favored 'General case' 0 C--O 1.225 -0.23 0 CA-C-O 115.576 -2.154 . . . . 2.23 112.34 179.792 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 2.6 m 4.19 112.22 0.0 OUTLIER 'General case' 0 N--CA 1.471 0.579 0 C-N-CA 128.285 2.634 . . . . 1.85 115.099 -176.238 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 2.0 p -43.65 -44.32 6.3 Favored 'General case' 0 N--CA 1.452 -0.354 0 C-N-CA 125.628 1.571 . . . . 2.39 111.571 177.576 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 56.9 t0 -73.98 105.36 5.19 Favored 'General case' 0 N--CA 1.454 -0.264 0 C-N-CA 117.495 -1.682 . . . . 2.33 108.827 166.639 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 4.1 p-80 -39.91 -39.12 0.78 Allowed 'General case' 0 CA--C 1.531 0.231 0 C-N-CA 124.355 1.062 . . . . 6.55 112.665 170.616 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -60.86 -44.61 96.8 Favored 'General case' 0 N--CA 1.449 -0.497 0 CA-C-O 118.983 -0.532 . . . . 2.18 110.752 -177.582 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -52.44 -38.83 60.12 Favored 'General case' 0 CA--C 1.518 -0.251 0 CA-C-O 121.222 0.534 . . . . 3.89 110.522 177.83 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -64.82 -48.52 74.07 Favored 'General case' 0 N--CA 1.451 -0.381 0 N-CA-C 108.595 -0.891 . . . . 4.41 108.595 179.799 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 1.6 mm? -62.69 -25.72 68.3 Favored 'General case' 0 N--CA 1.454 -0.233 0 CA-C-O 118.132 -0.937 . . . . 2.26 112.724 175.99 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 14.8 mttt -65.18 -44.09 89.58 Favored 'General case' 0 CA--C 1.518 -0.261 0 CA-C-N 120.528 1.513 . . . . 2.29 108.084 174.256 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 96.6 t -63.19 -60.18 3.18 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.544 0 CA-C-O 117.295 -1.336 . . . . 1.82 111.191 173.605 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 24.1 mt-30 -49.91 -51.11 43.32 Favored 'General case' 0 N--CA 1.463 0.189 0 CA-C-N 121.425 1.921 . . . . 2.94 111.827 -177.277 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.92 -37.65 88.36 Favored 'General case' 0 CA--C 1.531 0.234 0 O-C-N 121.545 -0.722 . . . . 3.89 110.933 -175.656 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 83.0 m-20 -85.45 -5.78 59.26 Favored 'General case' 0 CA--C 1.531 0.237 0 CA-C-N 118.091 0.405 . . . . 1.47 111.134 179.869 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -159.93 74.34 3.07 Favored Pre-proline 0 N--CA 1.446 -0.629 0 C-N-CA 125.016 1.326 . . . . 1.3 109.482 -173.903 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 85.3 Cg_endo -82.05 50.78 3.57 Favored 'Trans proline' 0 CA--C 1.536 0.582 0 C-N-CA 124.294 3.329 . . . . 1.65 110.96 -175.479 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 91' ' ' LYS . . . . . 0.414 ' HE2' HD13 ' A' ' 47' ' ' ILE . 0.1 OUTLIER -169.1 -57.57 0.02 OUTLIER 'General case' 0 N--CA 1.451 -0.393 0 C-N-CA 126.777 2.031 . . . . 3.09 108.28 -174.189 . . . . . . . . 3 3 . 1 . 024 nuclear orig core ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 3.9 m -50.15 -45.5 53.27 Favored 'General case' 0 N--CA 1.464 0.226 0 C-N-CA 123.835 0.854 . . . . 1.53 112.276 178.02 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 16.6 t80 -57.31 -50.75 71.94 Favored 'General case' 0 CA--C 1.512 -0.507 0 CA-C-O 121.843 0.83 . . . . 4.08 110.712 179.03 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 23.2 tt0 -60.19 -28.33 67.88 Favored 'General case' 0 N--CA 1.441 -0.908 0 CA-C-N 114.221 -1.354 . . . . 3.43 110.007 -179.083 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 4.5 t80 -65.73 -55.75 15.69 Favored 'General case' 0 N--CA 1.452 -0.354 0 C-N-CA 124.364 1.065 . . . . 1.4 110.205 -177.754 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 2.8 mp -56.67 -45.1 82.54 Favored 'Isoleucine or valine' 0 C--O 1.228 -0.068 0 N-CA-C 107.961 -1.125 . . . . 2.02 107.961 176.34 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 5.3 t30 -58.24 -33.08 68.97 Favored 'General case' 0 CA--C 1.538 0.516 0 N-CA-C 111.962 0.356 . . . . 1.95 111.962 -178.891 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 28.8 t70 . . . . . 0 CA--C 1.517 -0.306 0 C-N-CA 125.203 1.401 . . . . 1.97 110.777 178.459 . . . . . . . . 0 0 . 1 . 025 nuclear orig core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 3.2 t80 . . . . . 0 C--O 1.227 -0.12 0 CA-C-O 121.081 0.467 . . . . 4.37 111.24 . . . . . . . . . 0 0 . 1 . 025 nuclear orig core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 0.5 OUTLIER -66.17 -34.37 69.74 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.501 0 O-C-N 121.567 -0.708 . . . . 1.78 112.159 -177.907 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 5.3 t60 -63.38 -53.0 59.33 Favored 'General case' 0 N--CA 1.453 -0.295 0 N-CA-C 107.832 -1.173 . . . . 1.45 107.832 179.916 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 17.2 mt-10 -58.63 -38.66 78.54 Favored 'General case' 0 N--CA 1.449 -0.477 0 C-N-CA 127.398 2.279 . . . . 2.92 110.004 179.683 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -51.56 -47.05 63.6 Favored 'General case' 0 CA--C 1.519 -0.225 0 C-N-CA 123.709 0.804 . . . . 3.48 109.689 170.829 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -48.77 -49.26 28.57 Favored Glycine 0 CA--C 1.527 0.841 0 CA-C-O 119.728 -0.484 . . . . 0.72 111.912 171.851 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 60.4 m-70 -60.62 -45.4 94.17 Favored 'General case' 0 C--O 1.223 -0.299 0 CA-C-N 119.338 1.569 . . . . 5.0 111.422 176.115 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -62.19 -24.42 67.19 Favored 'General case' 0 CA--C 1.534 0.339 0 O-C-N 121.019 -1.051 . . . . 1.81 111.159 -179.474 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 78.3 t -78.26 -35.7 20.02 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.183 0 O-C-N 121.197 -0.94 . . . . 2.4 110.938 173.44 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 15.1 t0 . . . . . 0 C--N 1.333 -0.109 0 C-N-CA 124.37 1.068 . . . . 2.7 109.716 171.278 . . . . . . . . 0 0 . 1 . 025 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 21.5 t70 . . . . . 0 N--CA 1.47 0.56 0 CA-C-O 120.617 0.246 . . . . 2.25 110.823 . . . . . . . . . 0 0 . 1 . 025 nuclear orig core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 5.2 mm -46.92 -52.13 4.37 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.622 0 C-N-CA 125.244 1.418 . . . . 1.96 108.839 174.175 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 33.9 t80 -63.97 -28.01 69.52 Favored 'General case' 0 N--CA 1.453 -0.287 0 O-C-N 120.785 -1.197 . . . . 0.51 113.288 179.322 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . 0.452 ' HA ' ' HE2' ' A' ' 49' ' ' LYS . 10.5 mmpt? -68.97 -48.76 62.35 Favored 'General case' 0 C--N 1.329 -0.323 0 O-C-N 119.908 -1.745 . . . . 2.0 110.834 -177.838 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 4.2 tp10 -84.88 -58.48 2.69 Favored 'General case' 0 N--CA 1.453 -0.322 0 N-CA-C 108.743 -0.836 . . . . 2.29 108.743 -174.232 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 20.7 mp0 -74.56 -31.74 62.19 Favored 'General case' 0 C--O 1.235 0.3 0 O-C-N 121.052 -1.03 . . . . 2.68 110.982 -174.844 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . 0.403 ' HA2' ' CD1' ' A' ' 66' ' ' PHE . . . -72.39 42.98 0.85 Allowed Glycine 0 CA--C 1.531 1.091 0 C-N-CA 125.097 1.332 . . . . 0.4 114.336 174.354 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 27.9 t -155.03 35.15 0.39 Allowed 'General case' 0 N--CA 1.451 -0.409 0 O-C-N 121.048 -1.266 . . . . 2.63 108.614 153.332 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 42.9 t30 -140.52 -40.56 0.42 Allowed 'General case' 0 C--N 1.341 0.197 0 N-CA-C 112.728 0.64 . . . . 2.82 112.728 -164.997 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 30.9 mt -64.31 -38.68 91.91 Favored 'General case' 0 C--N 1.332 -0.177 0 O-C-N 121.85 -0.531 . . . . 1.6 110.754 178.209 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 1.4 t 177.57 171.6 0.6 Allowed 'General case' 0 CA--C 1.531 0.241 0 C-N-CA 125.513 1.525 . . . . 1.72 107.612 -175.372 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 8.5 m -59.82 -31.32 69.62 Favored 'General case' 0 N--CA 1.455 -0.216 0 O-C-N 121.717 -0.614 . . . . 1.32 110.634 168.421 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -66.28 -19.05 65.71 Favored 'General case' 0 N--CA 1.463 0.183 0 N-CA-C 112.045 0.387 . . . . 2.28 112.045 174.735 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -83.04 -8.44 85.69 Favored Glycine 0 N--CA 1.439 -1.102 0 CA-C-O 118.579 -1.123 . . . . 0.5 110.546 175.792 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -110.77 -18.99 13.0 Favored 'General case' 0 C--O 1.232 0.166 0 CA-C-N 119.357 1.579 . . . . 3.73 112.527 -176.347 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 3.4 p -62.77 -163.57 0.01 OUTLIER 'General case' 0 CA--C 1.538 0.483 0 C-N-CA 124.177 0.991 . . . . 1.87 109.447 168.282 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 78.1 m-20 -53.29 148.33 8.84 Favored 'General case' 0 CA--C 1.53 0.175 0 O-C-N 120.449 -1.407 . . . . 3.48 110.445 -174.14 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 30.7 tt0 -59.77 -26.94 66.11 Favored 'General case' 0 CA--C 1.537 0.477 0 C-N-CA 123.226 0.61 . . . . 2.87 111.168 -176.07 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -62.38 -39.27 92.64 Favored 'General case' 0 N--CA 1.458 -0.063 0 O-C-N 121.367 -0.833 . . . . 1.97 112.509 171.63 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 13.9 mt-10 -69.2 -44.35 72.31 Favored 'General case' 0 CA--C 1.514 -0.439 0 O-C-N 121.041 -1.037 . . . . 2.21 110.435 177.45 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 66' ' ' PHE . . . . . 0.403 ' CD1' ' HA2' ' A' ' 52' ' ' GLY . 51.7 t80 -53.04 -46.03 68.3 Favored 'General case' 0 CA--C 1.534 0.328 0 C-N-CA 125.308 1.443 . . . . 0.4 111.296 173.485 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 62.3 t80 -64.01 -48.48 76.21 Favored 'General case' 0 CA--C 1.534 0.33 0 CA-C-O 122.217 1.008 . . . . 0.87 109.973 177.379 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -64.44 -41.96 96.26 Favored 'General case' 0 N--CA 1.446 -0.648 0 O-C-N 121.203 -0.936 . . . . 1.68 113.226 -174.564 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -68.67 -35.77 77.66 Favored 'General case' 0 C--N 1.332 -0.154 0 O-C-N 121.054 -1.029 . . . . 3.63 109.848 175.006 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -54.24 -41.27 68.56 Favored 'General case' 0 C--O 1.223 -0.315 0 CA-C-N 118.949 0.795 . . . . 1.53 110.327 171.101 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 19.7 t80 -58.48 -49.97 75.44 Favored 'General case' 0 N--CA 1.464 0.241 0 CA-C-N 120.027 1.285 . . . . 4.98 111.635 173.45 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -51.44 -54.38 27.46 Favored 'General case' 0 CA--C 1.531 0.239 0 O-C-N 121.709 -0.62 . . . . 5.43 110.506 179.035 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -66.65 -32.77 74.31 Favored 'General case' 0 C--N 1.324 -0.543 0 C-N-CA 124.377 1.071 . . . . 1.57 109.96 -174.468 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 1.8 tmt? -61.58 -39.32 90.75 Favored 'General case' 0 N--CA 1.447 -0.606 0 C-N-CA 123.676 0.79 . . . . 3.43 112.124 -177.774 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 13.0 p80 -94.59 -8.93 36.68 Favored 'General case' 0 C--O 1.232 0.133 0 CA-C-O 117.3 -1.333 . . . . 1.48 113.187 -179.655 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 9.7 m -40.03 127.37 2.16 Favored 'General case' 0 N--CA 1.45 -0.434 0 CA-C-O 123.24 1.495 . . . . 1.9 110.81 -168.459 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 1.4 p -52.63 -42.77 64.93 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 112.692 -2.049 . . . . 2.36 108.892 -178.315 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 14.4 t0 -70.62 114.19 8.48 Favored 'General case' 0 N--CA 1.444 -0.739 0 CA-C-O 121.98 0.895 . . . . 1.92 108.916 169.548 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 52.5 m80 -57.72 -32.39 67.36 Favored 'General case' 0 N--CA 1.455 -0.194 0 O-C-N 121.639 -0.663 . . . . 6.76 110.615 174.597 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -61.85 -50.83 70.68 Favored 'General case' 0 N--CA 1.451 -0.381 0 CA-C-O 118.401 -0.809 . . . . 1.65 110.313 179.722 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 4.2 mt-10 -43.17 -45.45 5.57 Favored 'General case' 0 C--N 1.339 0.138 0 C-N-CA 124.725 1.21 . . . . 2.78 110.204 176.648 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 1.9 mtp180 -63.91 -52.75 58.42 Favored 'General case' 0 N--CA 1.453 -0.32 0 CA-C-N 115.828 -0.623 . . . . 3.94 109.778 -178.497 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 1.3 mm? -63.67 -21.08 66.2 Favored 'General case' 0 N--CA 1.452 -0.33 0 CA-C-O 117.651 -1.166 . . . . 1.93 112.701 178.042 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 2.5 mptm? -64.12 -44.55 91.89 Favored 'General case' 0 C--O 1.225 -0.221 0 CA-C-N 121.324 1.875 . . . . 2.26 107.639 171.2 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 84.4 t -62.11 -60.82 2.11 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.489 0 CA-C-O 118.144 -0.931 . . . . 1.78 110.368 175.324 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -51.13 -48.14 61.87 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 119.765 1.166 . . . . 2.87 111.197 -174.493 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 37.4 tttm -56.85 -48.54 77.84 Favored 'General case' 0 N--CA 1.449 -0.519 0 C-N-CA 123.769 0.828 . . . . 4.2 111.754 176.457 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 47.4 m-20 -79.29 -7.81 58.58 Favored 'General case' 0 CA--C 1.532 0.261 0 C-N-CA 123.231 0.612 . . . . 1.34 111.556 -177.244 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -165.8 73.19 1.3 Allowed Pre-proline 0 N--CA 1.448 -0.558 0 C-N-CA 125.488 1.515 . . . . 1.77 110.345 -167.72 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 74.4 Cg_endo -73.31 8.14 1.91 Allowed 'Trans proline' 0 N--CA 1.457 -0.62 0 C-N-CA 123.099 2.532 . . . . 1.95 112.875 -175.093 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -122.43 -47.93 2.09 Favored 'General case' 0 N--CA 1.45 -0.431 0 C-N-CA 125.221 1.408 . . . . 3.26 109.638 -177.625 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 2.7 m -53.92 -46.87 71.61 Favored 'General case' 0 C--N 1.334 -0.081 0 C-N-CA 123.706 0.803 . . . . 1.55 111.132 177.568 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 10.3 t80 -60.27 -47.45 85.94 Favored 'General case' 0 CA--C 1.508 -0.635 0 CA-C-O 121.355 0.598 . . . . 3.98 110.567 178.499 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 24.2 tt0 -56.58 -33.76 66.5 Favored 'General case' 0 N--CA 1.441 -0.912 0 CA-C-N 114.693 -1.139 . . . . 2.58 109.882 -179.914 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 3.2 t80 -63.33 -57.94 8.73 Favored 'General case' 0 N--CA 1.455 -0.221 0 C-N-CA 124.443 1.097 . . . . 1.31 109.633 -175.891 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 47.0 mm -51.9 -46.72 41.18 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.14 0 C-N-CA 123.345 0.658 . . . . 3.36 109.67 175.575 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 40.3 t30 -63.75 -32.99 74.67 Favored 'General case' 0 CA--C 1.53 0.205 0 N-CA-C 111.714 0.264 . . . . 2.03 111.714 -176.559 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 CA--C 1.523 -0.075 0 C-N-CA 124.304 1.042 . . . . 2.17 108.639 176.778 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 CA--C 1.522 -0.097 0 CA-C-O 121.161 0.505 . . . . 5.49 109.853 . . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER -62.36 -33.65 60.24 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.313 0 N-CA-C 112.617 0.599 . . . . 1.76 112.617 178.838 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 10.1 t60 -61.62 -52.33 64.8 Favored 'General case' 0 CA--C 1.531 0.213 0 N-CA-C 106.684 -1.599 . . . . 0.98 106.684 178.349 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 36.7 mt-10 -57.21 -36.84 71.37 Favored 'General case' 0 CA--C 1.53 0.207 0 O-C-N 121.473 -0.767 . . . . 2.63 111.337 176.946 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 1.1 t80 -56.9 -41.73 78.63 Favored 'General case' 0 C--N 1.33 -0.25 0 O-C-N 121.511 -0.743 . . . . 3.26 110.881 175.398 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -52.88 -45.11 61.59 Favored Glycine 0 CA--C 1.53 0.97 0 N-CA-C 111.249 -0.74 . . . . 0.79 111.249 172.631 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 71.6 m-70 -59.7 -49.02 79.35 Favored 'General case' 0 C--O 1.227 -0.105 0 CA-C-N 118.216 1.008 . . . . 5.2 111.279 175.403 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -58.69 -29.29 66.52 Favored 'General case' 0 CA--C 1.533 0.291 0 O-C-N 122.018 -0.426 . . . . 1.94 110.982 -179.185 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 49.3 t -66.57 -42.21 89.59 Favored 'Isoleucine or valine' 0 C--O 1.233 0.223 0 O-C-N 121.08 -1.012 . . . . 1.99 111.053 176.27 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 65.0 m-20 . . . . . 0 C--O 1.232 0.146 0 CA-C-N 117.904 0.32 . . . . 2.17 111.648 175.777 . . . . . . . . 0 0 . 1 . 026 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 1.6 t70 . . . . . 0 N--CA 1.468 0.432 0 N-CA-C 109.612 -0.514 . . . . 2.19 109.612 . . . . . . . . . 0 0 . 1 . 026 nuclear orig core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 4.4 mm -50.3 -53.25 12.52 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.26 0 C-N-CA 123.988 0.915 . . . . 1.79 109.383 178.262 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 20.2 t80 -60.11 -32.22 70.78 Favored 'General case' 0 N--CA 1.452 -0.338 0 C-N-CA 123.504 0.722 . . . . 0.44 112.243 178.465 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . 0.444 ' HA ' ' HE2' ' A' ' 49' ' ' LYS . 0.6 OUTLIER -63.38 -51.14 67.09 Favored 'General case' 0 CA--C 1.519 -0.22 0 O-C-N 120.336 -1.478 . . . . 1.87 110.502 -179.331 . . . . . . . . 3 3 . 1 . 026 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 3.1 tp10 -79.44 -65.98 0.93 Allowed 'General case' 0 N--CA 1.452 -0.338 0 CA-C-O 122.27 1.033 . . . . 2.13 108.559 -175.368 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 3.8 mm-40 -72.14 -30.23 64.82 Favored 'General case' 0 N--CA 1.453 -0.316 0 C-N-CA 124.006 0.923 . . . . 2.3 109.956 -167.336 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . 0.425 ' HA2' ' CD1' ' A' ' 66' ' ' PHE . . . -68.99 41.68 0.34 Allowed Glycine 0 CA--C 1.527 0.815 0 C-N-CA 125.706 1.622 . . . . 0.33 113.838 169.036 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 65.3 p -145.77 22.42 1.44 Allowed 'General case' 0 N--CA 1.448 -0.55 0 O-C-N 120.871 -1.37 . . . . 2.57 111.49 159.681 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 47.9 t-20 -135.44 -44.32 0.69 Allowed 'General case' 0 C--O 1.226 -0.16 0 N-CA-C 111.906 0.336 . . . . 2.31 111.906 -165.529 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 28.7 mt -58.55 -38.55 78.07 Favored 'General case' 0 N--CA 1.462 0.163 0 CA-C-O 120.985 0.421 . . . . 1.79 111.142 -174.987 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER 178.16 172.03 0.68 Allowed 'General case' 0 CA--C 1.531 0.22 0 C-N-CA 125.468 1.507 . . . . 1.68 107.591 -178.244 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 14.4 m -56.89 -35.55 69.08 Favored 'General case' 0 N--CA 1.453 -0.283 0 O-C-N 121.572 -0.705 . . . . 1.29 110.319 166.7 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -64.67 -21.43 66.73 Favored 'General case' 0 CA--C 1.534 0.343 0 CA-C-O 121.085 0.469 . . . . 2.1 111.858 175.969 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -80.73 -12.49 82.76 Favored Glycine 0 N--CA 1.444 -0.791 0 N-CA-C 111.125 -0.79 . . . . 0.52 111.125 176.372 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 36.4 ttt-85 -110.98 -11.59 14.31 Favored 'General case' 0 CA--C 1.529 0.171 0 CA-C-N 118.758 1.279 . . . . 3.08 112.151 -179.15 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 2.2 p -63.9 -161.63 0.01 OUTLIER 'General case' 0 CA--C 1.54 0.568 0 C-N-CA 123.616 0.766 . . . . 1.83 109.9 167.059 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 16.3 t-20 -52.34 151.83 3.78 Favored 'General case' 0 CA--C 1.532 0.287 0 O-C-N 120.907 -1.121 . . . . 2.14 110.709 -177.574 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 35.7 tt0 -59.91 -36.37 76.85 Favored 'General case' 0 CA--C 1.53 0.182 0 CA-C-N 118.915 0.78 . . . . 2.47 110.349 -176.527 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -55.37 -30.14 59.78 Favored 'General case' 0 C--N 1.331 -0.198 0 O-C-N 121.522 -0.736 . . . . 1.53 112.813 176.924 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 1.6 mm-40 -82.16 -38.67 24.34 Favored 'General case' 0 N--CA 1.447 -0.589 0 CA-C-O 118.612 -0.709 . . . . 2.65 110.362 -179.177 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 66' ' ' PHE . . . . . 0.425 ' CD1' ' HA2' ' A' ' 52' ' ' GLY . 59.0 t80 -55.16 -47.29 75.36 Favored 'General case' 0 N--CA 1.452 -0.361 0 C-N-CA 124.267 1.027 . . . . 0.4 111.43 170.73 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 56.9 t80 -65.03 -48.11 75.02 Favored 'General case' 0 CA--C 1.538 0.501 0 O-C-N 121.061 -1.024 . . . . 0.57 109.819 176.141 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -58.82 -55.69 31.92 Favored 'General case' 0 CA--C 1.536 0.44 0 N-CA-C 113.252 0.834 . . . . 1.63 113.252 -174.7 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -55.4 -39.56 70.34 Favored 'General case' 0 C--N 1.331 -0.218 0 O-C-N 121.027 -1.045 . . . . 3.87 111.355 171.264 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -60.17 -32.95 71.54 Favored 'General case' 0 CA--C 1.533 0.311 0 CA-C-N 119.737 1.153 . . . . 1.58 110.872 175.516 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -59.17 -49.71 76.83 Favored 'General case' 0 N--CA 1.464 0.229 0 CA-C-N 119.127 0.876 . . . . 4.97 111.901 168.681 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 10.7 ttp180 -51.92 -61.61 2.15 Favored 'General case' 0 CA--C 1.534 0.352 0 O-C-N 121.392 -0.818 . . . . 2.77 110.82 174.905 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -62.25 -45.89 91.3 Favored 'General case' 0 C--O 1.221 -0.436 0 C-N-CA 125.56 1.544 . . . . 1.65 110.649 -170.94 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -63.61 -25.96 68.46 Favored 'General case' 0 C--N 1.331 -0.216 0 O-C-N 120.276 -1.515 . . . . 5.48 111.808 -179.867 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -91.96 -12.11 34.28 Favored 'General case' 0 C--O 1.232 0.169 0 CA-C-O 117.063 -1.446 . . . . 1.34 112.327 175.214 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 80.3 p -48.9 122.66 5.99 Favored 'General case' 0 N--CA 1.446 -0.642 0 CA-C-N 119.8 1.182 . . . . 3.25 108.31 -167.436 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 2.2 p -51.21 -39.36 56.36 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 114.646 -1.161 . . . . 2.1 109.641 177.102 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 13.5 t0 -63.98 104.35 0.7 Allowed 'General case' 0 N--CA 1.448 -0.528 0 CA-C-O 121.641 0.734 . . . . 2.06 109.846 166.685 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 39.3 p-80 -50.17 -35.23 25.28 Favored 'General case' 0 C--N 1.332 -0.171 0 C-N-CA 122.991 0.517 . . . . 5.73 111.994 174.268 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -61.12 -51.24 69.93 Favored 'General case' 0 N--CA 1.449 -0.512 0 CA-C-O 118.516 -0.754 . . . . 1.92 110.736 -178.072 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 1.2 mt-10 -50.42 -39.52 47.53 Favored 'General case' 0 C--O 1.233 0.198 0 CA-C-N 119.132 0.878 . . . . 3.25 110.478 177.759 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -62.97 -52.96 60.98 Favored 'General case' 0 N--CA 1.453 -0.312 0 C-N-CA 119.218 -0.993 . . . . 4.08 108.891 -178.588 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 1.2 mm? -65.64 -18.1 65.08 Favored 'General case' 0 N--CA 1.451 -0.423 0 CA-C-O 117.866 -1.064 . . . . 1.56 112.114 178.851 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 6.0 mttt -65.83 -44.65 84.91 Favored 'General case' 0 CA--C 1.516 -0.335 0 CA-C-N 120.824 1.647 . . . . 2.12 108.299 169.371 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 95.8 t -58.2 -60.28 2.44 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.497 0 CA-C-N 118.757 0.708 . . . . 1.65 110.051 171.254 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -57.37 -45.54 84.34 Favored 'General case' 0 CA--C 1.53 0.202 0 CA-C-N 119.512 1.051 . . . . 3.36 111.812 -169.721 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 56.6 tttt -58.09 -53.44 58.25 Favored 'General case' 0 N--CA 1.451 -0.404 0 C-N-CA 123.723 0.809 . . . . 3.21 109.712 177.03 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 4.3 m-20 -77.23 -6.5 53.27 Favored 'General case' 0 N--CA 1.453 -0.283 0 CA-C-O 118.825 -0.607 . . . . 1.52 111.229 -173.927 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -164.46 72.9 1.61 Allowed Pre-proline 0 N--CA 1.447 -0.609 0 C-N-CA 124.952 1.301 . . . . 1.86 110.587 -171.75 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 72.9 Cg_endo -74.27 16.89 0.55 Allowed 'Trans proline' 0 CA--C 1.536 0.584 0 C-N-CA 123.461 2.774 . . . . 1.47 113.283 -173.861 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -133.75 -41.82 0.84 Allowed 'General case' 0 N--CA 1.454 -0.252 0 C-N-CA 125.385 1.474 . . . . 3.39 109.29 -177.635 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 5.7 m -54.55 -48.1 72.4 Favored 'General case' 0 CA--C 1.521 -0.154 0 O-C-N 121.159 -0.963 . . . . 1.62 110.615 171.517 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 2.7 t80 -59.12 -46.67 87.72 Favored 'General case' 0 CA--C 1.506 -0.733 0 C-N-CA 119.849 -0.741 . . . . 3.96 110.492 179.342 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 50.2 tt0 -54.09 -37.13 63.93 Favored 'General case' 0 N--CA 1.442 -0.85 0 O-C-N 123.964 0.79 . . . . 3.12 110.319 177.708 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 4.4 t80 -60.66 -57.63 11.9 Favored 'General case' 0 N--CA 1.457 -0.078 0 CA-C-N 118.549 0.613 . . . . 1.14 109.568 -174.557 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 3.2 mp -60.9 -39.01 80.58 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.284 0 N-CA-C 109.588 -0.523 . . . . 1.82 109.588 177.598 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 9.3 t-20 -62.0 -35.41 78.43 Favored 'General case' 0 N--CA 1.455 -0.198 0 O-C-N 121.597 -0.689 . . . . 3.4 111.443 -174.789 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 C--O 1.231 0.11 0 C-N-CA 125.679 1.592 . . . . 2.1 108.303 174.904 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 34.0 t80 . . . . . 0 C--O 1.227 -0.117 0 CA-C-O 122.173 0.987 . . . . 4.76 109.344 . . . . . . . . . 0 0 . 1 . 027 nuclear orig core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 0.7 OUTLIER -63.1 -33.97 63.94 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.469 0 O-C-N 121.625 -0.672 . . . . 1.87 111.956 179.694 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 2.2 t-160 -60.29 -53.69 54.63 Favored 'General case' 0 CA--C 1.533 0.32 0 N-CA-C 106.7 -1.592 . . . . 0.72 106.7 176.554 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 86.4 mt-10 -51.54 -44.7 62.75 Favored 'General case' 0 C--O 1.223 -0.32 0 C-N-CA 124.455 1.102 . . . . 2.47 110.05 177.669 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -53.37 -56.98 12.3 Favored 'General case' 0 CA--C 1.519 -0.25 0 C-N-CA 124.476 1.11 . . . . 3.79 110.892 177.987 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -48.03 -46.66 26.6 Favored Glycine 0 CA--C 1.523 0.537 0 N-CA-C 110.466 -1.054 . . . . 0.54 110.466 175.652 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 2.6 t-160 -60.68 -46.35 90.67 Favored 'General case' 0 N--CA 1.45 -0.428 0 O-C-N 122.052 -0.675 . . . . 2.6 112.028 -179.525 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -60.38 -31.46 70.37 Favored 'General case' 0 N--CA 1.447 -0.575 0 N-CA-C 109.428 -0.582 . . . . 1.94 109.428 -179.214 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 26.3 t -66.47 -41.54 88.77 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.182 0 C-N-CA 118.567 -1.253 . . . . 1.87 111.682 175.44 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 33.3 t0 . . . . . 0 N--CA 1.464 0.243 0 CA-C-O 122.098 0.952 . . . . 2.06 111.114 174.925 . . . . . . . . 0 0 . 1 . 027 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 42.2 t0 . . . . . 0 N--CA 1.467 0.41 0 CA-C-O 121.185 0.517 . . . . 2.28 110.335 . . . . . . . . . 0 0 . 1 . 027 nuclear orig core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 5.4 mm -51.94 -54.74 12.18 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.397 0 C-N-CA 124.74 1.216 . . . . 1.7 109.523 172.673 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 48' ' ' PHE . . . . . 0.434 ' CD2' ' HE3' ' A' ' 49' ' ' LYS . 22.1 t80 -57.77 -28.62 64.14 Favored 'General case' 0 N--CA 1.452 -0.325 0 O-C-N 120.414 -1.429 . . . . 0.54 112.148 176.538 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . 0.434 ' HE3' ' CD2' ' A' ' 48' ' ' PHE . 0.2 OUTLIER -69.17 -46.21 68.08 Favored 'General case' 0 N--CA 1.45 -0.431 0 O-C-N 120.353 -1.467 . . . . 2.11 111.251 -178.317 . . . . . . . . 3 3 . 1 . 027 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 52.3 tp10 -83.68 -66.01 0.94 Allowed 'General case' 0 C--N 1.33 -0.264 0 N-CA-C 109.009 -0.738 . . . . 2.82 109.009 -179.688 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 29.9 mp0 -69.19 -32.6 72.0 Favored 'General case' 0 C--O 1.236 0.384 0 O-C-N 121.384 -0.823 . . . . 2.69 111.35 -172.082 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -72.14 42.27 0.78 Allowed Glycine 0 CA--C 1.529 0.913 0 C-N-CA 124.652 1.12 . . . . 0.43 113.949 172.5 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 22.9 t -146.38 24.43 1.26 Allowed 'General case' 0 N--CA 1.447 -0.584 0 O-C-N 121.246 -1.149 . . . . 2.45 109.511 159.257 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -138.06 -27.99 0.88 Allowed 'General case' 0 C--N 1.342 0.273 0 N-CA-C 113.778 1.029 . . . . 3.7 113.778 -169.979 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 32.0 mt -68.28 -40.02 81.96 Favored 'General case' 0 C--N 1.333 -0.151 0 CA-C-N 119.06 0.845 . . . . 1.49 110.793 -179.441 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER 177.71 165.42 0.65 Allowed 'General case' 0 C--N 1.33 -0.253 0 C-N-CA 125.511 1.524 . . . . 1.66 106.961 -173.477 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 7.2 m -59.8 -35.18 74.14 Favored 'General case' 0 N--CA 1.453 -0.278 0 C-N-CA 123.027 0.531 . . . . 1.36 110.637 170.262 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -71.18 -6.09 36.84 Favored 'General case' 0 CA--C 1.533 0.306 0 C-N-CA 122.88 0.472 . . . . 1.66 112.032 176.127 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -101.85 4.23 52.97 Favored Glycine 0 CA--C 1.524 0.606 0 C-N-CA 124.524 1.059 . . . . 0.61 111.196 172.853 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -114.1 -17.89 11.81 Favored 'General case' 0 CA--C 1.527 0.064 0 C-N-CA 124.356 1.062 . . . . 4.4 111.514 177.274 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 13.9 p -61.74 -160.13 0.01 OUTLIER 'General case' 0 CA--C 1.541 0.607 0 C-N-CA 125.443 1.497 . . . . 1.81 109.691 168.069 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 3.7 m120 -50.49 146.62 5.26 Favored 'General case' 0 CA--C 1.535 0.373 0 O-C-N 119.983 -1.698 . . . . 2.16 111.469 -177.081 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 38.8 tt0 -56.52 -30.62 63.24 Favored 'General case' 0 N--CA 1.467 0.398 0 CA-C-O 121.443 0.64 . . . . 2.65 110.493 179.095 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -53.69 -45.05 70.24 Favored 'General case' 0 N--CA 1.452 -0.367 0 C-N-CA 123.841 0.857 . . . . 1.58 112.183 172.643 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 8.7 mt-10 -72.75 -39.26 66.99 Favored 'General case' 0 C--O 1.221 -0.397 0 O-C-N 121.562 -0.712 . . . . 2.29 110.756 178.484 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 55.4 t80 -51.45 -52.93 42.2 Favored 'General case' 0 C--N 1.332 -0.159 0 C-N-CA 123.337 0.655 . . . . 0.33 111.18 173.99 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 73.4 t80 -66.61 -45.54 78.83 Favored 'General case' 0 N--CA 1.449 -0.492 0 C-N-CA 123.711 0.804 . . . . 0.47 110.579 -178.567 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -60.12 -47.6 85.22 Favored 'General case' 0 CA--C 1.539 0.537 0 O-C-N 121.198 -0.939 . . . . 1.6 111.963 -178.666 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 48.1 mm-40 -55.41 -44.79 76.55 Favored 'General case' 0 CA--C 1.517 -0.292 0 C-N-CA 125.011 1.324 . . . . 4.23 109.975 169.36 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -55.7 -45.94 77.77 Favored 'General case' 0 N--CA 1.446 -0.632 0 CA-C-O 118.06 -0.971 . . . . 1.62 109.508 -175.869 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 73.9 t80 -56.82 -50.8 71.3 Favored 'General case' 0 N--CA 1.464 0.271 0 CA-C-N 119.343 0.974 . . . . 3.73 111.913 172.799 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 18.3 ttp180 -46.15 -58.02 4.0 Favored 'General case' 0 CA--C 1.531 0.25 0 CA-C-N 118.283 0.492 . . . . 3.41 110.826 178.103 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -65.14 -32.51 74.23 Favored 'General case' 0 C--N 1.324 -0.528 0 C-N-CA 125.332 1.453 . . . . 1.8 110.92 -178.428 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -59.48 -39.57 84.14 Favored 'General case' 0 CA--C 1.517 -0.315 0 C-N-CA 123.701 0.8 . . . . 3.22 110.012 -178.047 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 22.9 p80 -90.52 -36.45 14.48 Favored 'General case' 0 N--CA 1.45 -0.443 0 CA-C-O 115.723 -2.084 . . . . 1.17 110.867 -176.948 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 15.9 m -8.14 111.32 0.01 OUTLIER 'General case' 0 C--N 1.348 0.53 0 C-N-CA 127.883 2.473 . . . . 1.69 113.342 -171.765 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 4.1 p -46.56 -42.62 16.19 Favored 'General case' 0 N--CA 1.45 -0.465 0 C-N-CA 125.186 1.394 . . . . 2.04 110.567 -177.013 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 14.6 t0 -70.13 105.63 2.99 Favored 'General case' 0 N--CA 1.447 -0.586 0 C-N-CA 118.073 -1.451 . . . . 2.26 110.162 164.333 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 5.9 p-80 -39.38 -43.36 1.19 Allowed 'General case' 0 N--CA 1.45 -0.464 0 CA-C-N 114.457 -1.247 . . . . 5.56 113.039 169.657 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -66.98 -40.1 87.35 Favored 'General case' 0 N--CA 1.453 -0.291 0 O-C-N 121.872 -0.517 . . . . 2.18 110.195 -172.549 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 1.1 tm-20 -50.94 -41.79 59.24 Favored 'General case' 0 C--N 1.328 -0.327 0 C-N-CA 124.604 1.161 . . . . 3.33 110.097 172.625 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -63.53 -47.18 82.68 Favored 'General case' 0 CA--C 1.519 -0.234 0 C-N-CA 119.327 -0.949 . . . . 4.44 108.795 176.926 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 2.1 mm? -56.57 -25.11 51.52 Favored 'General case' 0 N--CA 1.456 -0.129 0 CA-C-O 118.042 -0.98 . . . . 1.58 113.308 174.061 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 14.9 mptt -64.64 -48.33 75.23 Favored 'General case' 0 CA--C 1.52 -0.21 0 CA-C-N 121.082 1.764 . . . . 4.17 108.956 172.337 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 2.4 t -57.87 -60.51 2.1 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.5 0 CA-C-N 118.608 0.64 . . . . 2.03 109.921 173.488 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 36.0 mt-30 -52.48 -50.44 62.73 Favored 'General case' 0 N--CA 1.453 -0.32 0 CA-C-N 118.909 0.777 . . . . 4.59 111.091 -171.064 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 8.5 pttp -65.02 -41.09 95.61 Favored 'General case' 0 N--CA 1.455 -0.214 0 O-C-N 121.623 -0.673 . . . . 4.47 110.842 -179.249 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 89.9 m-20 -79.75 -8.5 59.29 Favored 'General case' 0 CA--C 1.529 0.16 0 O-C-N 122.077 -0.389 . . . . 1.69 110.891 -177.27 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -160.9 62.52 1.63 Allowed Pre-proline 0 N--CA 1.446 -0.648 0 C-N-CA 123.606 0.763 . . . . 1.71 110.769 -169.416 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 28.5 Cg_endo -59.99 -35.9 91.61 Favored 'Trans proline' 0 N--CA 1.452 -0.929 0 C-N-CA 122.018 1.812 . . . . 2.16 110.56 -174.153 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 3.4 tttt -77.56 -44.23 29.23 Favored 'General case' 0 N--CA 1.453 -0.285 0 C-N-CA 123.496 0.718 . . . . 5.67 111.219 -177.038 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 12.0 m -58.21 -42.47 86.26 Favored 'General case' 0 CA--C 1.518 -0.288 0 O-C-N 121.22 -0.925 . . . . 1.62 110.394 177.734 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 56.3 t80 -54.9 -51.38 66.2 Favored 'General case' 0 CA--C 1.502 -0.893 0 C-N-CA 120.07 -0.652 . . . . 3.9 111.161 178.144 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 36.6 tt0 -50.94 -35.61 34.24 Favored 'General case' 0 N--CA 1.445 -0.701 0 O-C-N 124.374 1.046 . . . . 2.25 111.016 178.74 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 4.1 t80 -58.75 -58.95 6.32 Favored 'General case' 0 CA--C 1.532 0.288 0 C-N-CA 123.268 0.627 . . . . 1.18 110.102 -177.55 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 3.9 mp -62.89 -35.29 70.55 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.128 0 O-C-N 121.419 -0.801 . . . . 2.02 109.59 178.781 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -63.23 -29.81 71.08 Favored 'General case' 0 N--CA 1.452 -0.328 0 C-N-CA 122.693 0.397 . . . . 2.43 110.206 -179.012 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 10.7 t70 . . . . . 0 C--N 1.333 -0.116 0 CA-C-O 121.546 0.689 . . . . 2.56 109.734 174.57 . . . . . . . . 0 0 . 1 . 028 nuclear orig core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 79.4 t80 . . . . . 0 C--O 1.224 -0.256 0 CA-C-O 120.58 0.228 . . . . 4.46 111.28 . . . . . . . . . 0 0 . 1 . 028 nuclear orig core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -66.69 -31.0 51.54 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.192 0 O-C-N 121.457 -0.777 . . . . 1.51 112.632 -179.199 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 5.7 t60 -59.65 -57.2 13.97 Favored 'General case' 0 C--N 1.341 0.228 0 N-CA-C 106.406 -1.702 . . . . 0.85 106.406 176.359 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 44.0 mt-10 -54.11 -39.51 66.47 Favored 'General case' 0 N--CA 1.452 -0.343 0 C-N-CA 124.607 1.163 . . . . 2.1 110.713 178.384 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 4.0 t80 -58.78 -48.08 82.5 Favored 'General case' 0 CA--C 1.521 -0.16 0 C-N-CA 124.054 0.942 . . . . 3.14 110.488 178.625 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -51.15 -45.44 51.74 Favored Glycine 0 CA--C 1.525 0.67 0 N-CA-C 110.322 -1.111 . . . . 0.5 110.322 172.983 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 2.3 t-160 -60.81 -48.68 80.72 Favored 'General case' 0 N--CA 1.45 -0.426 0 O-C-N 122.109 -0.642 . . . . 2.65 111.32 179.434 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -60.3 -30.89 69.77 Favored 'General case' 0 N--CA 1.453 -0.319 0 O-C-N 121.696 -0.628 . . . . 1.72 110.169 179.846 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 74.2 t -69.95 -39.47 77.52 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.163 0 O-C-N 121.338 -0.851 . . . . 2.0 110.633 176.8 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 9.5 t0 . . . . . 0 C--N 1.331 -0.204 0 CA-C-O 121.364 0.602 . . . . 2.14 110.698 172.242 . . . . . . . . 0 0 . 1 . 028 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 14.8 t70 . . . . . 0 N--CA 1.465 0.31 0 CA-C-O 121.033 0.444 . . . . 2.12 110.396 . . . . . . . . . 0 0 . 1 . 028 nuclear orig core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 5.7 mm -53.31 -50.08 49.38 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.19 0 N-CA-C 108.339 -0.986 . . . . 1.69 108.339 172.052 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 19.6 t80 -63.61 -25.76 68.38 Favored 'General case' 0 N--CA 1.454 -0.225 0 O-C-N 121.906 -0.496 . . . . 0.48 112.008 177.667 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . 0.497 ' HA ' ' CE ' ' A' ' 49' ' ' LYS . 0.6 OUTLIER -71.22 -48.37 51.75 Favored 'General case' 0 N--CA 1.45 -0.43 0 O-C-N 119.774 -1.829 . . . . 2.58 110.888 -178.192 . . . . . . . . 3 3 . 1 . 028 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 22.8 tp10 -85.63 -63.53 1.31 Allowed 'General case' 0 C--N 1.328 -0.331 0 N-CA-C 108.582 -0.896 . . . . 2.6 108.582 -176.927 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 3.4 mm-40 -67.22 -32.86 74.2 Favored 'General case' 0 CA--C 1.536 0.407 0 C-N-CA 123.833 0.853 . . . . 2.73 109.789 -170.175 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . 0.456 ' HA2' ' CD1' ' A' ' 66' ' ' PHE . . . -68.05 43.9 0.3 Allowed Glycine 0 CA--C 1.53 1.028 0 C-N-CA 126.917 2.199 . . . . 0.34 114.587 171.132 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 33.1 p -154.2 32.25 0.43 Allowed 'General case' 0 N--CA 1.448 -0.536 0 O-C-N 121.104 -1.233 . . . . 2.62 109.869 160.274 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -137.35 -43.94 0.55 Allowed 'General case' 0 CA--C 1.517 -0.296 0 N-CA-C 112.908 0.707 . . . . 2.66 112.908 -168.719 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 15.3 mt -63.11 -36.48 83.74 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 120.872 0.367 . . . . 1.79 110.749 -175.926 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 1.1 t 176.53 171.01 0.45 Allowed 'General case' 0 CA--C 1.531 0.234 0 C-N-CA 125.835 1.654 . . . . 1.62 107.501 -177.919 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 20.8 m -57.38 -33.71 68.1 Favored 'General case' 0 N--CA 1.453 -0.306 0 O-C-N 121.713 -0.617 . . . . 1.35 110.555 168.016 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -61.15 -30.89 70.66 Favored 'General case' 0 CA--C 1.53 0.199 0 CA-C-N 118.475 0.58 . . . . 1.67 110.894 174.207 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -71.8 -11.56 73.69 Favored Glycine 0 C--O 1.221 -0.663 0 O-C-N 121.354 -0.841 . . . . 0.48 111.729 176.524 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 32.1 ttt180 -105.14 -12.54 16.07 Favored 'General case' 0 CA--C 1.533 0.294 0 CA-C-N 118.817 1.308 . . . . 3.52 112.473 177.224 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 41.4 p -66.39 -134.9 0.0 OUTLIER 'General case' 0 N--CA 1.47 0.573 0 CA-C-N 118.833 0.742 . . . . 1.81 111.211 178.204 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 6.7 t-20 -69.07 152.91 44.62 Favored 'General case' 0 N--CA 1.453 -0.307 0 O-C-N 119.465 -2.022 . . . . 2.9 107.943 179.871 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 5.3 tm-20 -60.7 -33.1 72.36 Favored 'General case' 0 CA--C 1.531 0.246 0 CA-C-N 118.72 0.691 . . . . 3.4 109.625 177.487 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -61.0 -30.73 70.46 Favored 'General case' 0 N--CA 1.45 -0.435 0 N-CA-C 113.246 0.832 . . . . 1.62 113.246 174.848 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 2.4 mt-10 -80.13 -42.31 23.76 Favored 'General case' 0 CA--C 1.51 -0.567 0 CA-C-O 118.392 -0.813 . . . . 2.36 110.592 176.5 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 66' ' ' PHE . . . . . 0.456 ' CD1' ' HA2' ' A' ' 52' ' ' GLY . 54.7 t80 -48.99 -49.0 42.92 Favored 'General case' 0 N--CA 1.453 -0.309 0 C-N-CA 123.596 0.758 . . . . 0.39 111.164 172.816 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 82.7 t80 -63.29 -44.42 95.11 Favored 'General case' 0 CA--C 1.539 0.53 0 O-C-N 121.319 -0.863 . . . . 0.47 110.772 177.074 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -62.21 -56.44 18.66 Favored 'General case' 0 CA--C 1.54 0.586 0 O-C-N 121.296 -0.878 . . . . 1.65 113.021 -175.594 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 1.1 pp20? -56.19 -38.45 70.98 Favored 'General case' 0 C--N 1.333 -0.123 0 O-C-N 120.962 -1.086 . . . . 3.73 111.204 171.376 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -57.91 -42.55 84.99 Favored 'General case' 0 N--CA 1.45 -0.438 0 CA-C-O 118.493 -0.765 . . . . 1.8 110.562 175.347 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 55.7 t80 -59.98 -50.08 75.16 Favored 'General case' 0 N--CA 1.464 0.268 0 CA-C-N 120.37 1.441 . . . . 3.94 111.544 174.453 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 6.9 ttt180 -44.71 -62.22 1.29 Allowed 'General case' 0 N--CA 1.465 0.294 0 N-CA-C 109.097 -0.705 . . . . 3.02 109.097 178.08 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -60.43 -37.93 82.47 Favored 'General case' 0 CA--C 1.515 -0.372 0 C-N-CA 125.651 1.58 . . . . 1.55 111.107 -177.253 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 1.6 tmt? -65.81 -33.01 74.86 Favored 'General case' 0 N--CA 1.451 -0.393 0 O-C-N 122.189 -0.319 . . . . 3.58 111.263 -174.593 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 5.2 p80 -92.8 -20.43 20.74 Favored 'General case' 0 CA--C 1.527 0.096 0 CA-C-O 117.159 -1.4 . . . . 1.08 112.708 177.35 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 76' ' ' SER . . . . . 0.429 ' O ' ' HD2' ' A' ' 82' ' ' ARG . 32.0 m -33.77 114.43 0.19 Allowed 'General case' 0 C--O 1.22 -0.491 0 C-N-CA 125.981 1.712 . . . . 1.63 112.446 -169.547 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 1.4 p -46.11 -39.96 10.24 Favored 'General case' 0 C--N 1.326 -0.441 0 C-N-CA 124.863 1.265 . . . . 2.3 110.832 -178.968 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 11.5 t0 -65.03 103.42 0.74 Allowed 'General case' 0 N--CA 1.451 -0.407 0 CA-C-O 121.823 0.821 . . . . 1.87 110.238 165.486 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 11.7 p80 -46.15 -37.7 7.32 Favored 'General case' 0 N--CA 1.455 -0.212 0 C-N-CA 123.574 0.75 . . . . 5.71 112.13 173.316 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -61.1 -47.05 88.09 Favored 'General case' 0 N--CA 1.451 -0.394 0 CA-C-N 118.378 0.535 . . . . 1.51 110.292 -178.555 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 2.9 mt-10 -52.8 -40.22 63.04 Favored 'General case' 0 CA--C 1.512 -0.484 0 CA-C-O 121.116 0.484 . . . . 3.13 111.365 177.348 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 82' ' ' ARG . . . . . 0.429 ' HD2' ' O ' ' A' ' 76' ' ' SER . 15.3 mtp180 -64.77 -56.49 13.25 Favored 'General case' 0 N--CA 1.45 -0.468 0 C-N-CA 119.173 -1.011 . . . . 3.31 108.343 178.762 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -56.34 -23.77 39.48 Favored 'General case' 0 C--O 1.223 -0.291 0 N-CA-C 113.28 0.844 . . . . 1.71 113.28 178.883 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 32.1 mttt -67.66 -45.3 75.68 Favored 'General case' 0 CA--C 1.517 -0.31 0 CA-C-N 120.242 1.383 . . . . 2.5 108.777 173.64 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 39.8 t -60.11 -53.48 48.0 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.614 0 CA-C-O 118.661 -0.685 . . . . 1.75 110.671 170.95 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 60.1 mt-30 -60.6 -44.59 96.11 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 120.394 1.452 . . . . 4.99 110.965 -171.125 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 22.4 tttt -59.87 -51.32 70.24 Favored 'General case' 0 N--CA 1.452 -0.362 0 C-N-CA 123.948 0.899 . . . . 3.02 110.6 175.751 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 38.9 m-20 -78.41 -8.24 58.26 Favored 'General case' 0 C--N 1.331 -0.212 0 C-N-CA 122.944 0.498 . . . . 1.59 111.474 -174.144 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -159.37 69.61 3.29 Favored Pre-proline 0 N--CA 1.447 -0.598 0 C-N-CA 125.013 1.325 . . . . 1.25 109.305 -173.144 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 36.2 Cg_endo -61.36 -25.76 80.61 Favored 'Trans proline' 0 N--CA 1.453 -0.907 0 C-N-CA 122.454 2.103 . . . . 1.74 110.759 -176.462 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 7.1 mttp -81.62 -52.96 6.64 Favored 'General case' 0 N--CA 1.449 -0.493 0 C-N-CA 123.211 0.604 . . . . 5.71 110.557 177.902 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 2.3 m -55.51 -39.9 71.1 Favored 'General case' 0 N--CA 1.467 0.385 0 CA-C-N 119.28 0.946 . . . . 1.7 111.296 -175.67 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 3.2 t80 -48.96 -65.67 0.53 Allowed 'General case' 0 CA--C 1.503 -0.836 0 CA-C-O 121.423 0.63 . . . . 5.96 112.562 175.261 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 44.7 tt0 -54.2 -31.98 54.44 Favored 'General case' 0 N--CA 1.44 -0.965 0 CA-C-N 113.926 -1.488 . . . . 1.86 109.727 -178.162 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 4.7 t80 -68.9 -58.53 4.01 Favored 'General case' 0 N--CA 1.451 -0.398 0 C-N-CA 122.87 0.468 . . . . 2.42 110.442 -173.102 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 35.5 mm -48.27 -46.41 13.75 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.139 0 C-N-CA 123.9 0.88 . . . . 2.94 109.961 172.279 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 12.4 t-20 -64.82 -32.7 74.52 Favored 'General case' 0 CA--C 1.535 0.373 0 CA-C-N 117.853 0.297 . . . . 2.44 111.631 -176.153 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 12.5 t70 . . . . . 0 N--CA 1.464 0.236 0 CA-C-O 121.61 0.719 . . . . 2.06 109.404 174.723 . . . . . . . . 0 0 . 1 . 029 nuclear orig core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 15.3 t80 . . . . . 0 CA--C 1.517 -0.29 0 N-CA-C 108.481 -0.933 . . . . 3.66 108.481 . . . . . . . . . 0 0 . 1 . 029 nuclear orig core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 0.6 OUTLIER -61.43 -34.5 61.57 Favored 'Isoleucine or valine' 0 CA--C 1.528 0.113 0 CA-C-O 118.864 -0.589 . . . . 1.85 112.579 175.547 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 4.6 t60 -56.44 -55.09 37.92 Favored 'General case' 0 C--N 1.341 0.211 0 N-CA-C 106.916 -1.513 . . . . 0.65 106.916 177.309 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 48.3 mt-10 -62.41 -32.11 72.9 Favored 'General case' 0 N--CA 1.452 -0.367 0 CA-C-O 118.709 -0.662 . . . . 2.63 111.802 179.608 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 17.7 t80 -59.19 -50.21 74.9 Favored 'General case' 0 N--CA 1.452 -0.326 0 CA-C-N 118.999 0.818 . . . . 3.37 109.618 177.34 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -51.87 -43.08 54.49 Favored Glycine 0 CA--C 1.529 0.909 0 N-CA-C 111.011 -0.836 . . . . 0.66 111.011 173.889 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 3.4 t60 -63.28 -53.04 59.04 Favored 'General case' 0 N--CA 1.453 -0.307 0 O-C-N 121.82 -0.812 . . . . 2.47 111.593 -177.738 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -63.65 -27.56 69.31 Favored 'General case' 0 N--CA 1.451 -0.388 0 C-N-CA 123.094 0.558 . . . . 2.06 110.172 -179.352 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 25.1 t -68.28 -42.39 84.44 Favored 'Isoleucine or valine' 0 C--O 1.235 0.307 0 O-C-N 121.342 -0.848 . . . . 2.44 109.646 177.049 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 2.8 t70 . . . . . 0 N--CA 1.451 -0.381 0 C-N-CA 120.204 -0.599 . . . . 2.8 111.837 176.209 . . . . . . . . 0 0 . 1 . 029 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 50.8 t0 . . . . . 0 N--CA 1.465 0.322 0 CA-C-O 122.335 1.064 . . . . 2.19 108.4 . . . . . . . . . 0 0 . 1 . 029 nuclear orig core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 2.0 mm -52.71 -51.6 34.34 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.29 0 C-N-CA 124.781 1.232 . . . . 1.94 110.211 -179.203 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 37.5 t80 -57.71 -31.54 66.52 Favored 'General case' 0 N--CA 1.454 -0.254 0 N-CA-C 113.044 0.757 . . . . 0.46 113.044 178.305 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . 0.412 ' HA ' ' HE2' ' A' ' 49' ' ' LYS . 1.0 OUTLIER -62.19 -44.8 95.79 Favored 'General case' 0 C--N 1.331 -0.216 0 O-C-N 120.967 -1.083 . . . . 2.04 111.091 -178.255 . . . . . . . . 3 3 . 1 . 029 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 17.8 tp10 -90.62 -61.61 1.64 Allowed 'General case' 0 CA--C 1.531 0.25 0 CA-C-O 122.442 1.115 . . . . 2.58 109.625 -177.141 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . 0.487 ' OE2' ' HE3' ' A' ' 91' ' ' LYS . 28.3 mm-40 -71.41 -34.23 70.16 Favored 'General case' 0 C--N 1.329 -0.305 0 C-N-CA 123.773 0.829 . . . . 2.43 109.889 -169.785 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . 0.43 ' HA2' ' CD1' ' A' ' 66' ' ' PHE . . . -69.84 38.8 0.4 Allowed Glycine 0 CA--C 1.528 0.889 0 C-N-CA 125.705 1.621 . . . . 0.4 113.894 168.162 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 34.3 t -153.37 37.82 0.48 Allowed 'General case' 0 N--CA 1.446 -0.656 0 O-C-N 121.133 -1.216 . . . . 2.42 108.191 159.371 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -141.18 -47.63 0.4 Allowed 'General case' 0 CA--C 1.518 -0.251 0 N-CA-C 112.384 0.513 . . . . 2.64 112.384 -169.203 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 37.7 mt -63.31 -36.76 84.77 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 120.808 0.337 . . . . 1.68 110.911 -176.361 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER 177.09 166.5 0.55 Allowed 'General case' 0 CA--C 1.529 0.172 0 C-N-CA 124.673 1.189 . . . . 1.64 108.289 -173.602 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 9.3 m -60.04 -35.07 74.31 Favored 'General case' 0 N--CA 1.454 -0.253 0 C-N-CA 123.212 0.605 . . . . 1.29 110.608 168.73 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -67.59 -10.75 54.83 Favored 'General case' 0 CA--C 1.533 0.324 0 C-N-CA 123.126 0.57 . . . . 2.13 111.716 175.359 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -93.05 -8.62 61.49 Favored Glycine 0 N--CA 1.445 -0.721 0 C-N-CA 124.887 1.232 . . . . 0.45 110.982 174.895 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 37.0 ttt180 -108.88 -11.58 14.99 Favored 'General case' 0 CA--C 1.528 0.118 0 CA-C-N 118.598 1.199 . . . . 3.41 111.88 177.725 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 31.9 p -65.33 -156.1 0.01 OUTLIER 'General case' 0 CA--C 1.541 0.611 0 N-CA-C 109.361 -0.607 . . . . 1.86 109.361 170.098 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 1.3 m-20 -52.82 145.84 11.7 Favored 'General case' 0 CA--C 1.53 0.188 0 O-C-N 120.119 -1.613 . . . . 1.91 110.312 -178.01 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 31.4 tt0 -60.97 -27.91 68.61 Favored 'General case' 0 CA--C 1.537 0.461 0 CA-C-O 122.118 0.961 . . . . 3.17 111.083 -177.595 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -58.62 -41.45 85.93 Favored 'General case' 0 N--CA 1.452 -0.351 0 C-N-CA 124.848 1.259 . . . . 1.58 112.447 170.626 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 6.0 mt-10 -71.73 -42.03 67.8 Favored 'General case' 0 C--O 1.219 -0.534 0 CA-C-O 118.163 -0.922 . . . . 1.79 110.323 176.405 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 66' ' ' PHE . . . . . 0.43 ' CD1' ' HA2' ' A' ' 52' ' ' GLY . 52.7 t80 -50.33 -52.92 32.65 Favored 'General case' 0 N--CA 1.456 -0.143 0 C-N-CA 123.377 0.671 . . . . 0.44 111.077 175.488 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 52.2 t80 -59.64 -42.98 93.98 Favored 'General case' 0 CA--C 1.539 0.555 0 O-C-N 121.712 -0.617 . . . . 0.66 110.53 177.003 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -64.1 -54.28 36.48 Favored 'General case' 0 CA--C 1.538 0.505 0 O-C-N 121.278 -0.889 . . . . 1.64 113.054 -175.124 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 1.4 pp20? -61.56 -37.48 83.98 Favored 'General case' 0 C--N 1.332 -0.195 0 O-C-N 120.97 -1.081 . . . . 3.9 110.174 175.523 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -58.73 -36.27 74.03 Favored 'General case' 0 N--CA 1.451 -0.409 0 CA-C-N 118.377 0.535 . . . . 1.77 110.938 173.761 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 41.6 t80 -63.68 -51.04 66.84 Favored 'General case' 0 CA--C 1.531 0.221 0 CA-C-N 119.758 1.163 . . . . 4.7 111.359 171.627 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 6.2 ttp180 -45.15 -54.14 7.22 Favored 'General case' 0 N--CA 1.468 0.426 0 C-N-CA 123.244 0.618 . . . . 2.89 109.463 177.311 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -67.25 -55.26 14.72 Favored 'General case' 0 C--N 1.329 -0.325 0 C-N-CA 126.615 1.966 . . . . 1.56 110.793 -174.24 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -56.82 -31.73 65.03 Favored 'General case' 0 N--CA 1.464 0.268 0 CA-C-N 119.576 1.08 . . . . 3.98 111.416 -177.622 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -90.72 -19.92 23.02 Favored 'General case' 0 N--CA 1.454 -0.233 0 CA-C-O 117.342 -1.313 . . . . 1.16 111.748 179.284 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 3.1 m -47.01 115.94 1.22 Allowed 'General case' 0 CA--C 1.507 -0.705 0 CA-C-N 119.953 1.251 . . . . 2.26 108.031 -174.815 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -46.12 -39.45 9.49 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 114.793 -1.094 . . . . 3.22 110.306 -179.533 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 18.0 t0 -57.3 104.78 0.18 Allowed 'General case' 0 N--CA 1.452 -0.337 0 CA-C-O 122.7 1.238 . . . . 2.04 111.556 168.562 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 1.9 p80 -46.73 -38.25 9.66 Favored 'General case' 0 N--CA 1.45 -0.428 0 CA-C-N 114.664 -1.153 . . . . 6.54 112.612 171.539 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -61.2 -58.76 6.98 Favored 'General case' 0 N--CA 1.45 -0.454 0 CA-C-N 119.276 0.944 . . . . 2.34 109.245 -176.346 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -48.27 -39.9 23.06 Favored 'General case' 0 N--CA 1.453 -0.275 0 C-N-CA 123.595 0.758 . . . . 3.68 112.101 179.125 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 12.8 mtt180 -64.23 -53.93 41.49 Favored 'General case' 0 C--N 1.328 -0.362 0 C-N-CA 120.441 -0.504 . . . . 4.19 110.904 178.6 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 1.1 mm? -62.06 -23.26 66.37 Favored 'General case' 0 N--CA 1.449 -0.486 0 CA-C-O 117.883 -1.056 . . . . 2.02 111.57 177.654 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 1.7 mptm? -64.57 -42.46 95.62 Favored 'General case' 0 C--O 1.224 -0.281 0 CA-C-N 120.857 1.662 . . . . 2.48 108.283 171.867 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 69.6 t -61.99 -63.45 0.81 Allowed 'Isoleucine or valine' 0 C--O 1.218 -0.557 0 CA-C-O 118.13 -0.938 . . . . 1.59 110.107 172.928 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -48.96 -47.47 43.89 Favored 'General case' 0 CA--C 1.536 0.412 0 CA-C-N 120.328 1.422 . . . . 2.85 111.704 -173.619 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 32.7 tttm -63.0 -50.53 70.39 Favored 'General case' 0 N--CA 1.452 -0.353 0 C-N-CA 124.449 1.1 . . . . 2.95 111.784 179.102 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 25.3 m-20 -86.78 5.16 37.86 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 119.038 -0.506 . . . . 1.43 110.997 -175.006 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -162.28 69.36 2.16 Favored Pre-proline 0 N--CA 1.447 -0.575 0 C-N-CA 125.54 1.536 . . . . 1.73 109.277 -176.112 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 90.3 Cg_endo -79.45 59.86 7.57 Favored 'Trans proline' 0 N--CA 1.458 -0.566 0 C-N-CA 124.214 3.276 . . . . 1.96 110.801 -173.659 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 91' ' ' LYS . . . . . 0.487 ' HE3' ' OE2' ' A' ' 51' ' ' GLU . 0.0 OUTLIER 175.89 -48.4 0.01 OUTLIER 'General case' 0 CA--C 1.531 0.232 0 C-N-CA 127.046 2.139 . . . . 3.24 109.713 -172.574 . . . . . . . . 3 3 . 1 . 029 nuclear orig core ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 8.6 m -57.74 -43.55 85.46 Favored 'General case' 0 CA--C 1.516 -0.333 0 O-C-N 121.101 -0.999 . . . . 1.54 111.445 179.991 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 3.7 t80 -54.28 -48.43 71.24 Favored 'General case' 0 CA--C 1.515 -0.402 0 C-N-CA 120.114 -0.635 . . . . 3.7 110.021 176.251 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 30.0 tt0 -60.82 -29.72 69.65 Favored 'General case' 0 N--CA 1.441 -0.888 0 CA-C-N 115.025 -0.989 . . . . 2.03 111.118 -179.799 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -63.41 -61.97 1.99 Allowed 'General case' 0 N--CA 1.463 0.205 0 C-N-CA 124.427 1.091 . . . . 2.1 108.919 -177.223 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 3.8 mp -53.35 -45.06 56.17 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.323 0 N-CA-C 108.48 -0.933 . . . . 2.07 108.48 177.246 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -57.69 -35.35 70.48 Favored 'General case' 0 C--O 1.225 -0.197 0 N-CA-C 112.352 0.501 . . . . 2.27 112.352 -179.655 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--N 1.334 -0.1 0 C-N-CA 124.845 1.258 . . . . 2.35 109.203 178.636 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 11.2 t80 . . . . . 0 CA--C 1.519 -0.236 0 CA-C-O 120.654 0.264 . . . . 3.95 110.677 . . . . . . . . . 0 0 . 1 . 030 nuclear orig core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 0.6 OUTLIER -69.46 -32.85 54.63 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.328 0 CA-C-O 118.809 -0.615 . . . . 1.77 112.571 178.894 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 9.3 t60 -59.94 -58.51 8.23 Favored 'General case' 0 CA--C 1.53 0.21 0 N-CA-C 107.227 -1.397 . . . . 0.95 107.227 175.775 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 1.5 mp0 -51.37 -44.55 62.16 Favored 'General case' 0 C--O 1.226 -0.135 0 C-N-CA 124.154 0.982 . . . . 4.04 110.634 176.697 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -54.2 -52.17 62.09 Favored 'General case' 0 CA--C 1.517 -0.322 0 C-N-CA 123.582 0.753 . . . . 4.04 109.505 179.884 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -45.97 -49.05 13.88 Favored Glycine 0 CA--C 1.524 0.646 0 N-CA-C 110.808 -0.917 . . . . 0.49 110.808 174.435 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 2.1 t-160 -59.16 -47.06 86.68 Favored 'General case' 0 N--CA 1.452 -0.346 0 O-C-N 122.015 -0.697 . . . . 2.58 111.393 179.209 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -61.03 -32.66 72.27 Favored 'General case' 0 N--CA 1.453 -0.294 0 O-C-N 121.635 -0.666 . . . . 1.88 110.47 178.438 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 40.4 t -67.63 -35.28 72.39 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.267 0 O-C-N 121.235 -0.915 . . . . 2.05 110.393 178.271 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 8.0 t0 . . . . . 0 N--CA 1.451 -0.391 0 CA-C-O 121.506 0.669 . . . . 1.9 110.983 176.611 . . . . . . . . 0 0 . 1 . 030 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 16.2 t70 . . . . . 0 N--CA 1.468 0.456 0 N-CA-C 109.112 -0.699 . . . . 2.2 109.112 . . . . . . . . . 0 0 . 1 . 030 nuclear orig core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 2.8 mm -54.69 -49.46 67.86 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.449 0 C-N-CA 125.338 1.455 . . . . 1.63 108.548 178.304 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 38.4 t80 -59.85 -26.35 65.76 Favored 'General case' 0 N--CA 1.453 -0.319 0 O-C-N 120.596 -1.315 . . . . 0.94 113.462 177.683 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . 0.561 ' HA ' ' HE2' ' A' ' 49' ' ' LYS . 9.0 mmpt? -70.04 -48.0 59.72 Favored 'General case' 0 CA--C 1.516 -0.339 0 O-C-N 120.095 -1.628 . . . . 2.58 110.859 -179.482 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 4.4 tp10 -87.51 -56.64 3.27 Favored 'General case' 0 CA--C 1.533 0.314 0 N-CA-C 109.039 -0.726 . . . . 2.27 109.039 -173.622 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . 0.473 ' OE1' ' HE3' ' A' ' 91' ' ' LYS . 19.0 mp0 -76.81 -31.87 57.25 Favored 'General case' 0 C--O 1.235 0.321 0 O-C-N 121.024 -1.048 . . . . 2.8 111.452 -175.952 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . 0.415 ' HA2' ' CD1' ' A' ' 66' ' ' PHE . . . -70.04 38.76 0.42 Allowed Glycine 0 CA--C 1.532 1.124 0 C-N-CA 124.997 1.284 . . . . 0.39 114.343 171.595 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 39.2 t -154.21 49.37 0.63 Allowed 'General case' 0 N--CA 1.448 -0.537 0 N-CA-C 107.234 -1.395 . . . . 2.77 107.234 153.692 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -145.34 -49.7 0.24 Allowed 'General case' 0 CA--C 1.516 -0.339 0 N-CA-C 112.644 0.609 . . . . 2.99 112.644 -177.306 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 17.5 mt -60.46 -35.54 76.12 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-O 120.891 0.377 . . . . 1.63 111.047 -172.962 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER 178.28 169.58 0.78 Allowed 'General case' 0 CA--C 1.53 0.209 0 C-N-CA 125.752 1.621 . . . . 1.51 107.487 -179.307 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 26.4 m -59.16 -33.36 70.82 Favored 'General case' 0 N--CA 1.454 -0.233 0 O-C-N 121.673 -0.642 . . . . 1.36 110.633 169.93 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -59.58 -34.19 72.4 Favored 'General case' 0 C--N 1.34 0.189 0 CA-C-N 118.31 0.505 . . . . 2.1 109.992 173.114 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -67.95 -9.91 57.67 Favored Glycine 0 C--O 1.22 -0.741 0 CA-C-O 119.074 -0.848 . . . . 0.42 111.836 178.184 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 41.3 ttt180 -107.77 -8.92 15.9 Favored 'General case' 0 N--CA 1.454 -0.237 0 CA-C-N 119.082 1.441 . . . . 4.35 112.582 178.084 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 68.7 p -69.45 -126.34 0.0 OUTLIER 'General case' 0 CA--C 1.537 0.461 0 CA-C-N 118.404 0.547 . . . . 2.0 111.196 179.456 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 4.2 t-20 -75.13 148.65 39.49 Favored 'General case' 0 N--CA 1.45 -0.43 0 O-C-N 120.081 -1.637 . . . . 1.87 107.497 176.156 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 30.7 tt0 -60.61 -31.98 71.12 Favored 'General case' 0 CA--C 1.538 0.5 0 CA-C-O 121.828 0.823 . . . . 3.26 110.37 179.425 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -61.36 -34.45 75.32 Favored 'General case' 0 CA--C 1.53 0.192 0 O-C-N 121.172 -0.955 . . . . 1.87 113.105 173.542 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 4.6 mt-10 -77.55 -39.27 46.48 Favored 'General case' 0 C--O 1.222 -0.378 0 O-C-N 121.016 -1.053 . . . . 2.07 110.137 179.246 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 66' ' ' PHE . . . . . 0.415 ' CD1' ' HA2' ' A' ' 52' ' ' GLY . 43.7 t80 -50.34 -45.66 55.16 Favored 'General case' 0 CA--C 1.532 0.253 0 C-N-CA 124.775 1.23 . . . . 0.46 110.959 170.434 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 72.1 t80 -65.86 -43.96 86.85 Favored 'General case' 0 CA--C 1.533 0.309 0 O-C-N 120.994 -1.067 . . . . 0.56 111.758 175.311 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -62.96 -53.98 45.63 Favored 'General case' 0 CA--C 1.537 0.449 0 O-C-N 121.381 -0.824 . . . . 1.6 112.002 -174.369 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -55.94 -40.97 73.94 Favored 'General case' 0 C--N 1.332 -0.182 0 O-C-N 120.92 -1.112 . . . . 3.89 111.299 169.868 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -55.99 -40.17 72.93 Favored 'General case' 0 C--O 1.223 -0.297 0 CA-C-N 119.122 0.874 . . . . 1.67 110.844 177.471 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 56.9 t80 -58.06 -49.93 75.19 Favored 'General case' 0 C--O 1.233 0.224 0 CA-C-N 119.683 1.129 . . . . 4.93 111.504 174.316 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 48.3 ttt180 -49.56 -53.8 21.66 Favored 'General case' 0 N--CA 1.467 0.377 0 N-CA-C 109.322 -0.621 . . . . 2.83 109.322 177.605 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -65.38 -34.24 77.84 Favored 'General case' 0 C--N 1.327 -0.392 0 C-N-CA 124.187 0.995 . . . . 1.53 110.289 -175.851 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER -60.04 -42.37 94.3 Favored 'General case' 0 C--N 1.333 -0.139 0 C-N-CA 123.77 0.828 . . . . 3.16 110.939 -176.341 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 9.3 p80 -95.13 -4.99 45.14 Favored 'General case' 0 N--CA 1.457 -0.113 0 CA-C-O 116.964 -1.493 . . . . 1.09 113.365 -178.306 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 12.4 m -40.92 126.29 2.48 Favored 'General case' 0 N--CA 1.452 -0.34 0 CA-C-O 123.222 1.487 . . . . 2.16 110.806 -168.349 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 1.1 p -52.82 -42.19 64.89 Favored 'General case' 0 N--CA 1.447 -0.584 0 CA-C-N 112.642 -2.072 . . . . 1.76 108.8 179.481 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 62.3 t0 -72.55 111.68 7.94 Favored 'General case' 0 N--CA 1.451 -0.414 0 CA-C-O 122.089 0.947 . . . . 2.07 108.673 168.885 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 4.2 t-160 -54.3 -33.05 57.91 Favored 'General case' 0 CA--C 1.532 0.268 0 CA-C-N 115.738 -0.665 . . . . 7.01 109.802 176.899 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -56.87 -52.19 66.1 Favored 'General case' 0 N--CA 1.451 -0.4 0 CA-C-N 117.904 0.32 . . . . 1.9 110.708 176.672 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 5.2 mt-10 -52.12 -39.57 60.06 Favored 'General case' 0 CA--C 1.514 -0.428 0 C-N-CA 123.365 0.666 . . . . 2.86 110.966 -177.59 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 2.4 mtp180 -61.92 -53.54 54.36 Favored 'General case' 0 N--CA 1.448 -0.546 0 C-N-CA 119.971 -0.692 . . . . 3.62 109.738 176.864 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 1.3 mm? -61.01 -24.53 66.23 Favored 'General case' 0 N--CA 1.453 -0.294 0 CA-C-O 117.421 -1.276 . . . . 1.88 112.936 177.655 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 2.0 mptm? -63.73 -43.11 97.5 Favored 'General case' 0 CA--C 1.522 -0.131 0 CA-C-N 121.499 1.954 . . . . 2.11 107.981 173.882 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 99.7 t -64.13 -63.3 0.89 Allowed 'Isoleucine or valine' 0 C--O 1.214 -0.808 0 CA-C-O 118.437 -0.792 . . . . 1.72 110.009 173.233 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -49.44 -38.57 29.88 Favored 'General case' 0 CA--C 1.532 0.256 0 CA-C-N 120.325 1.42 . . . . 2.89 112.277 -172.492 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 22.7 tttt -64.52 -58.98 4.88 Favored 'General case' 0 N--CA 1.45 -0.439 0 C-N-CA 124.81 1.244 . . . . 2.82 110.833 174.025 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 61.6 m-20 -80.48 2.37 25.54 Favored 'General case' 0 CA--C 1.535 0.373 0 C-N-CA 123.505 0.722 . . . . 1.45 111.815 -173.733 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -156.66 73.63 4.74 Favored Pre-proline 0 N--CA 1.446 -0.639 0 C-N-CA 126.802 2.041 . . . . 1.61 108.012 -175.387 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 62.1 Cg_endo -80.69 60.81 8.01 Favored 'Trans proline' 0 N--CA 1.454 -0.824 0 C-N-CA 124.057 3.171 . . . . 1.96 109.351 -179.837 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 91' ' ' LYS . . . . . 0.473 ' HE3' ' OE1' ' A' ' 51' ' ' GLU . 0.0 OUTLIER 171.28 -56.81 0.01 OUTLIER 'General case' 0 C--O 1.224 -0.269 0 C-N-CA 126.411 1.884 . . . . 3.32 110.466 -170.345 . . . . . . . . 3 3 . 1 . 030 nuclear orig core ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 1.4 m -53.69 -46.01 70.56 Favored 'General case' 0 N--CA 1.466 0.373 0 CA-C-N 119.95 1.25 . . . . 1.68 110.75 -179.534 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 8.6 t80 -61.21 -46.34 90.87 Favored 'General case' 0 CA--C 1.509 -0.599 0 CA-C-O 121.653 0.74 . . . . 3.96 110.187 178.852 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 8.1 tt0 -58.53 -30.95 67.48 Favored 'General case' 0 N--CA 1.441 -0.902 0 CA-C-N 114.482 -1.236 . . . . 1.93 110.126 -178.538 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -63.99 -68.74 0.32 Allowed 'General case' 0 N--CA 1.452 -0.349 0 C-N-CA 124.634 1.174 . . . . 1.44 108.753 -177.666 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 3.8 mp -49.86 -43.38 19.59 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.217 0 C-N-CA 123.457 0.703 . . . . 1.89 109.743 176.653 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 13.0 t30 -61.03 -35.42 76.83 Favored 'General case' 0 CA--C 1.531 0.241 0 O-C-N 121.961 -0.462 . . . . 2.04 111.94 -177.418 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 23.1 t70 . . . . . 0 CA--C 1.516 -0.362 0 C-N-CA 123.499 0.719 . . . . 2.12 109.624 173.777 . . . . . . . . 0 0 . 1 . 031 nuclear orig core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 49.7 t80 . . . . . 0 N--CA 1.463 0.204 0 CA-C-O 121.38 0.61 . . . . 5.49 110.685 . . . . . . . . . 0 0 . 1 . 031 nuclear orig core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 1.2 pt -63.05 -33.18 59.27 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.449 0 O-C-N 121.151 -0.968 . . . . 1.71 112.093 -178.488 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 2.6 t-160 -58.49 -49.27 77.98 Favored 'General case' 0 CA--C 1.532 0.268 0 N-CA-C 107.69 -1.226 . . . . 1.2 107.69 174.903 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 40.1 mt-10 -61.01 -36.56 79.82 Favored 'General case' 0 C--O 1.218 -0.554 0 C-N-CA 124.168 0.987 . . . . 2.73 109.752 -178.195 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 4.1 t80 -55.04 -50.23 69.61 Favored 'General case' 0 CA--C 1.522 -0.099 0 CA-C-N 119.354 0.979 . . . . 5.3 110.284 171.827 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -48.35 -50.23 23.98 Favored Glycine 0 CA--C 1.524 0.615 0 N-CA-C 111.454 -0.658 . . . . 0.64 111.454 172.768 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 2.0 t-160 -63.89 -44.93 91.51 Favored 'General case' 0 N--CA 1.45 -0.443 0 O-C-N 121.846 -0.796 . . . . 2.76 111.408 -177.533 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -55.86 -34.1 65.14 Favored 'General case' 0 N--CA 1.448 -0.536 0 C-N-CA 123.575 0.75 . . . . 2.07 109.125 -178.318 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 98.5 t -68.37 -42.37 84.13 Favored 'Isoleucine or valine' 0 N--CA 1.457 -0.101 0 C-N-CA 119.782 -0.767 . . . . 2.15 111.986 174.474 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 3.7 t70 . . . . . 0 N--CA 1.465 0.312 0 CA-C-O 122.284 1.04 . . . . 2.34 111.428 173.262 . . . . . . . . 0 0 . 1 . 031 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 45.9 t0 . . . . . 0 N--CA 1.461 0.097 0 N-CA-C 108.817 -0.809 . . . . 2.48 108.817 . . . . . . . . . 0 0 . 1 . 031 nuclear orig core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 7.1 mm -50.2 -54.44 8.44 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.523 0 C-N-CA 125.32 1.448 . . . . 1.59 109.202 174.387 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 30.4 t80 -61.83 -26.5 68.16 Favored 'General case' 0 CA--C 1.531 0.245 0 O-C-N 120.927 -1.108 . . . . 0.44 113.232 179.578 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 49' ' ' LYS . . . . . 0.522 ' HA ' ' HE2' ' A' ' 49' ' ' LYS . 9.6 mmpt? -72.24 -45.01 62.01 Favored 'General case' 0 CA--C 1.516 -0.347 0 O-C-N 119.675 -1.891 . . . . 2.29 111.684 -175.513 . . . . . . . . 2 2 . 1 . 031 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -86.72 -64.68 1.11 Allowed 'General case' 0 C--N 1.328 -0.349 0 N-CA-C 106.774 -1.565 . . . . 3.71 106.774 -177.701 . . . . . . . . 2 2 . 1 . 031 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 15.0 mm-40 -65.09 -36.05 83.09 Favored 'General case' 0 N--CA 1.452 -0.367 0 CA-C-N 115.677 -0.692 . . . . 2.16 110.165 -170.925 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . 0.446 ' HA2' ' CD1' ' A' ' 66' ' ' PHE . . . -69.07 37.6 0.3 Allowed Glycine 0 CA--C 1.527 0.82 0 C-N-CA 125.582 1.563 . . . . 0.31 114.44 171.761 . . . . . . . . 2 2 . 1 . 031 nuclear orig core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 11.2 t -147.71 23.4 1.11 Allowed 'General case' 0 N--CA 1.451 -0.401 0 O-C-N 121.047 -1.267 . . . . 2.69 110.47 155.592 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 13.7 t30 -134.11 -23.13 1.75 Allowed 'General case' 0 C--N 1.342 0.28 0 N-CA-C 113.958 1.096 . . . . 2.73 113.958 -164.1 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 14.6 mt -76.91 -37.02 56.21 Favored 'General case' 0 C--O 1.226 -0.144 0 O-C-N 121.891 -0.505 . . . . 1.62 110.571 176.124 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER 178.2 169.91 0.76 Allowed 'General case' 0 CA--C 1.532 0.273 0 C-N-CA 125.795 1.638 . . . . 1.59 107.096 -175.796 . . . . . . . . 2 2 . 1 . 031 nuclear orig core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 7.2 m -60.11 -33.88 72.72 Favored 'General case' 0 N--CA 1.454 -0.266 0 O-C-N 121.708 -0.62 . . . . 1.88 110.721 168.596 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -67.77 -9.11 41.27 Favored 'General case' 0 N--CA 1.467 0.41 0 N-CA-C 112.328 0.492 . . . . 2.26 112.328 174.498 . . . . . . . . 2 2 . 1 . 031 nuclear orig core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -87.83 -3.91 79.67 Favored Glycine 0 C--O 1.221 -0.683 0 CA-C-O 118.472 -1.182 . . . . 0.57 111.09 173.366 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 3.6 ttp85 -118.0 -7.97 10.8 Favored 'General case' 0 CA--C 1.53 0.183 0 CA-C-N 119.292 1.546 . . . . 4.69 112.253 -177.155 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 25.4 p -67.39 -148.13 0.01 OUTLIER 'General case' 0 CA--C 1.537 0.477 0 C-N-CA 124.958 1.303 . . . . 1.96 109.079 172.165 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 3.7 m120 -56.7 143.77 35.12 Favored 'General case' 0 N--CA 1.455 -0.176 0 O-C-N 119.753 -1.842 . . . . 2.53 109.176 176.049 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 15.6 tm-20 -57.04 -32.86 66.62 Favored 'General case' 0 C--O 1.223 -0.338 0 CA-C-O 121.538 0.685 . . . . 3.58 110.078 178.086 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -56.62 -35.37 68.22 Favored 'General case' 0 N--CA 1.45 -0.466 0 O-C-N 121.357 -0.839 . . . . 1.93 112.676 176.332 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 8.9 mt-10 -75.62 -42.18 52.38 Favored 'General case' 0 CA--C 1.512 -0.485 0 O-C-N 121.4 -0.812 . . . . 2.09 110.834 175.184 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 66' ' ' PHE . . . . . 0.446 ' CD1' ' HA2' ' A' ' 52' ' ' GLY . 37.4 t80 -49.47 -56.49 9.57 Favored 'General case' 0 N--CA 1.454 -0.275 0 C-N-CA 123.782 0.833 . . . . 0.42 110.818 175.104 . . . . . . . . 2 2 . 1 . 031 nuclear orig core ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 90.5 t80 -62.14 -48.37 80.43 Favored 'General case' 0 N--CA 1.451 -0.424 0 C-N-CA 123.19 0.596 . . . . 0.59 110.686 179.697 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -59.02 -39.4 81.81 Favored 'General case' 0 CA--C 1.544 0.737 0 O-C-N 121.112 -0.992 . . . . 1.49 112.54 -178.113 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 37.4 mm-40 -64.37 -42.21 96.31 Favored 'General case' 0 CA--C 1.518 -0.288 0 C-N-CA 124.563 1.145 . . . . 4.58 109.901 172.314 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -53.69 -43.05 68.6 Favored 'General case' 0 N--CA 1.449 -0.477 0 CA-C-O 118.282 -0.866 . . . . 1.6 109.694 178.485 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 10.8 t80 -59.15 -49.48 77.7 Favored 'General case' 0 N--CA 1.463 0.211 0 CA-C-N 119.437 1.017 . . . . 3.21 111.898 173.13 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -50.27 -55.95 13.26 Favored 'General case' 0 CA--C 1.531 0.223 0 O-C-N 121.588 -0.695 . . . . 3.51 110.408 179.301 . . . . . . . . 2 2 . 1 . 031 nuclear orig core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -63.66 -30.56 71.65 Favored 'General case' 0 C--N 1.325 -0.495 0 C-N-CA 125.819 1.648 . . . . 1.78 110.846 -179.756 . . . . . . . . 2 2 . 1 . 031 nuclear orig core ' A' A ' 74' ' ' MET . . . . . 0.44 ' HA ' ' CE2' ' A' ' 93' ' ' PHE . 1.1 tmt? -61.97 -39.92 93.82 Favored 'General case' 0 N--CA 1.451 -0.378 0 C-N-CA 123.281 0.632 . . . . 3.48 111.976 -177.364 . . . . . . . . 2 2 . 1 . 031 nuclear orig core ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 27.6 p80 -90.06 -45.97 8.8 Favored 'General case' 0 C--O 1.225 -0.225 0 CA-C-O 116.758 -1.592 . . . . 1.17 110.064 179.992 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 14.8 m 5.4 111.1 0.0 OUTLIER 'General case' 0 N--CA 1.469 0.492 0 C-N-CA 129.09 2.956 . . . . 2.12 114.719 -174.514 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 3.1 p -46.47 -44.58 17.63 Favored 'General case' 0 C--O 1.235 0.325 0 C-N-CA 125.38 1.472 . . . . 2.13 110.837 179.417 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 11.3 t0 -66.17 104.31 1.15 Allowed 'General case' 0 N--CA 1.449 -0.482 0 N-CA-C 108.673 -0.862 . . . . 2.18 108.673 167.279 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 41.4 m80 -55.86 -30.96 62.32 Favored 'General case' 0 N--CA 1.454 -0.26 0 CA-C-O 118.994 -0.527 . . . . 6.77 111.084 176.747 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -58.13 -50.95 71.69 Favored 'General case' 0 N--CA 1.446 -0.668 0 CA-C-O 117.937 -1.03 . . . . 1.35 109.767 176.708 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 1.9 mt-10 -46.89 -41.2 15.47 Favored 'General case' 0 N--CA 1.464 0.236 0 CA-C-N 119.583 1.083 . . . . 3.1 111.083 179.128 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -62.94 -51.66 66.06 Favored 'General case' 0 C--N 1.327 -0.383 0 N-CA-C 109.359 -0.608 . . . . 4.14 109.359 179.149 . . . . . . . . 2 2 . 1 . 031 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 1.7 mm? -66.56 -18.97 65.66 Favored 'General case' 0 N--CA 1.453 -0.301 0 CA-C-O 118.11 -0.948 . . . . 1.71 113.261 176.922 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 2.0 mptm? -65.56 -48.51 72.14 Favored 'General case' 0 CA--C 1.518 -0.279 0 CA-C-N 120.629 1.559 . . . . 2.35 106.805 169.346 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 45.6 t -63.9 -46.57 93.8 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.663 0 CA-C-O 117.482 -1.247 . . . . 1.85 111.809 177.955 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 30.3 mt-30 -60.9 -52.23 65.91 Favored 'General case' 0 N--CA 1.462 0.126 0 CA-C-N 122.114 2.233 . . . . 2.59 111.261 179.61 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -65.13 -40.46 94.5 Favored 'General case' 0 CA--C 1.532 0.254 0 O-C-N 121.654 -0.653 . . . . 3.79 110.463 -172.717 . . . . . . . . 2 2 . 1 . 031 nuclear orig core ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 6.9 m-20 -75.32 -21.75 58.18 Favored 'General case' 0 C--O 1.226 -0.172 0 CA-C-O 118.772 -0.632 . . . . 1.42 110.771 177.948 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -143.54 77.29 15.41 Favored Pre-proline 0 C--O 1.237 0.444 0 C-N-CA 124.15 0.98 . . . . 1.69 110.217 -173.238 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 94.2 Cg_endo -79.75 66.67 8.77 Favored 'Trans proline' 0 N--CA 1.453 -0.856 0 C-N-CA 124.024 3.15 . . . . 1.94 109.8 -173.27 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER 168.34 -53.07 0.01 OUTLIER 'General case' 0 C--O 1.224 -0.273 0 C-N-CA 126.923 2.089 . . . . 3.04 111.234 -171.718 . . . . . . . . 2 2 . 1 . 031 nuclear orig core ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 4.3 m -55.38 -47.02 76.47 Favored 'General case' 0 N--CA 1.466 0.338 0 CA-C-N 120.19 1.359 . . . . 1.56 110.567 -177.525 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 93' ' ' PHE . . . . . 0.44 ' CE2' ' HA ' ' A' ' 74' ' ' MET . 8.2 t80 -59.92 -48.11 83.03 Favored 'General case' 0 CA--C 1.511 -0.528 0 CA-C-O 121.552 0.691 . . . . 2.93 110.163 178.278 . . . . . . . . 2 2 . 1 . 031 nuclear orig core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 8.3 tt0 -56.76 -31.31 64.47 Favored 'General case' 0 N--CA 1.441 -0.875 0 CA-C-N 114.602 -1.181 . . . . 1.91 110.163 -178.019 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 7.1 t80 -64.86 -56.25 14.54 Favored 'General case' 0 N--CA 1.453 -0.319 0 C-N-CA 124.02 0.928 . . . . 1.34 109.798 -176.362 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 2.9 mp -57.93 -44.62 87.04 Favored 'Isoleucine or valine' 0 N--CA 1.457 -0.119 0 N-CA-C 108.44 -0.948 . . . . 1.96 108.44 177.321 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 24.3 t30 -60.61 -31.8 70.95 Favored 'General case' 0 CA--C 1.532 0.273 0 C-N-CA 122.285 0.234 . . . . 2.0 111.544 -177.427 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 CA--C 1.521 -0.145 0 C-N-CA 124.552 1.141 . . . . 2.64 109.17 176.086 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.474 1.229 0 N-CA-C 110.194 -1.163 . . . . 10.86 110.194 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' SER . . . . . 0.444 ' O ' ' HE2' ' A' ' 3' ' ' LYS . 59.9 m 69.15 68.42 0.27 Allowed 'General case' 0 N--CA 1.453 -0.298 0 N-CA-C 115.652 1.723 . . . . 11.24 115.652 139.595 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . 0.444 ' HE2' ' O ' ' A' ' 2' ' ' SER . 0.0 OUTLIER -139.65 154.85 47.63 Favored 'General case' 0 C--N 1.334 -0.093 0 N-CA-C 107.197 -1.408 . . . . 14.43 107.197 158.523 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -102.74 -100.54 2.56 Favored Glycine 0 CA--C 1.506 -0.508 0 N-CA-C 106.721 -2.552 . . . . 11.19 106.721 -1.177 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 33.2 m -73.52 -166.94 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.439 -0.979 0 N-CA-C 108.016 -1.105 . . . . 11.85 108.016 150.771 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . 0.497 ' C ' ' H ' ' A' ' 8' ' ' ARG . 3.1 pt-20 -87.05 70.5 10.26 Favored 'General case' 0 N--CA 1.445 -0.713 0 CA-C-O 122.818 1.294 . . . . 8.73 112.856 175.578 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -73.75 23.51 0.08 Allowed 'General case' 0 CA--C 1.543 0.678 0 CA-C-N 112.988 -1.915 . . . . 7.98 111.803 137.252 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . 0.497 ' H ' ' C ' ' A' ' 6' ' ' GLU 0.348 0.3 OUTLIER 81.39 -36.87 0.12 Allowed 'General case' 0 N--CA 1.454 -0.267 0 C-N-CA 129.402 3.081 . . . . 7.42 113.189 161.241 . . . . . . . . 4 4 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 6.6 m-20 -43.21 -41.51 3.85 Favored 'General case' 0 CA--C 1.516 -0.347 0 N-CA-C 113.47 0.915 . . . . 2.79 113.47 170.659 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -57.19 -53.14 61.48 Favored 'General case' 0 N--CA 1.45 -0.435 0 C-N-CA 120.272 -0.571 . . . . 3.17 110.181 -177.162 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 2.6 m -77.71 -48.58 16.35 Favored 'General case' 0 N--CA 1.44 -0.964 0 N-CA-C 108.309 -0.997 . . . . 1.88 108.309 -166.305 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 7.4 pt-20 -74.28 -27.4 60.71 Favored 'General case' 0 N--CA 1.449 -0.483 0 CA-C-N 115.298 -0.864 . . . . 3.02 110.198 -175.025 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -66.68 -56.39 13.29 Favored Glycine 0 N--CA 1.446 -0.651 0 N-CA-C 108.855 -1.698 . . . . 0.74 108.855 168.772 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 1.8 t80 -54.27 -46.21 72.61 Favored 'General case' 0 C--O 1.224 -0.271 0 CA-C-N 118.544 1.172 . . . . 3.45 110.755 -173.855 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 1.8 pt -71.94 -29.91 35.0 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.299 0 N-CA-C 113.349 0.87 . . . . 1.65 113.349 176.666 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 4.9 t60 -59.67 -57.65 12.02 Favored 'General case' 0 CA--C 1.533 0.297 0 N-CA-C 106.6 -1.63 . . . . 0.73 106.6 174.662 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 28.1 mt-10 -48.1 -45.09 32.41 Favored 'General case' 0 C--O 1.223 -0.311 0 C-N-CA 126.631 1.972 . . . . 2.65 110.368 174.55 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 1.4 t80 -59.23 -48.15 82.69 Favored 'General case' 0 CA--C 1.519 -0.239 0 C-N-CA 123.421 0.688 . . . . 3.16 110.184 179.857 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -51.34 -45.18 52.93 Favored Glycine 0 CA--C 1.523 0.553 0 N-CA-C 110.476 -1.05 . . . . 0.51 110.476 171.835 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 3.9 t60 -64.42 -34.05 77.29 Favored 'General case' 0 N--CA 1.45 -0.451 0 O-C-N 121.628 -0.925 . . . . 2.73 111.826 179.689 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -71.29 -30.09 65.84 Favored 'General case' 0 N--CA 1.454 -0.267 0 O-C-N 121.505 -0.747 . . . . 1.51 109.884 174.594 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 60.5 t -67.25 -39.94 83.98 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.299 0 O-C-N 120.951 -1.093 . . . . 1.74 109.641 174.55 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 15.3 t0 -62.31 -26.79 68.61 Favored 'General case' 0 C--N 1.327 -0.376 0 C-N-CA 123.669 0.788 . . . . 2.02 111.468 175.465 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 6.6 t70 -73.72 -54.92 6.98 Favored 'General case' 0 N--CA 1.452 -0.353 0 N-CA-C 108.122 -1.066 . . . . 1.84 108.122 -175.893 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 61.0 t80 -63.47 -43.3 97.7 Favored 'General case' 0 CA--C 1.52 -0.187 0 N-CA-C 109.012 -0.736 . . . . 3.49 109.012 -179.296 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -56.35 -38.2 71.05 Favored 'General case' 0 N--CA 1.445 -0.705 0 CA-C-O 118.154 -0.927 . . . . 1.96 110.877 176.381 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -75.74 -31.28 56.46 Favored Glycine 0 CA--C 1.526 0.759 0 CA-C-N 119.721 1.146 . . . . 1.06 111.935 -179.429 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 1.0 OUTLIER -69.0 -43.2 75.29 Favored 'General case' 0 CA--C 1.532 0.264 0 O-C-N 121.295 -1.121 . . . . 2.24 109.525 179.918 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -83.81 -33.88 24.84 Favored 'General case' 0 N--CA 1.45 -0.438 0 C-N-CA 125.615 1.566 . . . . 2.2 113.361 -177.658 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 21.2 mt -131.28 149.98 52.34 Favored 'General case' 0 N--CA 1.45 -0.456 0 N-CA-C 108.016 -1.105 . . . . 2.65 108.016 -168.263 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 2.1 t70 77.73 -161.14 0.03 OUTLIER 'General case' 0 C--N 1.327 -0.375 0 N-CA-C 107.41 -1.329 . . . . 4.7 107.41 -154.748 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 1.3 mmpt? -162.1 -36.82 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.366 0 O-C-N 121.532 -0.73 . . . . 7.41 111.284 -135.292 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 31.4 t30 -128.09 154.79 45.32 Favored 'General case' 0 C--O 1.221 -0.435 0 N-CA-C 108.889 -0.782 . . . . 6.38 108.889 -170.205 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 41.1 tt0 2.43 -47.35 0.0 OUTLIER 'General case' 0 N--CA 1.472 0.632 0 C-N-CA 130.087 3.355 . . . . 7.98 116.584 151.669 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 4.9 m -53.19 109.5 0.44 Allowed 'General case' 0 CA--C 1.536 0.436 0 C-N-CA 124.717 1.207 . . . . 5.71 109.923 175.904 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 27.3 t70 -79.48 -19.22 50.31 Favored 'General case' 0 CA--C 1.538 0.491 0 N-CA-C 114.567 1.321 . . . . 5.97 114.567 -145.426 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 8.3 mp -129.47 161.57 30.1 Favored 'General case' 0 CA--C 1.538 0.495 0 C-N-CA 126.077 1.751 . . . . 2.56 107.763 -170.115 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 1.9 p -73.99 -12.14 15.07 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.657 0 CA-C-N 120.233 1.378 . . . . 2.22 111.807 -179.212 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 12.0 t -44.44 146.1 0.75 Allowed 'General case' 0 CA--C 1.532 0.27 0 C-N-CA 124.102 0.961 . . . . 3.36 111.082 167.313 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 49.8 t30 50.56 44.54 27.23 Favored 'General case' 0 N--CA 1.453 -0.318 0 C-N-CA 125.097 1.359 . . . . 6.2 112.263 178.269 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 12.1 t -120.78 -170.4 1.99 Allowed 'General case' 0 N--CA 1.447 -0.607 0 N-CA-C 106.726 -1.583 . . . . 3.38 106.726 160.586 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . 0.414 ' HE3' ' OD2' ' A' ' 98' ' ' ASP . 9.5 tttm 71.91 -68.81 0.21 Allowed 'General case' 0 N--CA 1.465 0.324 0 C-N-CA 124.862 1.265 . . . . 6.5 111.942 178.197 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 15.6 tttm -141.71 58.73 1.5 Allowed 'General case' 0 CA--C 1.529 0.154 0 C-N-CA 123.934 0.894 . . . . 6.58 108.848 -171.529 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 18.4 m-30 9.13 92.42 0.01 OUTLIER 'General case' 0 N--CA 1.466 0.36 0 C-N-CA 127.978 2.511 . . . . 5.61 113.849 178.594 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . 0.336 3.6 tt 53.57 12.81 0.05 OUTLIER 'Isoleucine or valine' 0 CA--C 1.554 1.103 0 C-N-CA 125.858 1.663 . . . . 3.27 115.297 161.046 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 3.3 t0 -58.36 -61.65 2.42 Favored 'General case' 0 N--CA 1.47 0.567 0 C-N-CA 126.291 1.837 . . . . 2.51 110.518 176.071 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 3.9 mm -54.5 -47.43 71.17 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.301 0 C-N-CA 125.372 1.469 . . . . 1.57 108.616 -172.099 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 26.0 t80 -65.98 -37.1 85.11 Favored 'General case' 0 N--CA 1.449 -0.511 0 O-C-N 121.7 -0.625 . . . . 0.51 112.315 176.792 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . 0.466 ' CA ' ' HE2' ' A' ' 49' ' ' LYS . 0.0 OUTLIER -64.27 -45.74 86.75 Favored 'General case' 0 CA--C 1.514 -0.432 0 C-N-CA 118.007 -1.477 . . . . 2.46 111.244 -172.735 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 5.4 tp10 -84.31 -66.22 0.92 Allowed 'General case' 0 N--CA 1.446 -0.626 0 N-CA-C 108.242 -1.022 . . . . 2.18 108.242 -177.919 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 9.2 mm-40 -69.94 -32.13 70.24 Favored 'General case' 0 CA--C 1.533 0.29 0 O-C-N 121.439 -0.788 . . . . 2.04 110.555 -169.052 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -68.89 37.04 0.29 Allowed Glycine 0 CA--C 1.529 0.931 0 C-N-CA 125.992 1.758 . . . . 0.3 114.546 172.154 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 76.7 p -140.03 17.71 2.46 Favored 'General case' 0 N--CA 1.448 -0.546 0 O-C-N 121.224 -1.162 . . . . 2.69 111.401 160.093 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 30.4 t-20 -131.67 -39.3 1.12 Allowed 'General case' 0 C--N 1.339 0.146 0 N-CA-C 112.099 0.407 . . . . 2.34 112.099 -162.533 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 24.6 mt -63.05 -35.87 81.68 Favored 'General case' 0 CA--C 1.533 0.299 0 O-C-N 121.745 -0.597 . . . . 1.55 110.972 -176.257 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 4.4 t 168.32 175.55 0.04 OUTLIER 'General case' 0 CA--C 1.534 0.351 0 C-N-CA 127.463 2.305 . . . . 1.86 107.673 -179.052 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 6.9 m -59.69 -37.57 79.2 Favored 'General case' 0 N--CA 1.454 -0.249 0 C-N-CA 124.425 1.09 . . . . 1.42 111.378 176.348 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -63.97 -28.41 69.8 Favored 'General case' 0 N--CA 1.463 0.204 0 C-N-CA 122.938 0.495 . . . . 1.49 111.258 173.233 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -68.01 -3.71 31.11 Favored Glycine 0 CA--C 1.523 0.592 0 O-C-N 121.39 -0.819 . . . . 0.58 111.715 172.707 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 1.8 ttt180 -129.87 6.11 5.05 Favored 'General case' 0 N--CA 1.451 -0.402 0 CA-C-N 118.574 1.187 . . . . 2.84 112.231 -174.994 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 58.2 p -75.05 -132.03 0.01 OUTLIER 'General case' 0 CA--C 1.536 0.41 0 N-CA-C 108.123 -1.066 . . . . 1.87 108.123 169.59 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 1.5 m-20 -73.05 155.94 39.26 Favored 'General case' 0 CA--C 1.527 0.079 0 O-C-N 120.283 -1.511 . . . . 1.87 108.447 176.238 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 35.8 tt0 -62.09 -33.48 74.51 Favored 'General case' 0 CA--C 1.534 0.345 0 C-N-CA 119.512 -0.875 . . . . 2.56 110.463 178.531 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -60.82 -21.08 62.79 Favored 'General case' 0 C--N 1.331 -0.236 0 O-C-N 121.117 -0.989 . . . . 1.54 113.596 176.9 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 4.9 mt-10 -85.49 -49.57 7.97 Favored 'General case' 0 CA--C 1.509 -0.615 0 O-C-N 121.331 -0.856 . . . . 1.9 110.919 171.254 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 49.8 t80 -41.11 -49.85 3.45 Favored 'General case' 0 CA--C 1.535 0.376 0 C-N-CA 123.874 0.87 . . . . 0.37 111.666 171.869 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 77.9 t80 -62.59 -47.54 83.36 Favored 'General case' 0 CA--C 1.533 0.3 0 C-N-CA 123.509 0.724 . . . . 0.45 111.314 175.674 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -59.93 -53.46 57.61 Favored 'General case' 0 CA--C 1.535 0.386 0 C-N-CA 124.15 0.98 . . . . 1.43 112.264 -175.672 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 8.0 pt-20 -66.06 -31.07 71.73 Favored 'General case' 0 N--CA 1.451 -0.412 0 O-C-N 120.575 -1.328 . . . . 3.24 112.079 173.527 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -59.33 -40.57 86.74 Favored 'General case' 0 N--CA 1.451 -0.391 0 CA-C-N 119.749 1.159 . . . . 1.41 109.122 174.452 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 23.1 t80 -58.6 -51.4 70.08 Favored 'General case' 0 C--O 1.23 0.055 0 C-N-CA 124.546 1.138 . . . . 3.38 110.92 175.002 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 26.0 ttt180 -46.39 -66.87 0.34 Allowed 'General case' 0 N--CA 1.464 0.247 0 C-N-CA 123.4 0.68 . . . . 2.55 109.548 175.147 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -55.89 -35.77 66.9 Favored 'General case' 0 N--CA 1.45 -0.458 0 C-N-CA 126.19 1.796 . . . . 1.49 109.491 -173.271 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 2.1 ttp -59.64 -37.96 80.09 Favored 'General case' 0 C--O 1.234 0.242 0 N-CA-C 112.283 0.475 . . . . 3.26 112.283 -176.489 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 11.0 p80 -100.01 2.14 43.16 Favored 'General case' 0 CA--C 1.53 0.208 0 N-CA-C 114.459 1.281 . . . . 1.26 114.459 -177.566 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 70.3 m -49.51 128.51 17.56 Favored 'General case' 0 N--CA 1.448 -0.54 0 CA-C-N 120.43 1.468 . . . . 1.52 112.797 -168.518 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 4.1 p -50.96 -45.51 60.79 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 112.97 -1.923 . . . . 1.85 108.88 172.9 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 22.5 t0 -69.22 99.02 1.09 Allowed 'General case' 0 N--CA 1.449 -0.493 0 N-CA-C 107.241 -1.392 . . . . 2.22 107.241 162.951 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 36.8 p-80 -62.86 -30.18 71.31 Favored 'General case' 0 N--CA 1.45 -0.444 0 CA-C-N 115.342 -0.845 . . . . 4.9 112.241 -178.346 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -59.32 -39.42 83.04 Favored 'General case' 0 C--N 1.326 -0.453 0 O-C-N 121.83 -0.543 . . . . 1.53 110.189 174.402 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 2.6 tt0 -52.91 -35.92 58.83 Favored 'General case' 0 N--CA 1.466 0.326 0 CA-C-O 121.643 0.735 . . . . 2.99 110.483 176.817 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 18.6 mtp180 -67.57 -48.19 67.59 Favored 'General case' 0 CA--C 1.519 -0.248 0 N-CA-C 109.262 -0.644 . . . . 3.1 109.262 179.561 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 1.5 mm? -62.89 -23.82 67.52 Favored 'General case' 0 N--CA 1.452 -0.338 0 CA-C-O 117.702 -1.142 . . . . 1.5 112.31 177.848 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 2.5 mptm? -62.09 -44.43 96.68 Favored 'General case' 0 C--O 1.225 -0.234 0 CA-C-N 120.822 1.646 . . . . 1.88 108.349 170.282 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 96.7 t -61.29 -57.94 9.84 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.486 0 CA-C-O 117.467 -1.254 . . . . 1.51 110.962 176.107 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 57.0 mt-30 -55.51 -49.24 73.11 Favored 'General case' 0 N--CA 1.466 0.36 0 CA-C-N 121.603 2.001 . . . . 2.37 111.7 -176.355 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 76.6 tttt -53.92 -49.69 68.08 Favored 'General case' 0 N--CA 1.446 -0.645 0 C-N-CA 123.74 0.816 . . . . 2.57 110.92 179.963 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 3.0 m-20 -83.54 -9.0 59.23 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 118.918 -0.563 . . . . 1.68 111.727 -175.327 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -160.87 73.95 2.7 Favored Pre-proline 0 C--O 1.238 0.466 0 C-N-CA 124.991 1.317 . . . . 1.22 109.669 -170.628 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 84.9 Cg_endo -77.08 22.48 0.56 Allowed 'Trans proline' 0 CA--C 1.537 0.647 0 C-N-CA 123.521 2.814 . . . . 1.44 112.707 -173.41 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 4.7 ptmt -141.61 -43.15 0.36 Allowed 'General case' 0 N--CA 1.451 -0.423 0 C-N-CA 125.799 1.64 . . . . 3.37 109.397 -175.829 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 4.4 m -57.61 -46.09 84.52 Favored 'General case' 0 CA--C 1.517 -0.306 0 CA-C-N 119.924 1.238 . . . . 1.48 111.265 172.247 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 22.5 t80 -56.85 -49.25 76.04 Favored 'General case' 0 CA--C 1.505 -0.78 0 C-N-CA 119.835 -0.746 . . . . 2.91 109.55 177.432 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 55.3 tt0 -58.76 -28.59 66.05 Favored 'General case' 0 N--CA 1.439 -1.0 0 CA-C-N 114.9 -1.045 . . . . 1.77 110.844 178.721 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 18.4 t80 -67.13 -53.31 31.81 Favored 'General case' 0 N--CA 1.454 -0.231 0 CA-C-N 119.367 0.985 . . . . 1.24 109.615 -178.812 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 2.0 mp -63.99 -30.27 49.56 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.246 0 N-CA-C 108.315 -0.994 . . . . 1.79 108.315 177.284 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -73.73 -25.17 60.06 Favored 'General case' 0 CA--C 1.538 0.509 0 O-C-N 121.735 -0.603 . . . . 2.41 111.196 179.642 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 98' ' ' ASP . . . . . 0.414 ' OD2' ' HE3' ' A' ' 42' ' ' LYS . 34.2 t0 -69.29 -49.92 51.51 Favored 'General case' 0 CA--C 1.507 -0.674 0 N-CA-C 106.335 -1.728 . . . . 2.76 106.335 172.45 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 87.2 mm-40 -80.57 31.03 0.29 Allowed 'General case' 0 N--CA 1.435 -1.192 0 CA-C-N 113.895 -1.502 . . . . 3.16 111.021 172.923 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 4.7 tp -60.69 109.95 0.53 Allowed 'Isoleucine or valine' 0 CA--C 1.514 -0.43 0 N-CA-C 105.365 -2.087 . . . . 5.01 105.365 165.484 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 101' ' ' LYS . . . . . 0.592 ' HE2' ' HA ' ' A' ' 101' ' ' LYS 0.314 0.0 OUTLIER -142.77 -151.67 0.37 Allowed 'General case' 0 N--CA 1.442 -0.831 0 C-N-CA 117.558 -1.657 . . . . 8.21 112.03 177.719 . . . . . . . . 4 4 . 1 . 001 nuclear orig full ' A' A ' 102' ' ' PHE . . . . . . . . . . . . . 2.6 t80 -156.22 35.57 0.33 Allowed 'General case' 0 N--CA 1.446 -0.647 0 N-CA-C 106.755 -1.572 . . . . 7.25 106.755 -143.565 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 3.6 tp -71.23 114.71 9.92 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.66 0 N-CA-C 106.727 -1.583 . . . . 4.06 106.727 177.124 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 104' ' ' ILE . . . . . . . . . . . . 0.265 0.9 OUTLIER 70.31 172.22 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.55 0.953 0 O-C-N 124.117 0.886 . . . . 6.99 109.691 167.705 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 105' ' ' ASN . . . . . 0.406 ' HA ' ' C ' ' A' ' 106' ' ' SER 0.314 16.0 m120 101.35 105.85 0.01 OUTLIER 'General case' 0 N--CA 1.469 0.522 2 C-N-CA 137.631 6.373 . . . . 7.28 112.707 -13.268 . . . . . . . . 4 3 . 1 . 001 nuclear orig full ' A' A ' 106' ' ' SER . . . . . 0.406 ' C ' ' HA ' ' A' ' 105' ' ' ASN . 13.1 t . . . . . 0 C--O 1.247 0.956 0 C-N-CA 131.581 3.952 . . . . 8.01 112.005 14.592 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.471 0.989 0 N-CA-C 109.302 -1.519 . . . . 23.86 109.302 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -176.04 -85.48 0.0 OUTLIER 'General case' 0 C--O 1.226 -0.173 0 N-CA-C 107.919 -1.141 . . . . 24.83 107.919 173.974 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 6.6 ptpp? -163.9 170.66 16.45 Favored 'General case' 0 N--CA 1.455 -0.215 0 N-CA-C 108.194 -1.039 . . . . 28.78 108.194 -176.897 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 102.21 140.51 11.1 Favored Glycine 0 C--N 1.332 0.321 0 N-CA-C 108.63 -1.788 . . . . 20.61 108.63 -173.473 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 33.1 m -104.87 -162.35 0.14 Allowed 'Isoleucine or valine' 0 N--CA 1.442 -0.835 0 N-CA-C 108.271 -1.011 . . . . 19.04 108.271 175.553 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 1.3 pp20? -79.77 129.11 34.2 Favored 'General case' 0 N--CA 1.448 -0.531 0 N-CA-C 108.835 -0.802 . . . . 13.07 108.835 170.923 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -160.61 36.14 0.16 Allowed 'General case' 0 N--CA 1.446 -0.667 0 C-N-CA 124.756 1.222 . . . . 11.54 109.087 173.191 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 3.3 mmm180 -143.19 98.24 3.23 Favored 'General case' 0 N--CA 1.453 -0.301 0 C-N-CA 123.563 0.745 . . . . 10.99 109.156 -175.013 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 2.4 m120 -52.21 -33.51 41.38 Favored 'General case' 0 CA--C 1.516 -0.343 0 N-CA-C 112.47 0.545 . . . . 2.85 112.47 173.482 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 4.8 t70 -58.85 -54.69 44.23 Favored 'General case' 0 N--CA 1.448 -0.532 0 C-N-CA 123.21 0.604 . . . . 2.42 110.81 176.406 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 15.1 m -69.32 -48.02 62.74 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 121.899 0.857 . . . . 2.08 110.794 -175.944 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 20.9 tp10 -67.01 -30.67 70.84 Favored 'General case' 0 CA--C 1.534 0.359 0 C-N-CA 126.387 1.875 . . . . 4.96 109.751 -176.359 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -71.59 -43.0 53.75 Favored Glycine 0 N--CA 1.448 -0.557 0 N-CA-C 110.322 -1.111 . . . . 0.84 110.322 170.314 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -55.45 -52.85 62.27 Favored 'General case' 0 C--O 1.227 -0.127 0 CA-C-N 118.369 1.084 . . . . 4.98 110.297 -174.941 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER -63.58 -36.01 74.79 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.488 0 N-CA-C 112.838 0.681 . . . . 1.93 112.838 177.664 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 2.5 t60 -57.23 -57.34 13.04 Favored 'General case' 0 C--N 1.341 0.235 0 N-CA-C 107.115 -1.439 . . . . 0.62 107.115 177.659 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 38.7 mt-10 -59.67 -40.37 87.55 Favored 'General case' 0 N--CA 1.452 -0.362 0 C-N-CA 123.712 0.805 . . . . 2.17 110.479 -178.248 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -53.15 -48.74 67.7 Favored 'General case' 0 CA--C 1.518 -0.26 0 CA-C-N 118.849 0.749 . . . . 4.56 110.319 175.842 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -48.72 -47.09 30.89 Favored Glycine 0 CA--C 1.525 0.7 0 N-CA-C 110.715 -0.954 . . . . 0.61 110.715 174.913 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 2.3 t-160 -65.05 -44.5 88.84 Favored 'General case' 0 C--O 1.224 -0.282 0 O-C-N 122.149 -0.618 . . . . 2.6 111.682 179.493 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -61.72 -32.76 73.0 Favored 'General case' 0 N--CA 1.453 -0.302 0 O-C-N 120.915 -1.116 . . . . 1.98 109.933 -179.385 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 78.8 t -71.91 -36.35 57.59 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.306 0 O-C-N 121.519 -0.738 . . . . 2.5 109.292 176.267 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 8.9 t0 -57.52 -27.21 62.38 Favored 'General case' 0 N--CA 1.453 -0.288 0 C-N-CA 123.491 0.717 . . . . 2.03 111.401 173.793 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 14.7 t70 -71.74 -55.78 7.02 Favored 'General case' 0 N--CA 1.451 -0.423 0 N-CA-C 109.053 -0.721 . . . . 1.98 109.053 -178.127 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 60.7 t80 -64.39 -54.78 27.35 Favored 'General case' 0 CA--C 1.518 -0.262 0 CA-C-N 115.957 -0.565 . . . . 3.29 109.5 -176.896 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -55.06 -33.8 63.03 Favored 'General case' 0 N--CA 1.448 -0.564 0 CA-C-O 118.59 -0.719 . . . . 2.85 111.222 176.507 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -68.31 -38.54 87.5 Favored Glycine 0 CA--C 1.522 0.531 0 CA-C-N 119.59 1.086 . . . . 1.46 111.485 178.314 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -69.83 -45.79 67.06 Favored 'General case' 0 N--CA 1.453 -0.279 0 O-C-N 122.338 -0.507 . . . . 3.26 110.185 -177.795 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -79.84 -32.18 40.53 Favored 'General case' 0 N--CA 1.451 -0.381 0 C-N-CA 124.772 1.229 . . . . 2.38 112.986 -175.82 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 12.8 mt -127.27 103.36 7.36 Favored 'General case' 0 N--CA 1.451 -0.423 0 N-CA-C 107.243 -1.392 . . . . 3.56 107.243 -169.06 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -126.13 153.1 45.04 Favored 'General case' 0 N--CA 1.454 -0.238 0 N-CA-C 109.219 -0.66 . . . . 5.33 109.219 -176.167 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -164.99 98.12 0.74 Allowed 'General case' 0 N--CA 1.452 -0.375 0 N-CA-C 108.524 -0.917 . . . . 10.38 108.524 173.349 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 6.9 t-20 62.39 135.27 0.01 OUTLIER 'General case' 0 C--O 1.222 -0.376 0 C-N-CA 128.567 2.747 . . . . 10.75 111.299 -171.357 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 13.6 tt0 47.0 60.91 3.12 Favored 'General case' 0 CA--C 1.532 0.278 0 C-N-CA 124.338 1.055 . . . . 11.7 110.124 -179.564 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 22.2 p -57.9 84.95 0.01 OUTLIER 'General case' 0 N--CA 1.454 -0.232 0 C-N-CA 126.639 1.976 . . . . 7.35 112.284 -170.258 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -156.0 106.47 2.43 Favored 'General case' 0 N--CA 1.449 -0.502 0 N-CA-C 106.691 -1.596 . . . . 5.35 106.691 -179.333 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 5.4 mp 66.88 150.94 0.06 Allowed 'General case' 0 CA--C 1.539 0.52 0 C-N-CA 125.377 1.471 . . . . 3.29 112.166 177.844 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 7.8 p -87.27 35.94 0.06 OUTLIER 'Isoleucine or valine' 0 CA--C 1.538 0.489 0 O-C-N 119.674 -1.891 . . . . 3.76 110.855 -179.448 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 5.0 t -112.14 -41.01 4.04 Favored 'General case' 0 C--O 1.23 0.064 0 O-C-N 121.153 -0.967 . . . . 4.1 109.901 175.651 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 9.5 m120 -74.36 68.94 1.58 Allowed 'General case' 0 CA--C 1.531 0.218 0 C-N-CA 123.628 0.771 . . . . 6.0 110.436 -177.419 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -163.29 70.49 0.24 Allowed 'General case' 0 N--CA 1.451 -0.408 0 O-C-N 120.771 -1.206 . . . . 3.45 108.966 -178.31 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -151.61 68.05 0.9 Allowed 'General case' 0 CA--C 1.521 -0.17 0 O-C-N 121.05 -1.031 . . . . 9.74 108.754 174.843 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER 68.18 -75.05 0.07 Allowed 'General case' 0 C--O 1.225 -0.226 0 C-N-CA 125.244 1.418 . . . . 7.59 110.218 -174.889 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 23.7 p90 -156.4 87.72 1.05 Allowed 'General case' 0 C--O 1.222 -0.343 0 CA-C-N 119.43 1.014 . . . . 10.96 108.521 172.107 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 27.9 pt 37.93 57.78 0.19 Allowed 'Isoleucine or valine' 0 N--CA 1.47 0.54 0 C-N-CA 124.422 1.089 . . . . 3.61 112.107 177.524 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 4.9 t0 -86.23 -56.76 3.3 Favored 'General case' 0 C--N 1.33 -0.248 0 C-N-CA 124.591 1.156 . . . . 2.39 109.935 -173.044 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 7.6 mm -48.92 -57.83 1.47 Allowed 'Isoleucine or valine' 0 CA--C 1.531 0.216 0 C-N-CA 125.897 1.679 . . . . 1.56 110.079 179.499 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 21.6 t80 -60.0 -29.76 68.69 Favored 'General case' 0 N--CA 1.451 -0.41 0 C-N-CA 124.038 0.935 . . . . 0.52 111.962 179.82 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -69.14 -45.09 70.98 Favored 'General case' 0 N--CA 1.453 -0.315 0 O-C-N 120.289 -1.507 . . . . 2.09 110.956 -175.597 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 3.9 tp10 -86.84 -60.62 1.93 Allowed 'General case' 0 CA--C 1.532 0.266 0 CA-C-O 122.253 1.025 . . . . 2.48 109.349 -178.088 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 22.1 mm-40 -72.6 -28.79 62.99 Favored 'General case' 0 C--O 1.235 0.313 0 O-C-N 121.519 -0.738 . . . . 2.55 110.358 -171.348 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . 0.411 ' HA2' ' CD1' ' A' ' 66' ' ' PHE . . . -70.89 39.92 0.53 Allowed Glycine 0 CA--C 1.534 1.234 0 C-N-CA 124.838 1.209 . . . . 0.37 113.743 169.829 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 24.3 m -151.82 36.47 0.56 Allowed 'General case' 0 CA--C 1.529 0.161 0 C-N-CA 125.638 1.575 . . . . 2.84 108.746 159.779 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 1.3 m-80 -141.65 -47.25 0.37 Allowed 'General case' 0 CA--C 1.515 -0.381 0 O-C-N 122.052 -0.405 . . . . 2.54 112.074 -172.893 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 23.7 mt -63.81 -34.04 77.03 Favored 'General case' 0 C--N 1.332 -0.156 0 C-N-CA 120.294 -0.562 . . . . 1.61 111.227 -172.201 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER 177.82 169.43 0.7 Allowed 'General case' 0 C--N 1.331 -0.208 0 C-N-CA 124.937 1.295 . . . . 1.76 107.775 -173.575 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 39.4 m -61.56 -36.8 81.66 Favored 'General case' 0 N--CA 1.456 -0.146 0 O-C-N 121.81 -0.556 . . . . 1.34 110.677 168.767 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 4.7 m-85 -67.36 -7.58 25.98 Favored 'General case' 0 N--CA 1.465 0.316 0 CA-C-N 118.359 0.527 . . . . 1.92 112.164 172.87 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -82.59 -8.82 85.59 Favored Glycine 0 N--CA 1.441 -1.024 0 CA-C-O 118.024 -1.431 . . . . 0.53 110.934 173.569 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 4.8 ttt-85 -116.39 -9.15 11.54 Favored 'General case' 0 CA--C 1.529 0.166 0 CA-C-N 119.897 1.849 . . . . 3.9 112.283 -177.3 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 22.3 p -72.35 -136.51 0.01 OUTLIER 'General case' 0 CA--C 1.536 0.437 0 C-N-CA 123.366 0.666 . . . . 2.02 109.376 177.601 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -65.87 146.47 54.7 Favored 'General case' 0 N--CA 1.454 -0.264 0 O-C-N 119.784 -1.822 . . . . 2.16 108.187 178.182 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 61.6 tt0 -55.7 -34.28 64.94 Favored 'General case' 0 CA--C 1.533 0.301 0 CA-C-O 121.651 0.739 . . . . 2.92 110.564 178.21 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -59.44 -36.76 76.53 Favored 'General case' 0 N--CA 1.452 -0.36 0 C-N-CA 123.334 0.654 . . . . 1.49 112.523 176.45 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 9.1 mt-10 -72.27 -43.53 64.16 Favored 'General case' 0 N--CA 1.455 -0.224 0 O-C-N 121.402 -0.811 . . . . 2.45 109.989 177.461 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 66' ' ' PHE . . . . . 0.411 ' CD1' ' HA2' ' A' ' 52' ' ' GLY . 43.6 t80 -50.58 -50.91 52.5 Favored 'General case' 0 N--CA 1.454 -0.257 0 C-N-CA 124.089 0.955 . . . . 0.35 111.086 173.543 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 63.2 t80 -61.56 -46.78 88.43 Favored 'General case' 0 N--CA 1.454 -0.249 0 C-N-CA 123.308 0.643 . . . . 0.65 110.521 178.3 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -59.42 -48.45 81.61 Favored 'General case' 0 CA--C 1.536 0.418 0 O-C-N 121.615 -0.678 . . . . 1.67 111.36 -176.646 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 5.6 mm-40 -58.23 -45.35 87.85 Favored 'General case' 0 CA--C 1.52 -0.191 0 C-N-CA 123.324 0.65 . . . . 4.03 110.406 172.737 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -56.21 -39.66 72.83 Favored 'General case' 0 N--CA 1.453 -0.281 0 CA-C-N 118.927 0.785 . . . . 1.41 109.97 -179.555 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 1.4 t80 -60.58 -48.79 80.22 Favored 'General case' 0 CA--C 1.531 0.246 0 C-N-CA 124.475 1.11 . . . . 3.95 110.716 174.187 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 3.3 tmm_? -51.98 -54.51 28.87 Favored 'General case' 0 CA--C 1.535 0.388 0 C-N-CA 124.669 1.188 . . . . 3.61 110.595 178.042 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -62.77 -33.83 75.99 Favored 'General case' 0 C--N 1.326 -0.431 0 C-N-CA 126.463 1.905 . . . . 1.64 110.665 179.659 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -53.37 -45.94 69.43 Favored 'General case' 0 C--N 1.331 -0.217 0 C-N-CA 123.556 0.742 . . . . 3.3 111.888 -175.671 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 14.8 p80 -96.97 -19.03 19.07 Favored 'General case' 0 C--O 1.225 -0.201 0 CA-C-O 116.341 -1.79 . . . . 2.54 114.481 -179.778 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 10.0 m -18.9 117.42 0.02 OUTLIER 'General case' 0 C--N 1.345 0.376 0 C-N-CA 126.962 2.105 . . . . 2.23 113.237 -176.856 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 1.8 p -45.46 -44.32 12.19 Favored 'General case' 0 N--CA 1.45 -0.467 0 C-N-CA 126.097 1.759 . . . . 2.43 110.06 -178.808 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 59.1 t0 -75.68 107.46 7.86 Favored 'General case' 0 N--CA 1.451 -0.376 0 C-N-CA 118.097 -1.441 . . . . 1.91 109.161 169.182 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 3.4 p-80 -41.31 -36.97 0.89 Allowed 'General case' 0 CA--C 1.531 0.244 0 C-N-CA 124.202 1.001 . . . . 5.72 112.821 170.493 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -58.24 -45.88 86.95 Favored 'General case' 0 N--CA 1.45 -0.468 0 C-N-CA 122.841 0.456 . . . . 1.92 110.985 -178.822 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 9.2 mt-10 -59.49 -35.28 73.83 Favored 'General case' 0 N--CA 1.455 -0.219 0 CA-C-N 118.396 0.544 . . . . 2.52 110.921 -179.532 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 5.6 mtp180 -64.57 -50.52 66.94 Favored 'General case' 0 C--N 1.328 -0.346 0 N-CA-C 108.651 -0.87 . . . . 3.76 108.651 178.575 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 1.4 mm? -62.05 -25.11 67.49 Favored 'General case' 0 N--CA 1.449 -0.485 0 CA-C-O 118.113 -0.946 . . . . 1.73 111.836 174.715 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 21.5 mmtp -68.26 -39.44 82.21 Favored 'General case' 0 CA--C 1.514 -0.416 0 CA-C-N 121.071 1.759 . . . . 4.0 109.221 176.528 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 72.0 t -61.41 -65.97 0.45 Allowed 'Isoleucine or valine' 0 C--O 1.218 -0.57 0 CA-C-O 117.39 -1.29 . . . . 1.89 109.656 168.616 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 2.0 mt-30 -48.03 -45.64 32.31 Favored 'General case' 0 N--CA 1.469 0.494 0 CA-C-N 121.281 1.855 . . . . 2.95 112.531 -173.906 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 11.4 tttt -60.67 -59.58 5.17 Favored 'General case' 0 N--CA 1.45 -0.459 0 C-N-CA 125.111 1.365 . . . . 4.47 110.428 177.812 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 64.8 m-20 -84.85 14.56 4.68 Favored 'General case' 0 CA--C 1.532 0.287 0 CA-C-O 118.791 -0.623 . . . . 1.59 110.951 -175.559 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -170.1 71.45 0.62 Allowed Pre-proline 0 N--CA 1.448 -0.552 0 C-N-CA 126.011 1.725 . . . . 1.23 109.024 -178.473 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 94.2 Cg_endo -81.56 52.51 4.29 Favored 'Trans proline' 0 N--CA 1.459 -0.541 0 C-N-CA 124.001 3.134 . . . . 1.82 110.721 -175.756 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -170.47 -44.81 0.02 OUTLIER 'General case' 0 CA--C 1.534 0.365 0 C-N-CA 126.55 1.94 . . . . 4.0 109.376 174.646 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 5.6 m -52.17 -47.91 65.26 Favored 'General case' 0 N--CA 1.467 0.406 0 CA-C-N 119.082 0.856 . . . . 1.67 111.862 177.951 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 13.0 t80 -57.69 -47.6 81.89 Favored 'General case' 0 CA--C 1.513 -0.462 0 O-C-N 121.684 -0.635 . . . . 2.98 110.643 177.451 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 2.3 tt0 -57.55 -29.01 64.05 Favored 'General case' 0 N--CA 1.443 -0.794 0 CA-C-N 114.874 -1.057 . . . . 1.89 110.6 -178.512 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 1.9 t80 -60.83 -60.81 3.21 Favored 'General case' 0 N--CA 1.456 -0.14 0 C-N-CA 124.558 1.143 . . . . 1.38 110.078 -178.562 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 3.6 mp -58.88 -42.19 85.06 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.227 0 N-CA-C 108.501 -0.926 . . . . 1.86 108.501 178.07 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 1.1 m-20 -56.54 -40.02 74.39 Favored 'General case' 0 CA--C 1.534 0.35 0 CA-C-N 117.812 0.278 . . . . 2.21 111.577 -179.833 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -63.84 -49.78 71.48 Favored 'General case' 0 C--O 1.231 0.099 0 C-N-CA 125.416 1.486 . . . . 2.65 108.796 -178.5 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 23.0 mm100 -75.85 79.86 2.76 Favored 'General case' 0 N--CA 1.453 -0.304 0 N-CA-C 109.489 -0.56 . . . . 3.44 109.489 173.376 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 6.8 pt -48.41 113.52 0.22 Allowed 'Isoleucine or valine' 0 N--CA 1.453 -0.293 0 C-N-CA 123.084 0.554 . . . . 7.24 109.523 176.884 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 52.8 pttt -43.03 -46.54 5.61 Favored 'General case' 0 C--O 1.224 -0.258 0 C-N-CA 124.278 1.031 . . . . 11.18 111.978 -173.63 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 102' ' ' PHE . . . . . . . . . . . . . 24.6 t80 33.69 49.61 0.26 Allowed 'General case' 0 CA--C 1.532 0.277 0 C-N-CA 127.238 2.215 . . . . 7.77 112.367 173.492 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -134.34 129.94 53.64 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.693 0 N-CA-C 103.547 -2.76 . . . . 5.51 103.547 179.379 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 104' ' ' ILE . . . . . . . . . . . . . 15.2 tt -140.85 145.09 25.87 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.557 0 N-CA-C 105.878 -1.897 . . . . 9.13 105.878 -179.35 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 10.2 p-10 -147.63 171.62 15.32 Favored 'General case' 0 C--N 1.327 -0.389 0 N-CA-C 108.527 -0.916 . . . . 8.76 108.527 -171.378 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--O 1.248 0.975 0 N-CA-C 105.591 -2.003 . . . . 10.2 105.591 165.056 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . 0.485 ' HA3' ' OE1' ' A' ' 17' ' ' GLU . . . . . . . . 0 N--CA 1.471 1.026 0 N-CA-C 109.691 -1.364 . . . . 11.67 109.691 . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 8.1 t -59.54 178.35 0.16 Allowed 'General case' 0 CA--C 1.532 0.285 0 C-N-CA 124.583 1.153 . . . . 11.69 111.017 173.774 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -152.71 139.34 18.77 Favored 'General case' 0 N--CA 1.453 -0.284 0 N-CA-C 107.916 -1.142 . . . . 15.52 107.916 -178.18 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 155.98 -165.32 32.64 Favored Glycine 0 N--CA 1.451 -0.366 0 N-CA-C 108.592 -1.803 . . . . 11.56 108.592 -179.473 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 34.5 m -103.99 -161.81 0.13 Allowed 'Isoleucine or valine' 0 N--CA 1.44 -0.934 0 N-CA-C 106.98 -1.489 . . . . 12.29 106.98 159.727 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 8.3 pt-20 -79.18 119.13 21.84 Favored 'General case' 0 N--CA 1.448 -0.528 0 CA-C-O 122.016 0.912 . . . . 9.3 111.024 173.986 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -156.49 43.02 0.38 Allowed 'General case' 0 N--CA 1.449 -0.52 0 C-N-CA 124.299 1.04 . . . . 7.98 110.26 177.765 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 21.2 mmm180 73.77 -69.52 0.18 Allowed 'General case' 0 N--CA 1.467 0.402 0 C-N-CA 124.976 1.31 . . . . 9.64 109.868 -179.794 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 3.2 m120 -45.74 -37.37 5.85 Favored 'General case' 0 CA--C 1.517 -0.324 0 C-N-CA 125.541 1.537 . . . . 3.29 113.889 179.17 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 14.3 t70 -64.55 -51.14 64.35 Favored 'General case' 0 N--CA 1.448 -0.558 0 CA-C-N 117.67 0.214 . . . . 2.5 110.805 177.39 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 9.2 m -65.3 -51.45 60.6 Favored 'General case' 0 N--CA 1.454 -0.272 0 CA-C-O 121.805 0.812 . . . . 1.93 110.231 -175.807 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . 0.406 ' HA ' ' CD1' ' A' ' 15' ' ' ILE . 9.3 pt-20 -72.12 -26.64 62.2 Favored 'General case' 0 N--CA 1.451 -0.417 0 CA-C-N 115.773 -0.649 . . . . 3.01 110.538 -175.651 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -65.62 -47.67 75.02 Favored Glycine 0 CA--C 1.527 0.806 0 N-CA-C 110.742 -0.943 . . . . 1.02 110.742 169.335 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 17.3 t80 -60.98 -49.19 78.44 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 118.09 0.945 . . . . 4.42 109.779 -175.061 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . 0.406 ' CD1' ' HA ' ' A' ' 12' ' ' GLU . 1.7 pt -67.86 -32.19 55.4 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.208 0 O-C-N 121.269 -0.894 . . . . 1.99 112.833 175.624 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER -57.18 -54.36 47.65 Favored 'General case' 0 C--N 1.341 0.206 0 N-CA-C 106.693 -1.595 . . . . 0.71 106.693 175.752 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . 0.485 ' OE1' ' HA3' ' A' ' 1' ' ' GLY . 33.3 mt-10 -52.2 -47.64 65.48 Favored 'General case' 0 N--CA 1.454 -0.27 0 C-N-CA 125.278 1.431 . . . . 2.6 109.766 -179.555 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -52.8 -50.84 62.8 Favored 'General case' 0 C--O 1.227 -0.107 0 C-N-CA 123.344 0.658 . . . . 4.76 111.558 174.824 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -49.13 -46.17 33.9 Favored Glycine 0 CA--C 1.526 0.732 0 N-CA-C 110.632 -0.987 . . . . 0.49 110.632 176.676 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 2.0 t-160 -62.59 -46.47 88.13 Favored 'General case' 0 N--CA 1.45 -0.45 0 O-C-N 122.061 -0.67 . . . . 2.59 111.028 178.316 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -61.25 -28.97 69.55 Favored 'General case' 0 N--CA 1.455 -0.224 0 C-N-CA 123.376 0.67 . . . . 2.1 110.856 -178.636 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 80.4 t -65.92 -41.26 89.57 Favored 'Isoleucine or valine' 0 C--O 1.234 0.264 0 O-C-N 121.037 -1.039 . . . . 1.95 110.069 176.61 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -65.81 -20.73 66.36 Favored 'General case' 0 N--CA 1.453 -0.302 0 CA-C-N 116.715 -0.221 . . . . 2.47 111.591 178.232 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 13.0 t70 -73.04 -52.26 15.04 Favored 'General case' 0 N--CA 1.454 -0.235 0 CA-C-O 122.086 0.946 . . . . 2.36 108.483 -175.868 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 61.9 t80 -57.34 -45.41 84.32 Favored 'General case' 0 N--CA 1.455 -0.223 0 CA-C-N 115.581 -0.736 . . . . 3.41 109.763 175.297 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -59.65 -30.16 68.55 Favored 'General case' 0 CA--C 1.535 0.373 0 O-C-N 121.654 -0.654 . . . . 1.98 112.199 176.416 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -74.46 -21.86 78.22 Favored Glycine 0 CA--C 1.524 0.611 0 CA-C-N 119.231 0.923 . . . . 1.51 112.575 179.964 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 1.1 t80 -88.67 -46.4 9.06 Favored 'General case' 0 N--CA 1.456 -0.168 0 CA-C-N 117.569 0.684 . . . . 2.47 110.146 178.34 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -75.73 -35.56 60.2 Favored 'General case' 0 CA--C 1.514 -0.424 0 C-N-CA 124.224 1.009 . . . . 2.81 112.546 -176.369 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 9.1 mt -113.97 -163.01 0.84 Allowed 'General case' 0 N--CA 1.448 -0.574 0 N-CA-C 105.987 -1.857 . . . . 2.81 105.987 -176.874 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 15.6 t0 48.23 74.68 0.16 Allowed 'General case' 0 CA--C 1.539 0.546 0 CA-C-O 122.641 1.21 . . . . 4.42 114.2 169.688 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -72.59 -39.06 67.64 Favored 'General case' 0 N--CA 1.465 0.275 0 O-C-N 120.508 -1.37 . . . . 9.2 112.826 -166.979 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 50.4 t30 -86.61 134.56 33.62 Favored 'General case' 0 C--O 1.224 -0.26 0 N-CA-C 106.895 -1.521 . . . . 7.49 106.895 179.328 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 34.3 tp60 49.7 50.89 17.52 Favored 'General case' 0 CA--C 1.539 0.552 0 C-N-CA 123.034 0.533 . . . . 7.71 110.452 -170.597 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 49.1 m -54.93 102.47 0.07 Allowed 'General case' 0 C--N 1.342 0.273 0 CA-C-N 118.182 0.447 . . . . 9.01 110.075 174.675 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 39.8 t0 -145.72 -77.27 0.2 Allowed 'General case' 0 N--CA 1.452 -0.366 0 N-CA-C 107.1 -1.444 . . . . 5.2 107.1 -172.739 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 4.5 mp -142.51 140.56 31.88 Favored 'General case' 0 C--N 1.339 0.132 0 N-CA-C 107.233 -1.395 . . . . 2.64 107.233 171.194 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 9.6 p -62.31 -12.55 8.72 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.54 0 N-CA-C 112.759 0.651 . . . . 2.41 112.759 -170.892 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 8.1 t -47.21 -36.38 8.74 Favored 'General case' 0 N--CA 1.454 -0.244 0 C-N-CA 125.629 1.572 . . . . 3.09 113.496 179.992 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 37.1 t-20 -88.9 50.49 1.97 Allowed 'General case' 0 CA--C 1.531 0.234 0 CA-C-N 119.784 1.175 . . . . 7.5 110.895 -168.812 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 13.8 t -166.02 -140.25 0.04 OUTLIER 'General case' 0 CA--C 1.536 0.419 0 O-C-N 121.526 -0.734 . . . . 3.59 109.28 -171.01 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 17.88 93.5 0.01 OUTLIER 'General case' 0 N--CA 1.47 0.539 0 C-N-CA 129.088 2.955 . . . . 6.62 114.126 172.549 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 3.7 tttp 100.44 -47.56 0.0 OUTLIER 'General case' 0 N--CA 1.464 0.268 0 C-N-CA 128.066 2.546 . . . . 8.89 107.25 177.143 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 19.7 t80 91.32 98.61 0.02 OUTLIER 'General case' 0 CA--C 1.528 0.115 0 C-N-CA 127.175 2.19 . . . . 5.9 108.864 169.267 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 32.8 pt 43.27 -126.4 0.03 OUTLIER 'Isoleucine or valine' 0 CA--C 1.542 0.645 0 C-N-CA 125.048 1.339 . . . . 5.3 111.796 -173.846 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 26.6 t70 69.06 -72.84 0.1 Allowed 'General case' 0 N--CA 1.468 0.456 0 C-N-CA 127.101 2.161 . . . . 2.63 112.047 174.945 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 8.1 mm -48.34 -53.17 6.67 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.392 0 C-N-CA 126.732 2.013 . . . . 2.02 109.421 175.179 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 32.3 t80 -64.42 -34.24 77.74 Favored 'General case' 0 C--O 1.224 -0.256 0 O-C-N 121.93 -0.481 . . . . 0.53 112.15 176.069 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . 0.41 ' HA ' ' HE2' ' A' ' 49' ' ' LYS . 10.3 mmpt? -63.11 -46.45 87.26 Favored 'General case' 0 N--CA 1.453 -0.288 0 O-C-N 120.94 -1.1 . . . . 2.02 110.784 -176.285 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 1.2 mm-40 -81.07 -67.12 0.81 Allowed 'General case' 0 N--CA 1.451 -0.378 0 CA-C-O 122.379 1.085 . . . . 2.9 109.717 179.012 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . 0.469 ' OE2' ' HE3' ' A' ' 91' ' ' LYS . 45.1 mm-40 -75.98 -22.79 55.51 Favored 'General case' 0 N--CA 1.451 -0.389 0 CA-C-N 115.589 -0.732 . . . . 3.39 110.952 -165.442 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . 0.408 ' HA2' ' CD1' ' A' ' 66' ' ' PHE . . . -71.99 35.45 0.63 Allowed Glycine 0 CA--C 1.531 1.065 0 C-N-CA 123.784 0.707 . . . . 0.43 113.284 168.008 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 30.0 t -152.1 36.27 0.54 Allowed 'General case' 0 N--CA 1.448 -0.551 0 O-C-N 120.899 -1.354 . . . . 2.92 108.269 156.794 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 4.6 t-20 -134.88 -50.52 0.77 Allowed 'General case' 0 CA--C 1.519 -0.217 0 C-N-CA 122.67 0.388 . . . . 2.59 110.837 -168.545 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 16.0 mt -64.21 -35.03 79.46 Favored 'General case' 0 C--N 1.334 -0.091 0 CA-C-O 120.798 0.332 . . . . 1.76 111.266 -174.3 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER 178.2 165.94 0.76 Allowed 'General case' 0 CA--C 1.531 0.238 0 C-N-CA 124.845 1.258 . . . . 1.62 108.067 -174.81 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 9.0 m -59.11 -36.51 75.3 Favored 'General case' 0 N--CA 1.455 -0.204 0 C-N-CA 123.803 0.841 . . . . 1.33 110.881 170.557 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -59.78 -34.05 72.5 Favored 'General case' 0 C--O 1.223 -0.314 0 C-N-CA 123.825 0.85 . . . . 1.62 109.575 172.367 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -63.18 -11.55 39.81 Favored Glycine 0 C--O 1.223 -0.551 0 O-C-N 121.482 -0.761 . . . . 0.56 112.384 176.663 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 3.1 tmt_? -111.7 -3.79 14.9 Favored 'General case' 0 N--CA 1.452 -0.37 0 CA-C-N 118.515 1.158 . . . . 4.05 112.48 -176.857 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 56.3 p -72.27 -137.75 0.01 OUTLIER 'General case' 0 CA--C 1.538 0.481 0 N-CA-C 108.596 -0.89 . . . . 1.9 108.596 175.944 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 98.5 m-20 -69.76 149.84 47.55 Favored 'General case' 0 CA--C 1.528 0.119 0 O-C-N 119.717 -1.864 . . . . 1.93 108.73 178.199 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 45.0 tt0 -58.6 -27.76 64.96 Favored 'General case' 0 CA--C 1.538 0.516 0 CA-C-O 121.682 0.754 . . . . 3.1 111.222 -179.55 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -62.96 -36.61 84.02 Favored 'General case' 0 N--CA 1.452 -0.339 0 C-N-CA 124.163 0.985 . . . . 1.82 112.826 174.562 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 4.2 mt-10 -75.81 -48.47 21.51 Favored 'General case' 0 CA--C 1.511 -0.55 0 O-C-N 121.322 -0.861 . . . . 1.92 109.175 177.766 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 66' ' ' PHE . . . . . 0.408 ' CD1' ' HA2' ' A' ' 52' ' ' GLY . 41.2 t80 -40.23 -51.73 2.68 Favored 'General case' 0 CA--C 1.535 0.403 0 C-N-CA 123.969 0.908 . . . . 0.35 111.694 171.609 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 59.5 t80 -60.98 -42.99 99.42 Favored 'General case' 0 CA--C 1.538 0.483 0 C-N-CA 122.95 0.5 . . . . 0.56 111.828 175.989 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -60.76 -49.33 77.92 Favored 'General case' 0 CA--C 1.538 0.486 0 O-C-N 120.999 -1.063 . . . . 1.45 111.836 -178.993 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 2.9 mp0 -58.28 -40.69 82.57 Favored 'General case' 0 CA--C 1.519 -0.219 0 O-C-N 121.437 -0.789 . . . . 4.51 110.644 171.863 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -56.01 -42.29 76.22 Favored 'General case' 0 N--CA 1.449 -0.485 0 C-N-CA 120.294 -0.563 . . . . 1.82 109.594 177.934 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -60.09 -51.47 69.5 Favored 'General case' 0 CA--C 1.528 0.114 0 CA-C-N 119.187 0.903 . . . . 4.81 112.09 174.88 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 20.9 ttt180 -45.85 -67.46 0.28 Allowed 'General case' 0 N--CA 1.467 0.387 0 CA-C-N 118.555 0.616 . . . . 2.48 109.569 175.489 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -59.12 -35.25 73.13 Favored 'General case' 0 CA--C 1.509 -0.605 0 C-N-CA 125.603 1.561 . . . . 1.85 111.314 -173.054 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 1.8 tmt? -59.06 -38.55 79.64 Favored 'General case' 0 N--CA 1.445 -0.683 0 CA-C-O 119.783 -0.151 . . . . 3.72 111.164 -177.256 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 23.1 p80 -91.13 -35.95 14.27 Favored 'General case' 0 N--CA 1.454 -0.237 0 CA-C-O 116.467 -1.73 . . . . 1.27 111.915 179.353 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 20.4 m -10.36 117.46 0.01 OUTLIER 'General case' 0 C--N 1.344 0.328 0 C-N-CA 128.532 2.733 . . . . 1.64 115.251 -169.359 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 6.9 p -46.66 -44.01 18.12 Favored 'General case' 0 N--CA 1.452 -0.347 0 C-N-CA 125.814 1.645 . . . . 2.07 110.346 176.585 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 10.5 t0 -68.33 102.68 1.44 Allowed 'General case' 0 N--CA 1.448 -0.558 0 CA-C-O 121.669 0.747 . . . . 2.21 109.243 166.04 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 34.4 p-80 -50.23 -35.54 27.22 Favored 'General case' 0 N--CA 1.455 -0.21 0 CA-C-N 115.832 -0.622 . . . . 5.51 111.986 175.145 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -59.47 -48.28 82.24 Favored 'General case' 0 N--CA 1.448 -0.538 0 CA-C-O 118.278 -0.868 . . . . 2.07 110.399 179.757 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 1.4 tt0 -46.69 -42.6 16.78 Favored 'General case' 0 N--CA 1.465 0.298 0 CA-C-N 119.066 0.848 . . . . 3.37 110.161 177.1 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -63.18 -51.88 64.6 Favored 'General case' 0 CA--C 1.516 -0.351 0 N-CA-C 109.504 -0.554 . . . . 4.19 109.504 -179.982 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 1.4 mm? -65.72 -18.38 65.29 Favored 'General case' 0 N--CA 1.45 -0.431 0 CA-C-O 117.628 -1.177 . . . . 1.55 113.059 178.166 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -67.04 -50.58 61.47 Favored 'General case' 0 CA--C 1.519 -0.218 0 CA-C-N 121.387 1.903 . . . . 2.28 107.141 168.092 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 69.0 t -58.03 -43.53 85.25 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.671 0 CA-C-O 117.471 -1.252 . . . . 1.52 112.008 177.79 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 9.9 mt-30 -68.1 -47.79 67.25 Favored 'General case' 0 C--O 1.225 -0.225 0 CA-C-N 122.305 2.321 . . . . 2.31 111.853 177.972 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 72.4 tttt -57.12 -49.18 76.71 Favored 'General case' 0 N--CA 1.449 -0.506 0 O-C-N 121.568 -0.707 . . . . 3.07 110.602 -173.942 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 25.0 m120 -68.83 -48.76 62.73 Favored 'General case' 0 N--CA 1.453 -0.291 0 N-CA-C 109.622 -0.511 . . . . 2.88 109.622 175.738 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -122.81 77.62 48.88 Favored Pre-proline 0 C--O 1.236 0.393 0 C-N-CA 125.652 1.581 . . . . 1.35 111.656 -170.34 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 57.9 Cg_endo -69.78 4.18 2.35 Favored 'Trans proline' 0 CA--C 1.537 0.632 0 C-N-CA 122.907 2.404 . . . . 1.57 113.187 -176.815 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 91' ' ' LYS . . . . . 0.469 ' HE3' ' OE2' ' A' ' 51' ' ' GLU . 0.5 OUTLIER -122.49 -44.14 2.25 Favored 'General case' 0 N--CA 1.45 -0.448 0 C-N-CA 126.26 1.824 . . . . 4.24 110.143 -171.702 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 5.9 m -58.25 -45.52 87.64 Favored 'General case' 0 N--CA 1.464 0.237 0 O-C-N 120.946 -1.097 . . . . 1.51 111.214 175.668 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 10.9 t80 -58.15 -46.08 86.3 Favored 'General case' 0 CA--C 1.511 -0.556 0 CA-C-O 121.771 0.796 . . . . 3.68 110.83 178.136 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 26.8 tt0 -56.09 -34.75 66.31 Favored 'General case' 0 N--CA 1.44 -0.931 0 CA-C-N 114.284 -1.325 . . . . 3.29 109.834 179.851 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 4.0 t80 -62.7 -57.19 11.85 Favored 'General case' 0 N--CA 1.455 -0.207 0 C-N-CA 124.338 1.055 . . . . 1.16 110.305 -178.083 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 37.3 mm -53.91 -44.62 61.7 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.114 0 N-CA-C 109.591 -0.522 . . . . 2.72 109.591 177.368 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 9.3 t30 -62.56 -30.78 71.57 Favored 'General case' 0 CA--C 1.534 0.335 0 N-CA-C 111.957 0.354 . . . . 2.2 111.957 -179.329 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 7.7 t70 -65.43 -47.07 77.47 Favored 'General case' 0 N--CA 1.462 0.156 0 C-N-CA 124.587 1.155 . . . . 2.46 110.003 175.118 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 6.7 mm100 -81.47 70.85 8.43 Favored 'General case' 0 N--CA 1.453 -0.305 0 CA-C-O 122.162 0.982 . . . . 3.64 110.212 -175.47 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 9.4 tp -69.4 106.67 1.38 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.425 0 N-CA-C 108.765 -0.828 . . . . 5.14 108.765 178.966 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 9.5 ttmm -155.79 151.42 27.21 Favored 'General case' 0 N--CA 1.455 -0.204 0 O-C-N 120.736 -1.227 . . . . 11.55 107.958 174.084 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 102' ' ' PHE . . . . . . . . . . . . . 87.6 m-85 -137.49 135.09 36.49 Favored 'General case' 0 N--CA 1.449 -0.511 0 N-CA-C 105.537 -2.023 . . . . 8.94 105.537 175.273 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 8.8 tp -136.01 140.83 43.26 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.21 0 N-CA-C 106.519 -1.66 . . . . 4.34 106.519 177.744 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 104' ' ' ILE . . . . . . . . . . . . . 26.1 mm 63.66 -73.8 0.08 OUTLIER 'Isoleucine or valine' 0 CA--C 1.533 0.324 0 C-N-CA 124.989 1.316 . . . . 7.79 110.5 -169.938 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 12.9 t-20 75.47 -163.73 0.07 Allowed 'General case' 0 CA--C 1.534 0.338 0 C-N-CA 126.013 1.725 . . . . 9.16 109.506 -178.029 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 22.5 p . . . . . 0 C--O 1.246 0.888 0 N-CA-C 107.437 -1.32 . . . . 9.97 107.437 176.785 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . 0.461 ' O ' ' HE3' ' A' ' 3' ' ' LYS . . . . . . . . 0 N--CA 1.472 1.083 0 N-CA-C 109.59 -1.404 . . . . 17.24 109.59 . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 5.5 m 25.56 76.35 0.02 OUTLIER 'General case' 0 CA--C 1.53 0.182 0 C-N-CA 127.64 2.376 . . . . 19.86 116.228 174.114 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . 0.461 ' HE3' ' O ' ' A' ' 1' ' ' GLY . 12.1 ptpt -156.34 88.31 1.07 Allowed 'General case' 0 C--O 1.225 -0.232 0 N-CA-C 109.485 -0.561 . . . . 19.34 109.485 170.385 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 70.74 -163.98 53.31 Favored Glycine 0 CA--C 1.522 0.509 0 N-CA-C 111.1 -0.8 . . . . 18.08 111.1 -176.375 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 26.7 m -85.91 -157.89 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.446 -0.628 0 C-N-CA 123.853 0.861 . . . . 18.3 109.492 178.329 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 21.5 mt-10 -82.79 119.28 24.15 Favored 'General case' 0 N--CA 1.443 -0.775 0 N-CA-C 108.924 -0.769 . . . . 12.8 108.924 172.135 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -156.07 37.03 0.34 Allowed 'General case' 0 N--CA 1.452 -0.33 0 C-N-CA 125.484 1.514 . . . . 11.64 109.565 179.197 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 7.3 mmm180 -144.14 121.65 11.74 Favored 'General case' 0 N--CA 1.446 -0.648 0 N-CA-C 106.288 -1.745 . . . . 11.97 106.288 -178.933 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 1.7 m120 -48.78 -32.25 8.32 Favored 'General case' 0 C--O 1.223 -0.324 0 C-N-CA 123.784 0.834 . . . . 3.31 112.653 174.292 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 9.5 t70 -55.07 -58.01 9.38 Favored 'General case' 0 N--CA 1.449 -0.519 0 C-N-CA 124.768 1.227 . . . . 2.36 110.978 173.012 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 66.1 m -64.94 -50.47 66.3 Favored 'General case' 0 N--CA 1.462 0.166 0 CA-C-O 122.115 0.96 . . . . 2.3 111.193 178.822 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 7.4 tt0 -70.52 -22.35 62.63 Favored 'General case' 0 CA--C 1.536 0.42 0 C-N-CA 125.022 1.329 . . . . 3.99 110.45 -169.599 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -79.93 -41.1 12.91 Favored Glycine 0 CA--C 1.525 0.708 0 C-N-CA 125.1 1.333 . . . . 0.87 109.978 168.577 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -52.28 -49.4 64.22 Favored 'General case' 0 C--N 1.333 -0.12 0 CA-C-N 118.599 1.199 . . . . 4.14 110.741 -179.24 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -63.87 -34.33 67.56 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.559 0 N-CA-C 112.747 0.647 . . . . 1.88 112.747 178.891 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 2.1 t-160 -59.79 -54.65 43.82 Favored 'General case' 0 N--CA 1.462 0.128 0 N-CA-C 106.762 -1.57 . . . . 0.62 106.762 176.4 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 41.0 mt-10 -57.28 -39.32 75.45 Favored 'General case' 0 C--O 1.222 -0.349 0 CA-C-O 118.209 -0.901 . . . . 2.46 111.075 179.723 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -51.1 -54.72 22.5 Favored 'General case' 0 CA--C 1.52 -0.203 0 CA-C-N 119.368 0.985 . . . . 4.67 110.45 173.452 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -47.94 -46.26 25.93 Favored Glycine 0 CA--C 1.527 0.792 0 N-CA-C 110.999 -0.84 . . . . 0.48 110.999 176.5 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 2.1 t-160 -63.62 -46.73 84.42 Favored 'General case' 0 N--CA 1.45 -0.462 0 O-C-N 121.98 -0.718 . . . . 2.6 111.794 -179.367 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -59.23 -32.72 70.22 Favored 'General case' 0 N--CA 1.452 -0.342 0 CA-C-N 118.603 0.638 . . . . 1.58 109.352 -179.25 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 45.0 t -68.39 -41.57 83.53 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.267 0 C-N-CA 119.923 -0.711 . . . . 1.82 110.201 177.092 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 2.0 t70 -59.53 -29.16 67.69 Favored 'General case' 0 C--O 1.23 0.07 0 CA-C-O 121.284 0.564 . . . . 2.16 110.974 173.86 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 10.3 t70 -70.49 -49.56 47.1 Favored 'General case' 0 N--CA 1.45 -0.427 0 N-CA-C 108.602 -0.888 . . . . 2.19 108.602 -173.65 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -64.2 -49.4 72.16 Favored 'General case' 0 N--CA 1.453 -0.284 0 C-N-CA 123.547 0.739 . . . . 6.09 110.787 178.171 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -54.61 -41.5 70.06 Favored 'General case' 0 N--CA 1.454 -0.267 0 O-C-N 121.983 -0.448 . . . . 2.07 110.382 178.795 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -60.39 -58.36 14.34 Favored Glycine 0 C--O 1.224 -0.531 0 N-CA-C 109.664 -1.374 . . . . 1.13 109.664 175.728 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -46.73 -42.64 17.02 Favored 'General case' 0 C--N 1.33 -0.242 0 C-N-CA 124.49 1.116 . . . . 3.85 112.044 -175.187 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 3.0 mm? -84.83 -30.11 24.8 Favored 'General case' 0 N--CA 1.445 -0.696 0 C-N-CA 124.146 0.978 . . . . 2.47 113.439 -177.729 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 11.8 mt -124.82 64.78 1.11 Allowed 'General case' 0 CA--C 1.529 0.146 0 CA-C-N 119.375 0.989 . . . . 2.64 109.949 -165.457 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 1.6 t70 -144.8 171.11 14.88 Favored 'General case' 0 CA--C 1.529 0.147 0 CA-C-O 121.237 0.541 . . . . 4.32 110.48 -178.162 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 3.2 mmtm -101.82 -40.24 7.02 Favored 'General case' 0 N--CA 1.452 -0.35 0 C-N-CA 125.686 1.594 . . . . 7.98 110.287 168.69 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 7.4 t30 -98.4 138.55 35.46 Favored 'General case' 0 N--CA 1.454 -0.246 0 N-CA-C 107.598 -1.26 . . . . 7.32 107.598 -179.205 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 1.4 tt0 -66.95 -20.18 65.85 Favored 'General case' 0 CA--C 1.535 0.372 0 O-C-N 121.509 -0.744 . . . . 12.41 111.229 179.845 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 1.8 p -109.94 66.12 0.63 Allowed 'General case' 0 N--CA 1.448 -0.528 0 C-N-CA 125.178 1.391 . . . . 8.44 109.724 -177.15 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -154.87 -179.52 8.11 Favored 'General case' 0 CA--C 1.537 0.445 0 C-N-CA 124.658 1.183 . . . . 6.89 107.962 173.845 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 5.4 mp -138.47 164.89 28.21 Favored 'General case' 0 N--CA 1.464 0.246 0 C-N-CA 124.071 0.949 . . . . 3.1 108.577 176.371 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 9.3 p -59.58 -43.55 91.24 Favored 'Isoleucine or valine' 0 C--N 1.342 0.276 0 CA-C-N 118.509 0.595 . . . . 2.9 110.339 -175.942 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 59.7 p 48.51 -156.98 0.07 Allowed 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 124.87 1.268 . . . . 4.43 112.123 179.97 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 26.6 t30 -75.09 69.09 1.95 Allowed 'General case' 0 CA--C 1.532 0.28 0 O-C-N 120.509 -1.369 . . . . 7.69 109.963 173.417 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 8.4 t -77.59 -176.75 4.44 Favored 'General case' 0 CA--C 1.534 0.357 0 O-C-N 121.57 -0.706 . . . . 3.55 109.39 170.518 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 33.5 mtmt 56.71 -77.14 0.01 OUTLIER 'General case' 0 N--CA 1.467 0.383 0 C-N-CA 124.868 1.267 . . . . 7.23 110.987 -161.897 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.3 -45.59 92.84 Favored 'General case' 0 C--O 1.224 -0.272 0 CA-C-N 118.801 0.728 . . . . 9.02 111.15 -178.95 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 3.8 t80 64.39 74.99 0.39 Allowed 'General case' 0 CA--C 1.531 0.246 0 C-N-CA 123.611 0.765 . . . . 6.69 111.576 174.424 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . 0.265 3.9 mt 65.65 90.74 0.05 OUTLIER 'Isoleucine or valine' 0 CA--C 1.539 0.545 0 C-N-CA 125.4 1.48 . . . . 3.97 110.967 -178.335 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 6.6 t70 -164.57 -66.56 0.04 OUTLIER 'General case' 0 N--CA 1.465 0.292 0 C-N-CA 125.692 1.597 . . . . 2.75 107.374 -179.133 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 4.3 mm -54.28 -55.79 12.98 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.396 0 C-N-CA 126.038 1.735 . . . . 1.6 109.689 -179.894 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 30.4 t80 -62.28 -26.02 68.17 Favored 'General case' 0 C--O 1.225 -0.219 0 O-C-N 120.498 -1.376 . . . . 0.43 112.181 175.664 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . 0.445 ' HA ' ' HE2' ' A' ' 49' ' ' LYS . 10.9 mmpt? -70.15 -47.21 62.66 Favored 'General case' 0 N--CA 1.45 -0.433 0 O-C-N 120.164 -1.585 . . . . 2.09 110.877 -178.066 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 16.4 tp10 -89.25 -60.61 1.9 Allowed 'General case' 0 C--N 1.332 -0.179 0 CA-C-O 121.519 0.676 . . . . 2.48 109.449 -176.504 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . 0.451 ' OE2' ' HE2' ' A' ' 91' ' ' LYS . 29.3 mp0 -71.32 -26.99 63.08 Favored 'General case' 0 C--O 1.235 0.324 0 O-C-N 121.185 -0.947 . . . . 2.61 110.699 -174.534 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . 0.424 ' HA2' ' CD1' ' A' ' 66' ' ' PHE . . . -72.45 42.59 0.84 Allowed Glycine 0 CA--C 1.53 1.016 0 C-N-CA 124.152 0.882 . . . . 0.36 114.562 171.619 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 28.2 t -151.51 34.24 0.56 Allowed 'General case' 0 N--CA 1.451 -0.409 0 O-C-N 121.109 -1.23 . . . . 2.86 109.087 151.432 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 1.5 m-20 -132.25 -47.68 0.92 Allowed 'General case' 0 CA--C 1.519 -0.237 0 N-CA-C 112.246 0.462 . . . . 2.43 112.246 -172.238 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 25.0 mt -59.42 -36.89 76.72 Favored 'General case' 0 N--CA 1.464 0.26 0 CA-C-O 121.033 0.444 . . . . 1.58 111.411 -172.294 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -177.56 171.76 1.87 Allowed 'General case' 0 C--N 1.33 -0.245 0 N-CA-C 107.126 -1.435 . . . . 1.63 107.126 -175.871 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 31.2 m -63.15 -33.7 76.03 Favored 'General case' 0 CA--C 1.53 0.179 0 O-C-N 121.693 -0.629 . . . . 1.61 110.834 169.101 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 1.8 m-85 -65.63 -19.2 65.82 Favored 'General case' 0 N--CA 1.466 0.361 0 CA-C-N 119.191 0.905 . . . . 1.61 111.502 171.041 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -69.21 -9.81 61.28 Favored Glycine 0 N--CA 1.443 -0.845 0 CA-C-O 118.656 -1.08 . . . . 0.49 111.31 173.607 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 58.3 ttt180 -116.35 -11.5 11.21 Favored 'General case' 0 N--CA 1.454 -0.232 0 CA-C-N 119.211 1.506 . . . . 4.66 112.657 -174.33 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 32.4 p -72.85 -123.61 0.0 OUTLIER 'General case' 0 CA--C 1.533 0.317 0 C-N-CA 123.227 0.611 . . . . 1.85 109.724 -178.378 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 14.3 t30 -76.3 149.19 37.11 Favored 'General case' 0 N--CA 1.451 -0.405 0 O-C-N 120.215 -1.553 . . . . 2.56 107.537 177.219 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -57.12 -33.32 67.24 Favored 'General case' 0 CA--C 1.534 0.336 0 CA-C-O 121.79 0.805 . . . . 2.86 110.321 178.832 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -60.14 -34.81 74.05 Favored 'General case' 0 N--CA 1.45 -0.445 0 O-C-N 121.684 -0.635 . . . . 1.78 112.592 177.656 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 7.0 mt-10 -76.25 -42.29 46.22 Favored 'General case' 0 CA--C 1.516 -0.34 0 O-C-N 121.694 -0.628 . . . . 2.14 110.174 178.491 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 66' ' ' PHE . . . . . 0.424 ' CD1' ' HA2' ' A' ' 52' ' ' GLY . 36.8 t80 -48.94 -53.84 18.01 Favored 'General case' 0 N--CA 1.453 -0.289 0 C-N-CA 123.786 0.834 . . . . 0.39 111.183 171.626 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 72.3 t80 -61.79 -45.92 91.79 Favored 'General case' 0 CA--C 1.534 0.347 0 C-N-CA 123.028 0.531 . . . . 0.59 110.483 -179.988 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -60.54 -48.22 82.74 Favored 'General case' 0 CA--C 1.538 0.517 0 O-C-N 121.378 -0.826 . . . . 1.65 112.186 -177.226 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 5.7 mm-40 -57.47 -41.53 80.79 Favored 'General case' 0 N--CA 1.458 -0.067 0 C-N-CA 123.74 0.816 . . . . 4.15 110.095 172.256 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -57.48 -45.16 85.15 Favored 'General case' 0 N--CA 1.451 -0.401 0 CA-C-O 118.664 -0.684 . . . . 1.44 109.801 -179.92 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 50.1 t80 -55.99 -49.87 72.43 Favored 'General case' 0 N--CA 1.465 0.287 0 CA-C-N 119.167 0.894 . . . . 3.32 112.004 174.607 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 11.6 ttt180 -47.46 -61.35 1.96 Allowed 'General case' 0 CA--C 1.533 0.327 0 N-CA-C 109.107 -0.701 . . . . 2.82 109.107 175.405 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -65.36 -23.37 66.97 Favored 'General case' 0 C--N 1.328 -0.362 0 C-N-CA 124.414 1.086 . . . . 1.47 111.607 -173.411 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -65.05 -40.8 95.28 Favored 'General case' 0 C--N 1.326 -0.425 0 C-N-CA 122.933 0.493 . . . . 3.62 110.719 179.109 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 13.8 p80 -95.41 -18.68 20.53 Favored 'General case' 0 C--O 1.227 -0.083 0 CA-C-O 116.936 -1.506 . . . . 1.13 113.478 -178.603 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 7.6 m -25.67 118.04 0.06 Allowed 'General case' 0 CA--C 1.516 -0.342 0 C-N-CA 126.419 1.888 . . . . 1.64 113.59 -171.603 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 6.2 p -46.08 -44.19 15.3 Favored 'General case' 0 N--CA 1.451 -0.424 0 C-N-CA 125.746 1.619 . . . . 2.09 109.985 177.607 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 13.4 t0 -70.03 103.81 2.38 Favored 'General case' 0 N--CA 1.451 -0.408 0 CA-C-O 122.034 0.921 . . . . 1.92 109.738 166.274 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 1.4 p80 -45.49 -37.32 5.19 Favored 'General case' 0 CA--C 1.531 0.239 0 CA-C-N 115.569 -0.741 . . . . 5.93 112.746 172.017 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -65.22 -42.07 93.82 Favored 'General case' 0 N--CA 1.449 -0.477 0 CA-C-O 118.68 -0.676 . . . . 1.32 110.879 -178.699 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 1.2 tt0 -48.83 -41.41 32.84 Favored 'General case' 0 N--CA 1.463 0.188 0 CA-C-N 118.896 0.771 . . . . 2.99 109.794 174.377 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 14.9 mtp180 -65.01 -52.53 55.55 Favored 'General case' 0 CA--C 1.517 -0.317 0 N-CA-C 109.332 -0.618 . . . . 3.14 109.332 -179.714 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 1.4 mm? -62.5 -21.79 65.77 Favored 'General case' 0 C--O 1.222 -0.345 0 CA-C-O 118.315 -0.85 . . . . 1.81 112.838 177.752 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 30.4 mttt -67.45 -42.91 82.31 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 120.907 1.685 . . . . 2.62 108.424 174.467 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 84.0 t -60.69 -64.9 0.53 Allowed 'Isoleucine or valine' 0 C--O 1.219 -0.503 0 CA-C-O 118.032 -0.985 . . . . 1.83 109.815 170.639 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -48.72 -42.67 35.9 Favored 'General case' 0 CA--C 1.533 0.309 0 CA-C-N 120.309 1.413 . . . . 2.78 112.31 -174.622 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 35.6 tttm -62.52 -49.35 75.69 Favored 'General case' 0 N--CA 1.448 -0.56 0 C-N-CA 123.933 0.893 . . . . 3.01 111.891 178.793 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 70.6 m-80 -84.79 -4.96 59.3 Favored 'General case' 0 CA--C 1.531 0.219 0 CA-C-N 118.332 0.515 . . . . 2.3 111.973 -179.465 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -162.02 62.78 1.44 Allowed Pre-proline 0 N--CA 1.448 -0.539 0 C-N-CA 124.274 1.029 . . . . 1.78 110.005 -166.343 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 30.2 Cg_endo -60.08 -35.07 93.95 Favored 'Trans proline' 0 N--CA 1.454 -0.836 0 C-N-CA 122.516 2.144 . . . . 2.43 110.446 -174.754 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 91' ' ' LYS . . . . . 0.451 ' HE2' ' OE2' ' A' ' 51' ' ' GLU . 0.2 OUTLIER -81.65 -39.55 24.23 Favored 'General case' 0 N--CA 1.451 -0.379 0 C-N-CA 124.813 1.245 . . . . 3.38 112.639 -177.525 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 3.5 m -60.96 -45.99 92.52 Favored 'General case' 0 N--CA 1.464 0.262 0 CA-C-N 120.303 1.411 . . . . 1.51 110.342 179.04 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 5.1 t80 -58.84 -47.96 83.01 Favored 'General case' 0 CA--C 1.51 -0.571 0 CA-C-O 121.068 0.461 . . . . 3.09 110.835 176.835 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 44.9 tt0 -56.22 -31.22 63.3 Favored 'General case' 0 N--CA 1.441 -0.887 0 CA-C-N 115.327 -0.851 . . . . 1.98 110.767 177.841 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 3.6 t80 -61.12 -58.78 6.96 Favored 'General case' 0 N--CA 1.455 -0.205 0 CA-C-N 118.702 0.683 . . . . 1.13 110.417 -176.07 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 3.3 mp -57.15 -41.58 78.1 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.206 0 N-CA-C 108.625 -0.88 . . . . 1.92 108.625 176.237 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 7.7 t-20 -59.65 -35.14 73.82 Favored 'General case' 0 CA--C 1.542 0.662 0 N-CA-C 112.342 0.497 . . . . 3.01 112.342 -177.726 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 21.0 t70 -57.41 -43.81 84.05 Favored 'General case' 0 CA--C 1.516 -0.356 0 C-N-CA 125.214 1.406 . . . . 2.47 109.66 176.423 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 70.3 mm-40 -88.76 65.9 7.85 Favored 'General case' 0 N--CA 1.443 -0.785 0 CA-C-O 121.52 0.676 . . . . 4.16 109.857 -173.709 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 5.7 tp -69.17 88.14 0.19 Allowed 'Isoleucine or valine' 0 CA--C 1.537 0.477 0 CA-C-O 122.032 0.92 . . . . 5.18 110.359 -176.406 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -152.57 -175.76 5.43 Favored 'General case' 0 C--N 1.333 -0.131 0 O-C-N 120.644 -1.285 . . . . 9.36 107.755 177.235 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 102' ' ' PHE . . . . . . . . . . . . . 39.0 p90 -147.56 163.78 35.51 Favored 'General case' 0 C--N 1.327 -0.401 0 C-N-CA 125.665 1.586 . . . . 7.81 106.745 -177.604 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 9.5 tp -116.59 157.82 17.33 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.238 0 N-CA-C 108.739 -0.838 . . . . 4.28 108.739 179.272 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 104' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -135.74 141.49 41.9 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.51 0 N-CA-C 107.019 -1.474 . . . . 6.71 107.019 179.674 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 52.4 t30 65.49 107.96 0.04 OUTLIER 'General case' 0 CA--C 1.532 0.252 0 C-N-CA 125.651 1.58 . . . . 12.08 111.764 -174.709 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 13.3 p . . . . . 0 C--O 1.253 1.265 0 CA-C-O 115.122 -2.371 . . . . 12.77 109.693 178.017 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.471 0.995 0 N-CA-C 109.492 -1.443 . . . . 17.03 109.492 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 2' ' ' SER . . . . . 0.479 ' O ' ' HE2' ' A' ' 3' ' ' LYS . 7.0 m -147.08 64.08 1.17 Allowed 'General case' 0 CA--C 1.516 -0.334 0 CA-C-N 118.115 0.957 . . . . 15.79 109.429 178.466 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . 0.479 ' HE2' ' O ' ' A' ' 2' ' ' SER . 0.3 OUTLIER -158.8 154.02 25.48 Favored 'General case' 0 N--CA 1.45 -0.457 0 N-CA-C 108.14 -1.059 . . . . 21.25 108.14 -179.15 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 173.37 164.02 27.95 Favored Glycine 0 CA--C 1.519 0.333 0 N-CA-C 108.167 -1.973 . . . . 14.16 108.167 177.322 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 14.4 m -89.37 175.94 0.69 Allowed 'Isoleucine or valine' 0 N--CA 1.445 -0.702 0 N-CA-C 107.911 -1.144 . . . . 14.2 107.911 158.038 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 8.1 pt-20 -82.33 120.76 25.82 Favored 'General case' 0 N--CA 1.45 -0.446 0 CA-C-O 121.499 0.666 . . . . 9.58 111.915 -177.561 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -111.32 26.78 10.32 Favored 'General case' 0 N--CA 1.453 -0.324 0 C-N-CA 125.236 1.414 . . . . 9.69 110.995 -177.692 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 18.9 mtp180 66.94 -69.51 0.13 Allowed 'General case' 0 N--CA 1.466 0.335 0 C-N-CA 125.133 1.373 . . . . 8.26 110.861 -174.571 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 3.5 m120 -48.9 -49.21 40.94 Favored 'General case' 0 C--O 1.224 -0.241 0 O-C-N 121.02 -1.05 . . . . 3.73 112.055 177.62 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -75.53 -26.97 58.5 Favored 'General case' 0 C--O 1.218 -0.591 0 C-N-CA 119.273 -0.971 . . . . 3.13 111.633 -179.434 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 30.5 t -65.76 -66.56 0.53 Allowed 'General case' 0 N--CA 1.451 -0.419 0 CA-C-N 119.369 0.986 . . . . 3.73 109.333 178.622 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . 0.413 ' HA ' ' CD1' ' A' ' 15' ' ' ILE . 3.8 mp0 -74.55 -30.42 61.74 Favored 'General case' 0 N--CA 1.448 -0.528 0 N-CA-C 109.311 -0.625 . . . . 4.68 109.311 -173.938 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -61.81 -53.28 44.55 Favored Glycine 0 CA--C 1.524 0.62 0 N-CA-C 111.045 -0.822 . . . . 0.75 111.045 171.566 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 84.3 t80 -57.02 -53.15 61.34 Favored 'General case' 0 CA--C 1.517 -0.319 0 CA-C-N 118.771 1.285 . . . . 4.46 110.197 -175.139 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . 0.413 ' CD1' ' HA ' ' A' ' 12' ' ' GLU . 0.9 OUTLIER -62.99 -33.72 62.26 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.407 0 O-C-N 121.755 -0.59 . . . . 1.95 112.194 -179.906 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 1.9 t60 -58.99 -57.51 12.75 Favored 'General case' 0 C--N 1.342 0.259 0 N-CA-C 107.303 -1.369 . . . . 0.75 107.303 175.954 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 44.0 mt-10 -55.64 -35.44 65.92 Favored 'General case' 0 C--O 1.222 -0.389 0 C-N-CA 124.262 1.025 . . . . 2.56 110.72 -179.805 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 6.2 t80 -58.64 -49.66 76.71 Favored 'General case' 0 N--CA 1.453 -0.292 0 C-N-CA 124.097 0.959 . . . . 4.25 109.8 177.521 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -48.52 -46.93 29.73 Favored Glycine 0 CA--C 1.527 0.837 0 N-CA-C 110.959 -0.856 . . . . 0.47 110.959 171.128 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 1.9 t-160 -62.5 -44.99 95.03 Favored 'General case' 0 N--CA 1.453 -0.299 0 O-C-N 121.516 -0.991 . . . . 2.66 111.742 -179.526 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -62.59 -29.56 70.69 Favored 'General case' 0 N--CA 1.451 -0.377 0 O-C-N 121.483 -0.761 . . . . 1.9 109.806 -179.695 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 90.1 t -66.29 -40.07 85.87 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.147 0 O-C-N 121.36 -0.838 . . . . 1.86 110.697 175.432 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 18.8 t0 -59.36 -30.53 68.47 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-O 121.785 0.802 . . . . 2.0 110.863 173.936 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 11.8 t70 -69.37 -51.58 35.34 Favored 'General case' 0 N--CA 1.451 -0.393 0 N-CA-C 108.258 -1.016 . . . . 1.87 108.258 -176.107 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 48.9 t80 -59.38 -50.66 73.12 Favored 'General case' 0 N--CA 1.454 -0.263 0 C-N-CA 123.09 0.556 . . . . 3.65 110.512 179.021 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -52.91 -42.45 65.37 Favored 'General case' 0 N--CA 1.451 -0.394 0 N-CA-C 110.285 -0.265 . . . . 1.9 110.285 179.671 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -69.67 -46.9 52.18 Favored Glycine 0 C--O 1.226 -0.401 0 N-CA-C 111.464 -0.654 . . . . 1.65 111.464 -178.351 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 0.9 OUTLIER -54.09 -47.47 71.71 Favored 'General case' 0 N--CA 1.455 -0.207 0 C-N-CA 123.606 0.762 . . . . 2.74 109.422 -177.298 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -74.31 -33.02 63.08 Favored 'General case' 0 N--CA 1.447 -0.603 0 C-N-CA 123.254 0.621 . . . . 3.04 112.531 -177.821 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 12.3 mt -118.74 37.06 4.2 Favored 'General case' 0 CA--C 1.532 0.257 0 CA-C-N 118.834 0.743 . . . . 2.84 110.245 -166.723 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 4.7 t70 -64.9 146.0 55.53 Favored 'General case' 0 CA--C 1.533 0.31 0 C-N-CA 123.244 0.618 . . . . 6.79 110.986 177.997 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 179.71 -43.44 0.01 OUTLIER 'General case' 0 N--CA 1.464 0.233 0 C-N-CA 126.404 1.882 . . . . 8.07 109.33 162.268 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 24.1 t-20 -78.95 168.05 20.26 Favored 'General case' 0 CA--C 1.532 0.288 0 C-N-CA 123.686 0.794 . . . . 10.07 110.068 -173.08 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 3.1 mm-40 -66.57 8.04 0.28 Allowed 'General case' 0 CA--C 1.537 0.445 0 N-CA-C 114.194 1.183 . . . . 8.77 114.194 177.714 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 18.1 p -142.27 111.9 6.71 Favored 'General case' 0 N--CA 1.447 -0.607 0 N-CA-C 106.882 -1.525 . . . . 7.31 106.882 169.3 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -58.64 -54.4 47.44 Favored 'General case' 0 C--O 1.224 -0.266 0 C-N-CA 124.367 1.067 . . . . 6.38 108.863 -178.278 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 10.8 mp -51.34 118.67 3.43 Favored 'General case' 0 C--O 1.233 0.226 0 C-N-CA 124.862 1.265 . . . . 3.42 109.82 -175.992 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 55.9 t -84.16 75.67 1.11 Allowed 'Isoleucine or valine' 0 N--CA 1.454 -0.253 0 CA-C-O 122.279 1.037 . . . . 4.29 108.496 -176.337 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 15.0 t -138.21 -54.44 0.64 Allowed 'General case' 0 N--CA 1.454 -0.27 0 CA-C-N 115.489 -0.778 . . . . 4.52 109.601 172.474 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 11.5 p-10 -83.32 62.76 6.88 Favored 'General case' 0 CA--C 1.537 0.469 0 O-C-N 120.787 -1.195 . . . . 6.49 111.258 -172.952 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 22.3 t -137.38 -56.94 0.7 Allowed 'General case' 0 CA--C 1.534 0.337 0 O-C-N 121.425 -0.797 . . . . 3.33 111.95 -168.841 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 6.6 mmtp -62.94 93.95 0.06 Allowed 'General case' 0 N--CA 1.465 0.314 0 O-C-N 121.311 -0.868 . . . . 6.98 109.007 177.51 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 35.2 mttp 73.76 133.69 0.05 OUTLIER 'General case' 0 N--CA 1.464 0.255 0 C-N-CA 127.179 2.192 . . . . 6.83 108.347 -170.101 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 7.0 m-85 -59.78 105.81 0.42 Allowed 'General case' 0 N--CA 1.456 -0.166 0 N-CA-C 108.709 -0.848 . . . . 5.69 108.709 176.315 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER 35.47 64.78 0.09 OUTLIER 'Isoleucine or valine' 0 CA--C 1.542 0.664 0 C-N-CA 126.514 1.925 . . . . 3.96 111.847 175.272 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 6.3 t70 -103.01 -55.05 2.49 Favored 'General case' 0 N--CA 1.47 0.533 0 CA-C-O 121.775 0.798 . . . . 2.51 110.068 -179.392 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 4.5 mm -54.8 -50.02 64.4 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.385 0 C-N-CA 124.901 1.28 . . . . 1.5 108.643 -176.418 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 36.1 t80 -66.92 -26.99 67.12 Favored 'General case' 0 N--CA 1.453 -0.314 0 O-C-N 121.617 -0.677 . . . . 0.78 112.724 177.067 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . 0.442 ' HA ' ' HE2' ' A' ' 49' ' ' LYS . 0.2 OUTLIER -68.44 -48.59 64.18 Favored 'General case' 0 N--CA 1.452 -0.367 0 O-C-N 120.591 -1.318 . . . . 2.3 111.047 -175.994 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 7.6 mm-40 -86.77 -62.17 1.57 Allowed 'General case' 0 C--N 1.33 -0.258 0 N-CA-C 109.059 -0.719 . . . . 2.65 109.059 179.155 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 4.2 mm-40 -69.9 -33.58 72.38 Favored 'General case' 0 CA--C 1.535 0.373 0 O-C-N 121.643 -0.661 . . . . 2.05 109.546 -167.719 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -68.92 34.97 0.29 Allowed Glycine 0 CA--C 1.53 0.997 0 C-N-CA 125.926 1.727 . . . . 0.38 114.213 169.041 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 23.0 t -146.9 35.94 0.93 Allowed 'General case' 0 N--CA 1.447 -0.601 0 O-C-N 120.917 -1.343 . . . . 2.7 108.845 157.433 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 1.1 t-20 -141.25 -43.58 0.37 Allowed 'General case' 0 CA--C 1.52 -0.204 0 N-CA-C 112.817 0.673 . . . . 2.62 112.817 -173.985 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 17.0 mt -60.58 -37.04 80.04 Favored 'General case' 0 N--CA 1.461 0.124 0 CA-C-O 120.876 0.369 . . . . 1.71 111.385 -174.56 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER 178.93 168.86 0.93 Allowed 'General case' 0 C--N 1.33 -0.25 0 C-N-CA 125.386 1.474 . . . . 1.54 107.319 -178.21 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 18.7 m -60.43 -36.42 78.13 Favored 'General case' 0 N--CA 1.454 -0.24 0 O-C-N 121.742 -0.599 . . . . 1.66 110.569 168.701 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -67.81 -8.34 35.18 Favored 'General case' 0 N--CA 1.465 0.308 0 C-N-CA 122.806 0.443 . . . . 1.69 112.066 174.209 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -92.47 -0.39 70.03 Favored Glycine 0 N--CA 1.443 -0.846 0 CA-C-O 118.787 -1.007 . . . . 0.52 110.825 175.2 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 1.2 ttt180 -123.11 -2.93 8.57 Favored 'General case' 0 C--O 1.227 -0.087 0 CA-C-N 119.003 1.401 . . . . 2.95 112.175 -178.746 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 12.1 p -68.63 -106.72 0.0 OUTLIER 'General case' 0 N--CA 1.453 -0.275 0 C-N-CA 125.038 1.335 . . . . 1.9 109.644 175.877 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 2.2 t-20 -93.25 151.22 19.94 Favored 'General case' 0 N--CA 1.447 -0.599 0 N-CA-C 108.312 -0.995 . . . . 2.63 108.312 177.071 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 22.7 tt0 -61.23 -29.49 69.86 Favored 'General case' 0 CA--C 1.535 0.401 0 CA-C-N 118.769 0.713 . . . . 3.15 109.974 176.914 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -64.91 -36.43 84.33 Favored 'General case' 0 N--CA 1.452 -0.357 0 N-CA-C 112.797 0.666 . . . . 1.74 112.797 174.959 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 11.3 mt-10 -75.47 -37.75 60.07 Favored 'General case' 0 CA--C 1.511 -0.531 0 O-C-N 121.367 -0.833 . . . . 2.28 110.178 178.473 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 48.8 t80 -53.2 -51.54 61.79 Favored 'General case' 0 N--CA 1.447 -0.607 0 C-N-CA 123.604 0.762 . . . . 0.37 110.472 173.685 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 84.8 t80 -60.59 -46.71 89.22 Favored 'General case' 0 CA--C 1.534 0.35 0 CA-C-O 121.204 0.526 . . . . 0.55 111.121 177.512 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -60.81 -50.96 71.33 Favored 'General case' 0 CA--C 1.541 0.606 0 O-C-N 121.4 -0.813 . . . . 1.54 112.342 -176.553 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 24.8 mm-40 -54.01 -43.71 70.32 Favored 'General case' 0 CA--C 1.52 -0.192 0 C-N-CA 124.425 1.09 . . . . 4.35 110.487 169.6 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -56.36 -42.25 77.49 Favored 'General case' 0 N--CA 1.451 -0.413 0 CA-C-O 118.414 -0.803 . . . . 1.65 109.768 -178.649 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 22.9 t80 -58.09 -52.21 66.51 Favored 'General case' 0 N--CA 1.465 0.323 0 CA-C-N 119.233 0.924 . . . . 4.56 111.578 173.055 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 28.1 ttt180 -46.8 -51.2 16.95 Favored 'General case' 0 CA--C 1.533 0.303 0 C-N-CA 122.738 0.415 . . . . 2.95 110.148 177.584 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -72.51 -30.19 64.27 Favored 'General case' 0 C--N 1.327 -0.377 0 C-N-CA 124.698 1.199 . . . . 1.49 111.035 -176.132 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 4.0 tmm? -62.78 -37.91 88.52 Favored 'General case' 0 C--N 1.33 -0.245 0 C-N-CA 123.784 0.834 . . . . 3.52 111.015 -179.374 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 23.4 p80 -87.57 -47.59 8.59 Favored 'General case' 0 C--O 1.224 -0.278 0 CA-C-O 116.832 -1.556 . . . . 1.18 109.826 179.201 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 5.2 m -0.09 104.75 0.01 OUTLIER 'General case' 0 N--CA 1.47 0.557 0 C-N-CA 128.297 2.639 . . . . 2.06 113.624 -173.454 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 2.1 p -45.7 -41.62 10.71 Favored 'General case' 0 N--CA 1.452 -0.372 0 C-N-CA 125.685 1.594 . . . . 1.86 111.621 -177.086 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 59.4 t0 -69.48 103.5 2.06 Favored 'General case' 0 N--CA 1.455 -0.223 0 C-N-CA 118.589 -1.244 . . . . 2.11 109.129 167.381 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 1.7 p80 -42.03 -36.57 1.16 Allowed 'General case' 0 CA--C 1.53 0.177 0 C-N-CA 124.462 1.105 . . . . 5.68 112.63 172.581 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -58.1 -48.84 78.97 Favored 'General case' 0 N--CA 1.451 -0.38 0 C-N-CA 122.644 0.378 . . . . 1.87 111.011 178.91 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -53.62 -38.55 64.13 Favored 'General case' 0 C--O 1.232 0.181 0 C-N-CA 123.407 0.683 . . . . 3.85 110.964 179.073 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 3.3 mtp-105 -65.4 -51.4 60.65 Favored 'General case' 0 C--N 1.328 -0.334 0 C-N-CA 120.167 -0.613 . . . . 4.25 109.702 178.383 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -60.53 -26.7 67.07 Favored 'General case' 0 N--CA 1.452 -0.344 0 CA-C-O 118.656 -0.688 . . . . 1.56 112.695 177.752 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 37.6 mttt -65.14 -42.39 93.86 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 119.691 1.132 . . . . 2.71 108.489 175.814 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 78.5 t -62.77 -60.34 2.91 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.485 0 CA-C-O 117.4 -1.286 . . . . 1.57 111.612 171.138 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 11.9 mt-30 -49.11 -46.55 45.01 Favored 'General case' 0 N--CA 1.468 0.446 0 CA-C-N 121.19 1.814 . . . . 2.2 111.619 -175.86 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 18.5 tttt -60.25 -52.33 65.73 Favored 'General case' 0 N--CA 1.449 -0.494 0 C-N-CA 123.737 0.815 . . . . 3.16 110.57 178.803 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 19.3 m-20 -84.25 5.38 26.86 Favored 'General case' 0 CA--C 1.533 0.293 0 C-N-CA 123.296 0.638 . . . . 1.41 111.516 -174.629 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -164.47 77.93 1.47 Allowed Pre-proline 0 N--CA 1.448 -0.553 0 C-N-CA 125.324 1.45 . . . . 1.62 108.894 -177.696 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 96.8 Cg_endo -80.65 47.42 2.55 Favored 'Trans proline' 0 CA--C 1.539 0.76 0 C-N-CA 124.211 3.274 . . . . 1.81 111.624 -175.101 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 4.0 ptmt -169.06 -51.14 0.02 OUTLIER 'General case' 0 C--O 1.225 -0.233 0 C-N-CA 126.436 1.894 . . . . 3.26 109.643 -176.889 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 3.2 m -53.19 -45.61 68.66 Favored 'General case' 0 N--CA 1.464 0.231 0 CA-C-N 119.09 0.859 . . . . 1.43 111.817 179.913 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 9.1 t80 -60.2 -47.27 86.69 Favored 'General case' 0 CA--C 1.514 -0.408 0 CA-C-O 121.572 0.701 . . . . 4.0 110.039 178.527 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 2.0 tt0 -57.89 -30.14 65.62 Favored 'General case' 0 N--CA 1.442 -0.834 0 CA-C-N 114.746 -1.115 . . . . 2.37 110.471 179.253 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 3.9 t80 -64.49 -57.41 9.3 Favored 'General case' 0 N--CA 1.455 -0.196 0 C-N-CA 124.715 1.206 . . . . 1.18 109.917 -175.723 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 3.2 mp -58.79 -41.99 84.18 Favored 'Isoleucine or valine' 0 C--O 1.226 -0.136 0 N-CA-C 108.326 -0.99 . . . . 1.81 108.326 176.108 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 7.7 t30 -59.66 -31.34 69.45 Favored 'General case' 0 CA--C 1.536 0.44 0 N-CA-C 111.617 0.228 . . . . 2.09 111.617 -179.496 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 2.4 t0 -66.2 -53.05 42.02 Favored 'General case' 0 C--N 1.338 0.095 0 C-N-CA 126.132 1.773 . . . . 2.31 108.829 175.672 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 52.5 mm-40 -86.15 70.37 10.56 Favored 'General case' 0 N--CA 1.452 -0.368 0 CA-C-O 122.501 1.143 . . . . 3.8 110.292 -177.253 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 7.3 tp -69.17 110.02 2.39 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.45 0 CA-C-N 115.464 -0.789 . . . . 4.45 109.393 176.688 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 22.2 tptt -148.8 96.84 2.63 Favored 'General case' 0 N--CA 1.458 -0.041 0 O-C-N 120.776 -1.203 . . . . 10.34 110.011 171.197 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 102' ' ' PHE . . . . . . . . . . . . . 72.4 m-85 -77.73 79.42 4.22 Favored 'General case' 0 N--CA 1.455 -0.217 0 N-CA-C 109.051 -0.722 . . . . 10.09 109.051 172.922 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 3.5 tp -81.21 138.96 18.75 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.198 0 N-CA-C 107.095 -1.446 . . . . 4.21 107.095 168.863 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 104' ' ' ILE . . . . . . . . . . . . . 19.1 tt -155.93 120.02 0.46 Allowed 'Isoleucine or valine' 0 N--CA 1.453 -0.282 0 N-CA-C 108.327 -0.99 . . . . 8.82 108.327 175.278 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 5.1 p-10 -164.68 166.63 19.86 Favored 'General case' 0 C--N 1.33 -0.277 0 N-CA-C 107.589 -1.263 . . . . 10.73 107.589 176.165 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 64.2 m . . . . . 0 C--O 1.252 1.219 0 CA-C-O 116.582 -1.675 . . . . 12.2 107.425 160.011 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.472 1.078 0 N-CA-C 108.839 -1.704 . . . . 11.54 108.839 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 18.9 m -143.04 146.37 33.77 Favored 'General case' 0 C--O 1.238 0.497 0 N-CA-C 108.585 -0.895 . . . . 12.32 108.585 173.482 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -170.06 112.12 0.45 Allowed 'General case' 0 CA--C 1.529 0.167 0 CA-C-N 118.229 0.468 . . . . 15.31 110.66 172.842 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 92.47 -156.4 23.27 Favored Glycine 0 C--N 1.334 0.447 0 N-CA-C 110.613 -0.995 . . . . 13.26 110.613 175.992 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 34.3 m -80.22 -160.15 0.05 OUTLIER 'Isoleucine or valine' 0 N--CA 1.442 -0.843 0 N-CA-C 107.652 -1.24 . . . . 13.69 107.652 161.826 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -103.07 122.69 45.18 Favored 'General case' 0 N--CA 1.443 -0.812 0 N-CA-C 108.572 -0.899 . . . . 9.35 108.572 173.365 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 1.9 mm? -111.7 35.73 3.55 Favored 'General case' 0 N--CA 1.454 -0.26 0 C-N-CA 125.409 1.484 . . . . 9.15 108.448 -177.841 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER 71.15 -60.74 0.5 Allowed 'General case' 0 C--O 1.222 -0.354 0 C-N-CA 125.663 1.585 . . . . 10.98 109.893 -162.518 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 32.5 m-20 -55.05 -45.26 75.26 Favored 'General case' 0 C--O 1.224 -0.275 0 CA-C-N 119.279 0.945 . . . . 4.17 112.313 -174.246 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 5.9 t70 -74.34 -25.71 59.7 Favored 'General case' 0 C--O 1.223 -0.327 0 C-N-CA 119.009 -1.076 . . . . 2.69 111.2 -178.735 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -68.88 -65.07 0.75 Allowed 'General case' 0 CA--C 1.534 0.327 0 CA-C-O 121.975 0.893 . . . . 2.66 109.632 175.835 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 49.5 mt-10 -61.72 -38.04 86.41 Favored 'General case' 0 N--CA 1.455 -0.196 0 C-N-CA 126.376 1.87 . . . . 3.33 109.038 -176.236 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -62.55 -56.35 22.05 Favored Glycine 0 N--CA 1.45 -0.423 0 C-N-CA 124.701 1.143 . . . . 0.76 110.295 176.441 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 39.8 t80 -52.34 -56.42 15.0 Favored 'General case' 0 C--O 1.225 -0.197 0 CA-C-N 117.911 0.855 . . . . 5.2 110.206 -178.02 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 0.7 OUTLIER -65.72 -31.93 55.92 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.21 0 O-C-N 121.761 -0.587 . . . . 1.67 112.111 -177.778 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 9.1 t60 -60.78 -54.74 41.46 Favored 'General case' 0 CA--C 1.532 0.254 0 N-CA-C 107.388 -1.338 . . . . 0.73 107.388 177.647 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 22.4 mt-10 -53.2 -39.37 63.65 Favored 'General case' 0 C--O 1.222 -0.353 0 C-N-CA 123.773 0.829 . . . . 2.14 110.639 174.977 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 5.1 t80 -58.05 -47.67 82.43 Favored 'General case' 0 CA--C 1.52 -0.182 0 C-N-CA 123.757 0.823 . . . . 4.34 110.259 -178.407 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -49.07 -48.73 31.29 Favored Glycine 0 CA--C 1.524 0.621 0 N-CA-C 110.508 -1.037 . . . . 0.46 110.508 171.068 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 20' ' ' HIS . . . . . 0.406 ' CE1' ' HB3' ' A' ' 64' ' ' ALA . 2.0 t60 -60.69 -45.53 93.84 Favored 'General case' 0 N--CA 1.451 -0.384 0 O-C-N 122.002 -0.705 . . . . 2.61 112.0 -178.4 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -66.32 -27.24 67.76 Favored 'General case' 0 N--CA 1.452 -0.354 0 O-C-N 121.606 -0.684 . . . . 1.61 110.032 -179.599 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 55.8 t -73.44 -37.83 51.7 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.185 0 C-N-CA 119.406 -0.918 . . . . 1.77 110.187 174.586 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 7.0 t0 -57.73 -31.15 66.16 Favored 'General case' 0 N--CA 1.453 -0.319 0 C-N-CA 122.718 0.407 . . . . 1.89 110.954 174.464 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 9.9 t70 -63.52 -54.82 30.35 Favored 'General case' 0 N--CA 1.457 -0.093 0 N-CA-C 108.098 -1.075 . . . . 2.03 108.098 -176.125 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 0.9 OUTLIER -54.89 -51.21 66.69 Favored 'General case' 0 N--CA 1.456 -0.168 0 CA-C-N 115.308 -0.86 . . . . 3.85 109.362 177.183 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -56.16 -40.33 73.69 Favored 'General case' 0 N--CA 1.447 -0.576 0 CA-C-O 119.1 -0.476 . . . . 1.88 111.081 -177.167 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -84.89 -14.69 69.21 Favored Glycine 0 CA--C 1.525 0.663 0 C-N-CA 123.723 0.678 . . . . 1.29 112.403 -174.977 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 1.2 t80 -74.95 -45.05 44.95 Favored 'General case' 0 N--CA 1.453 -0.291 0 CA-C-N 117.898 0.849 . . . . 2.48 108.952 174.178 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 3.2 mm? -82.64 -36.41 26.07 Favored 'General case' 0 N--CA 1.449 -0.502 0 C-N-CA 125.151 1.38 . . . . 2.68 112.658 -177.126 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 10.2 mt -124.66 124.2 41.68 Favored 'General case' 0 N--CA 1.452 -0.338 0 N-CA-C 107.172 -1.418 . . . . 2.55 107.172 -168.461 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 2.2 t70 69.33 169.86 0.3 Allowed 'General case' 0 CA--C 1.54 0.581 0 N-CA-C 109.122 -0.696 . . . . 5.08 109.122 -165.254 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 32.7 mtpt -156.11 119.75 4.37 Favored 'General case' 0 N--CA 1.463 0.177 0 N-CA-C 107.004 -1.48 . . . . 10.0 107.004 172.075 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 43.5 t-20 -152.53 174.75 13.53 Favored 'General case' 0 CA--C 1.532 0.28 0 N-CA-C 107.471 -1.307 . . . . 7.63 107.471 178.862 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 10.2 tt0 -64.5 -11.95 39.2 Favored 'General case' 0 CA--C 1.537 0.458 0 CA-C-N 119.595 1.089 . . . . 10.08 111.449 173.062 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -121.65 99.26 6.36 Favored 'General case' 0 N--CA 1.446 -0.659 0 N-CA-C 105.614 -1.995 . . . . 7.61 105.614 171.87 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 1.2 p30 -78.5 81.07 4.86 Favored 'General case' 0 C--N 1.328 -0.365 0 C-N-CA 125.664 1.585 . . . . 6.81 109.194 179.397 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 5.4 mp -141.59 140.68 33.41 Favored 'General case' 0 CA--C 1.53 0.18 0 N-CA-C 107.197 -1.409 . . . . 3.75 107.197 174.36 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 6.0 p -83.11 34.15 0.05 OUTLIER 'Isoleucine or valine' 0 CA--C 1.538 0.493 0 C-N-CA 124.553 1.141 . . . . 2.68 110.941 -177.523 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 71.7 p -115.61 79.62 1.32 Allowed 'General case' 0 N--CA 1.449 -0.489 0 O-C-N 120.54 -1.35 . . . . 5.26 108.068 -170.49 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 19.1 t-20 -173.16 -42.78 0.01 OUTLIER 'General case' 0 C--N 1.333 -0.133 0 C-N-CA 123.815 0.846 . . . . 6.45 109.712 -179.039 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 65.9 p -65.0 166.48 9.27 Favored 'General case' 0 CA--C 1.541 0.603 0 C-N-CA 126.012 1.725 . . . . 3.94 112.311 -172.577 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 56.7 mttm 49.98 82.5 0.05 Allowed 'General case' 0 N--CA 1.47 0.548 0 C-N-CA 125.98 1.712 . . . . 6.52 112.015 -168.39 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER 67.51 116.99 0.03 OUTLIER 'General case' 0 N--CA 1.468 0.475 0 C-N-CA 126.84 2.056 . . . . 7.45 108.031 -168.76 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 2.2 m-85 -47.35 109.07 0.18 Allowed 'General case' 0 CA--C 1.527 0.092 0 C-N-CA 123.755 0.822 . . . . 6.66 109.435 178.05 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 47.6 pt 44.14 72.2 0.08 OUTLIER 'Isoleucine or valine' 0 C--O 1.219 -0.517 0 C-N-CA 125.751 1.621 . . . . 3.75 111.293 176.262 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 10.2 t70 -102.07 -59.87 1.63 Allowed 'General case' 0 N--CA 1.466 0.373 0 O-C-N 120.578 -1.326 . . . . 2.56 110.451 -173.253 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 2.9 mm -51.42 -48.16 34.55 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.226 0 C-N-CA 126.911 2.084 . . . . 1.64 109.526 176.78 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 20.0 t80 -63.42 -31.92 73.21 Favored 'General case' 0 N--CA 1.45 -0.436 0 O-C-N 121.039 -1.038 . . . . 0.61 112.229 177.917 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . 0.477 ' HA ' ' HE2' ' A' ' 49' ' ' LYS . 10.8 mmpt? -69.97 -45.52 67.18 Favored 'General case' 0 C--N 1.33 -0.265 0 O-C-N 119.662 -1.899 . . . . 2.13 110.543 -177.954 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 7.2 mm-40 -79.95 -65.76 0.96 Allowed 'General case' 0 N--CA 1.452 -0.344 0 CA-C-O 121.901 0.858 . . . . 3.13 109.526 -176.906 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 14.0 mp0 -73.53 -28.32 61.82 Favored 'General case' 0 CA--C 1.533 0.314 0 O-C-N 121.492 -0.755 . . . . 2.65 110.64 -172.33 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . 0.409 ' HA2' ' CD1' ' A' ' 66' ' ' PHE . . . -68.99 33.5 0.29 Allowed Glycine 0 CA--C 1.533 1.158 0 C-N-CA 124.944 1.259 . . . . 0.38 114.498 168.285 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 32.6 t -149.61 44.16 0.93 Allowed 'General case' 0 N--CA 1.447 -0.58 0 O-C-N 120.79 -1.418 . . . . 2.38 107.56 158.84 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -148.48 -42.41 0.16 Allowed 'General case' 0 CA--C 1.516 -0.334 0 N-CA-C 114.003 1.112 . . . . 3.04 114.003 -176.078 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 19.0 mt -61.89 -38.69 89.27 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-O 120.954 0.407 . . . . 1.73 110.778 -176.737 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 1.2 t 178.63 172.76 0.73 Allowed 'General case' 0 CA--C 1.531 0.236 0 C-N-CA 125.41 1.484 . . . . 1.6 107.678 -176.325 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 10.7 m -60.86 -34.66 74.94 Favored 'General case' 0 N--CA 1.453 -0.303 0 O-C-N 121.671 -0.643 . . . . 1.28 110.408 168.45 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 1.6 m-85 -67.5 -10.82 55.25 Favored 'General case' 0 N--CA 1.464 0.242 0 N-CA-C 112.332 0.493 . . . . 2.14 112.332 173.831 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -83.1 -9.37 84.25 Favored Glycine 0 N--CA 1.443 -0.879 0 N-CA-C 110.825 -0.91 . . . . 0.46 110.825 173.775 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 3.4 tmt_? -120.96 -6.39 9.54 Favored 'General case' 0 CA--C 1.526 0.03 0 CA-C-N 118.994 1.397 . . . . 3.21 112.767 -173.81 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 19.5 p -67.56 -145.32 0.01 OUTLIER 'General case' 0 CA--C 1.54 0.575 0 C-N-CA 124.689 1.196 . . . . 1.76 108.947 169.277 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 32.5 m-80 -62.36 148.75 44.27 Favored 'General case' 0 N--CA 1.456 -0.158 0 O-C-N 119.318 -2.114 . . . . 2.95 109.261 178.269 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 58.2 tt0 -60.37 -27.86 67.74 Favored 'General case' 0 CA--C 1.537 0.449 0 CA-C-O 121.819 0.819 . . . . 2.78 111.065 -179.565 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 64' ' ' ALA . . . . . 0.406 ' HB3' ' CE1' ' A' ' 20' ' ' HIS . . . -59.32 -40.92 87.79 Favored 'General case' 0 N--CA 1.452 -0.362 0 C-N-CA 124.643 1.177 . . . . 1.92 112.507 171.564 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 10.4 mt-10 -70.41 -47.09 62.42 Favored 'General case' 0 N--CA 1.446 -0.631 0 CA-C-O 118.211 -0.899 . . . . 2.04 109.828 176.927 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 66' ' ' PHE . . . . . 0.409 ' CD1' ' HA2' ' A' ' 52' ' ' GLY . 48.7 t80 -45.86 -51.92 12.21 Favored 'General case' 0 N--CA 1.454 -0.249 0 C-N-CA 124.042 0.937 . . . . 0.38 111.576 175.23 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 60.1 t80 -65.11 -43.81 90.81 Favored 'General case' 0 CA--C 1.538 0.5 0 O-C-N 121.426 -0.796 . . . . 0.46 110.98 178.27 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -62.73 -53.89 47.47 Favored 'General case' 0 CA--C 1.541 0.611 0 O-C-N 121.023 -1.048 . . . . 1.43 113.156 -176.23 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -57.78 -40.15 79.14 Favored 'General case' 0 C--N 1.332 -0.154 0 O-C-N 120.435 -1.416 . . . . 3.83 110.738 171.388 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -56.76 -39.41 73.95 Favored 'General case' 0 N--CA 1.451 -0.378 0 CA-C-O 118.282 -0.866 . . . . 1.74 110.951 176.899 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 58.6 t80 -57.61 -49.82 75.18 Favored 'General case' 0 N--CA 1.465 0.299 0 CA-C-N 120.195 1.361 . . . . 5.51 111.05 172.375 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 38.0 ttp85 -49.5 -57.7 6.55 Favored 'General case' 0 C--N 1.341 0.218 0 N-CA-C 109.235 -0.654 . . . . 4.38 109.235 178.256 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -64.09 -29.6 70.72 Favored 'General case' 0 N--CA 1.451 -0.409 0 C-N-CA 124.34 1.056 . . . . 1.64 110.834 -174.704 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 1.4 ttp -60.7 -41.44 95.19 Favored 'General case' 0 C--O 1.234 0.271 0 C-N-CA 123.042 0.537 . . . . 3.17 110.116 -179.582 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 5.8 p80 -97.48 -9.79 26.53 Favored 'General case' 0 N--CA 1.454 -0.266 0 CA-C-O 116.238 -1.839 . . . . 1.1 113.97 -177.598 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 8.0 m -36.19 123.78 0.75 Allowed 'General case' 0 CA--C 1.516 -0.363 0 CA-C-N 120.363 1.438 . . . . 1.72 111.505 -169.026 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 2.1 p -48.95 -42.82 38.75 Favored 'General case' 0 N--CA 1.45 -0.467 0 CA-C-N 113.318 -1.765 . . . . 2.07 109.068 -179.791 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 14.9 t0 -70.52 104.19 2.7 Favored 'General case' 0 N--CA 1.445 -0.705 0 CA-C-O 122.439 1.114 . . . . 1.78 109.764 165.879 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 18.1 p-80 -45.39 -38.84 6.29 Favored 'General case' 0 N--CA 1.453 -0.284 0 CA-C-N 115.064 -0.971 . . . . 5.51 112.763 170.909 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -63.35 -44.64 94.26 Favored 'General case' 0 N--CA 1.451 -0.391 0 O-C-N 121.537 -0.727 . . . . 1.51 110.179 -177.82 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 1.8 tt0 -47.61 -43.16 25.54 Favored 'General case' 0 C--O 1.231 0.127 0 C-N-CA 123.948 0.899 . . . . 2.76 110.389 175.185 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 4.5 mtp180 -62.79 -51.0 68.78 Favored 'General case' 0 CA--C 1.516 -0.359 0 N-CA-C 108.774 -0.824 . . . . 3.63 108.774 -179.405 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 1.6 mm? -63.68 -18.62 64.17 Favored 'General case' 0 N--CA 1.455 -0.211 0 CA-C-O 118.194 -0.907 . . . . 1.46 113.355 176.664 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 1.9 mptm? -65.93 -47.46 74.65 Favored 'General case' 0 CA--C 1.521 -0.164 0 CA-C-N 120.856 1.662 . . . . 2.67 107.998 169.234 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 84.8 t -60.58 -59.07 4.74 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.6 0 CA-C-O 118.401 -0.809 . . . . 1.71 110.206 175.19 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -52.69 -48.62 66.42 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 120.075 1.307 . . . . 2.85 111.959 -175.803 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 18.5 pttt -65.19 -41.07 94.91 Favored 'General case' 0 CA--C 1.533 0.32 0 O-C-N 120.931 -1.106 . . . . 3.99 110.676 -177.975 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 37.8 m-20 -74.81 -20.68 59.67 Favored 'General case' 0 CA--C 1.534 0.335 0 C-N-CA 122.712 0.405 . . . . 1.38 111.013 -179.208 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -157.43 67.11 3.88 Favored Pre-proline 0 N--CA 1.45 -0.459 0 C-N-CA 125.932 1.693 . . . . 1.23 108.959 -163.549 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 25.4 Cg_endo -60.33 -28.84 87.6 Favored 'Trans proline' 0 N--CA 1.455 -0.786 0 C-N-CA 122.255 1.97 . . . . 2.56 110.919 -173.486 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -89.31 -43.8 10.69 Favored 'General case' 0 N--CA 1.451 -0.387 0 C-N-CA 126.215 1.806 . . . . 3.19 111.941 -174.561 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 4.9 m -56.86 -44.52 82.26 Favored 'General case' 0 N--CA 1.465 0.28 0 CA-C-N 120.168 1.349 . . . . 1.64 110.909 178.791 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 13.5 t80 -55.39 -49.42 72.39 Favored 'General case' 0 CA--C 1.512 -0.498 0 C-N-CA 120.123 -0.631 . . . . 2.94 110.631 176.008 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 9.8 tt0 -59.22 -30.09 67.98 Favored 'General case' 0 N--CA 1.445 -0.693 0 CA-C-N 115.594 -0.73 . . . . 2.82 110.894 -179.508 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 4.6 t80 -61.46 -57.86 10.47 Favored 'General case' 0 C--O 1.231 0.12 0 C-N-CA 123.781 0.833 . . . . 1.35 109.047 -176.687 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 3.4 mp -58.45 -42.48 84.39 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.254 0 N-CA-C 108.681 -0.859 . . . . 1.87 108.681 175.983 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -57.44 -35.69 70.44 Favored 'General case' 0 CA--C 1.532 0.266 0 CA-C-N 118.445 0.566 . . . . 2.96 111.515 -177.73 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -70.31 -39.88 74.53 Favored 'General case' 0 CA--C 1.532 0.253 0 C-N-CA 123.509 0.724 . . . . 2.09 109.416 179.263 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 7.6 mm-40 -65.19 -60.48 2.96 Favored 'General case' 0 CA--C 1.535 0.393 0 C-N-CA 124.413 1.085 . . . . 3.15 112.428 179.601 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 1.2 pt -70.45 86.84 0.27 Allowed 'Isoleucine or valine' 0 CA--C 1.527 0.074 0 O-C-N 121.478 -0.764 . . . . 7.01 111.135 -172.034 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 8.5 tttt -134.05 109.42 8.95 Favored 'General case' 0 N--CA 1.45 -0.457 0 N-CA-C 107.738 -1.208 . . . . 11.39 107.738 -171.991 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 102' ' ' PHE . . . . . . . . . . . . . 30.6 p90 42.1 29.92 0.16 Allowed 'General case' 0 CA--C 1.537 0.462 0 C-N-CA 126.16 1.784 . . . . 9.77 113.609 -177.754 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 11.2 tp -97.85 65.18 0.31 Allowed 'Isoleucine or valine' 0 N--CA 1.454 -0.238 0 CA-C-O 122.073 0.94 . . . . 6.29 108.719 -170.933 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 104' ' ' ILE . . . . . . . . . . . . . 39.3 pt -131.06 154.67 41.08 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.134 0 N-CA-C 109.042 -0.725 . . . . 9.71 109.042 -177.698 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 1.2 t30 -153.55 116.85 4.6 Favored 'General case' 0 N--CA 1.451 -0.384 0 N-CA-C 107.155 -1.424 . . . . 7.81 107.155 175.088 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 14.1 p . . . . . 0 C--O 1.247 0.921 0 N-CA-C 106.871 -1.529 . . . . 9.1 106.871 -179.162 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.468 0.797 0 N-CA-C 109.586 -1.405 . . . . 18.21 109.586 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 2.7 p -65.88 148.38 51.87 Favored 'General case' 0 N--CA 1.451 -0.409 0 C-N-CA 124.755 1.222 . . . . 17.04 111.911 -173.487 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 5.2 ptpt -171.06 170.8 6.05 Favored 'General case' 0 N--CA 1.465 0.305 0 C-N-CA 125.77 1.628 . . . . 22.09 108.032 166.058 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 148.73 177.08 22.65 Favored Glycine 0 C--N 1.332 0.358 0 N-CA-C 110.111 -1.196 . . . . 16.65 110.111 172.878 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 21.6 m -83.91 -160.27 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.445 -0.715 0 N-CA-C 108.912 -0.773 . . . . 17.65 108.912 170.952 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 10.6 pt-20 -85.25 115.44 23.03 Favored 'General case' 0 N--CA 1.446 -0.64 0 CA-C-O 122.575 1.179 . . . . 12.34 110.958 173.297 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -146.99 50.6 1.1 Allowed 'General case' 0 N--CA 1.447 -0.596 0 C-N-CA 126.199 1.799 . . . . 11.73 107.461 173.687 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 38.5 mtp180 53.86 39.75 30.75 Favored 'General case' 0 C--O 1.226 -0.182 0 C-N-CA 124.133 0.973 . . . . 7.34 111.996 -174.9 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 3.3 m-20 -52.8 -31.6 39.55 Favored 'General case' 0 C--O 1.219 -0.53 0 N-CA-C 112.374 0.509 . . . . 4.26 112.374 -179.108 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 2.6 t70 -62.46 -55.69 25.2 Favored 'General case' 0 C--N 1.324 -0.533 0 C-N-CA 123.058 0.543 . . . . 2.34 111.27 175.199 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 12.1 t -71.05 -48.95 49.88 Favored 'General case' 0 C--N 1.33 -0.248 0 N-CA-C 109.338 -0.616 . . . . 2.88 109.338 -171.651 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -67.39 -34.35 77.1 Favored 'General case' 0 C--O 1.221 -0.436 0 N-CA-C 107.957 -1.127 . . . . 5.86 107.957 179.661 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -60.35 -46.42 94.34 Favored Glycine 0 C--O 1.22 -0.724 0 N-CA-C 109.711 -1.355 . . . . 1.33 109.711 178.866 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -57.56 -57.48 12.5 Favored 'General case' 0 N--CA 1.454 -0.271 0 CA-C-N 118.422 1.111 . . . . 4.31 110.312 -177.174 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER -66.91 -31.59 54.14 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.336 0 O-C-N 121.265 -0.897 . . . . 1.69 111.849 -176.933 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 2.5 t-160 -63.32 -57.64 9.74 Favored 'General case' 0 N--CA 1.45 -0.46 0 N-CA-C 106.878 -1.527 . . . . 1.14 106.878 -179.411 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 42.4 mt-10 -57.88 -32.51 67.77 Favored 'General case' 0 N--CA 1.446 -0.641 0 C-N-CA 124.573 1.149 . . . . 2.96 110.552 177.408 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 4.3 t80 -55.95 -49.75 72.67 Favored 'General case' 0 C--N 1.332 -0.161 0 CA-C-N 120.388 1.449 . . . . 4.41 110.02 174.481 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -51.95 -47.11 54.74 Favored Glycine 0 CA--C 1.526 0.749 0 N-CA-C 111.308 -0.717 . . . . 0.76 111.308 173.499 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 2.4 t-160 -65.89 -50.66 63.68 Favored 'General case' 0 N--CA 1.452 -0.348 0 O-C-N 121.608 -0.936 . . . . 2.73 111.69 -174.374 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -57.54 -31.2 65.86 Favored 'General case' 0 N--CA 1.446 -0.647 0 C-N-CA 124.672 1.189 . . . . 1.65 109.624 -179.184 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 71.4 t -67.69 -45.84 83.9 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.238 0 C-N-CA 118.663 -1.215 . . . . 2.06 110.944 173.439 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 2.2 t70 -59.77 -28.27 67.26 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 121.136 0.494 . . . . 2.18 111.57 175.217 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 11.2 t70 -74.45 -50.26 19.1 Favored 'General case' 0 N--CA 1.452 -0.367 0 N-CA-C 108.061 -1.089 . . . . 2.22 108.061 -172.805 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 26.5 t80 -59.12 -49.88 76.17 Favored 'General case' 0 N--CA 1.448 -0.529 0 CA-C-N 115.388 -0.824 . . . . 3.46 108.99 177.553 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -51.65 -40.06 59.29 Favored 'General case' 0 N--CA 1.45 -0.475 0 CA-C-O 119.213 -0.422 . . . . 2.0 111.129 173.814 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -75.74 -25.01 68.35 Favored Glycine 0 CA--C 1.524 0.599 0 CA-C-N 118.909 0.777 . . . . 1.77 113.448 -176.265 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 1.4 t80 -82.33 -39.95 22.11 Favored 'General case' 0 N--CA 1.455 -0.176 0 CA-C-N 118.342 1.071 . . . . 3.04 109.661 178.09 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -80.71 -30.63 36.28 Favored 'General case' 0 N--CA 1.452 -0.363 0 C-N-CA 124.405 1.082 . . . . 3.4 112.932 -177.411 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 9.1 mt -123.36 132.68 54.05 Favored 'General case' 0 N--CA 1.449 -0.478 0 N-CA-C 106.654 -1.61 . . . . 3.36 106.654 -170.248 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 1.7 t70 66.63 -155.2 0.24 Allowed 'General case' 0 CA--C 1.536 0.44 0 N-CA-C 109.087 -0.709 . . . . 4.55 109.087 -169.614 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 9.7 tmtt? -148.7 175.01 11.57 Favored 'General case' 0 C--O 1.227 -0.109 0 N-CA-C 107.472 -1.307 . . . . 12.75 107.472 172.223 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 54.1 t30 -62.53 101.52 0.25 Allowed 'General case' 0 N--CA 1.454 -0.26 0 O-C-N 121.187 -0.945 . . . . 9.37 109.766 178.211 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -130.62 -38.93 1.29 Allowed 'General case' 0 CA--C 1.53 0.179 0 C-N-CA 125.321 1.449 . . . . 8.25 109.964 -176.935 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 5.7 t -132.73 -85.13 0.47 Allowed 'General case' 0 N--CA 1.454 -0.267 0 N-CA-C 108.467 -0.938 . . . . 7.34 108.467 177.737 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 68.4 t0 -151.15 109.0 3.68 Favored 'General case' 0 C--O 1.226 -0.172 0 N-CA-C 106.278 -1.749 . . . . 7.62 106.278 176.233 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 46.2 mt 43.38 -141.83 0.16 Allowed 'General case' 0 CA--C 1.543 0.71 0 C-N-CA 125.146 1.378 . . . . 4.92 112.573 178.066 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 5.5 p -85.41 -39.22 13.73 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.289 0 CA-C-N 119.41 1.005 . . . . 3.05 109.861 178.38 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 11.5 p 40.56 -166.82 0.0 OUTLIER 'General case' 0 CA--C 1.537 0.473 0 C-N-CA 128.567 2.747 . . . . 4.03 113.988 -176.516 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 8.2 t30 -74.7 88.13 2.21 Favored 'General case' 0 N--CA 1.453 -0.293 0 O-C-N 120.133 -1.604 . . . . 8.04 109.623 179.053 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 1.3 p -97.77 23.48 7.87 Favored 'General case' 0 N--CA 1.447 -0.603 0 CA-C-N 114.198 -1.365 . . . . 3.97 110.583 179.368 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 11.5 tttt -82.72 -77.4 0.24 Allowed 'General case' 0 C--N 1.344 0.328 0 O-C-N 120.966 -1.083 . . . . 8.88 110.895 -177.934 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -97.3 5.47 49.9 Favored 'General case' 0 CA--C 1.532 0.284 0 O-C-N 121.285 -0.884 . . . . 7.71 110.563 -177.952 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER 85.1 86.95 0.02 OUTLIER 'General case' 0 C--N 1.342 0.251 0 C-N-CA 126.95 2.1 . . . . 5.71 108.287 172.625 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 14.5 tt 38.39 70.54 0.07 OUTLIER 'Isoleucine or valine' 0 CA--C 1.539 0.556 0 C-N-CA 125.953 1.701 . . . . 3.4 112.49 -177.966 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 19.7 t70 -131.78 -60.65 0.92 Allowed 'General case' 0 N--CA 1.464 0.26 0 C-N-CA 124.209 1.004 . . . . 2.14 110.367 -163.85 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 47' ' ' ILE . . . . . 0.414 ' CG2' ' HG1' ' A' ' 92' ' ' THR . 2.3 mm -45.52 -49.04 4.0 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.546 0 CA-C-O 122.749 1.262 . . . . 1.94 109.671 169.277 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 28.7 t80 -65.76 -28.36 68.97 Favored 'General case' 0 N--CA 1.452 -0.356 0 O-C-N 120.397 -1.439 . . . . 0.53 112.386 -179.754 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -65.04 -55.29 19.78 Favored 'General case' 0 N--CA 1.454 -0.263 0 O-C-N 120.049 -1.657 . . . . 1.89 109.801 174.764 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 6.4 mm-40 -74.0 -70.74 0.37 Allowed 'General case' 0 N--CA 1.451 -0.421 0 N-CA-C 108.687 -0.857 . . . . 2.97 108.687 -173.337 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . 0.535 ' OE2' ' HE2' ' A' ' 91' ' ' LYS . 18.5 mp0 -70.21 -31.36 68.75 Favored 'General case' 0 C--O 1.235 0.32 0 O-C-N 121.544 -0.722 . . . . 2.56 110.693 -171.577 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . 0.441 ' HA2' ' CD1' ' A' ' 66' ' ' PHE . . . -69.92 35.96 0.39 Allowed Glycine 0 CA--C 1.53 1.0 0 C-N-CA 124.59 1.09 . . . . 0.33 114.155 170.341 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 33.2 p -142.39 20.14 2.05 Favored 'General case' 0 N--CA 1.449 -0.517 0 O-C-N 120.81 -1.406 . . . . 2.68 111.535 157.915 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -134.04 -35.16 0.96 Allowed 'General case' 0 C--N 1.342 0.24 0 N-CA-C 112.871 0.693 . . . . 3.97 112.871 -171.629 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 29.4 mt -61.89 -39.18 91.06 Favored 'General case' 0 N--CA 1.465 0.293 0 CA-C-N 119.302 0.955 . . . . 1.66 110.927 -175.817 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 1.2 t 178.2 173.65 0.62 Allowed 'General case' 0 CA--C 1.531 0.233 0 C-N-CA 125.463 1.505 . . . . 1.59 107.564 -179.146 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 14.7 m -58.64 -36.39 74.02 Favored 'General case' 0 N--CA 1.453 -0.306 0 O-C-N 121.712 -0.617 . . . . 1.34 110.819 168.526 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -68.54 -12.43 61.26 Favored 'General case' 0 N--CA 1.467 0.381 0 CA-C-N 118.401 0.546 . . . . 1.6 112.191 175.001 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -86.45 -4.98 82.82 Favored Glycine 0 N--CA 1.444 -0.783 0 CA-C-O 118.596 -1.113 . . . . 0.39 110.927 173.047 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -120.4 1.95 10.74 Favored 'General case' 0 CA--C 1.529 0.169 0 CA-C-N 119.402 1.601 . . . . 4.27 112.129 -178.447 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 14.9 p -76.18 -145.99 0.03 OUTLIER 'General case' 0 CA--C 1.539 0.543 0 N-CA-C 108.605 -0.887 . . . . 1.91 108.605 170.759 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 1.6 m120 -58.16 149.57 23.53 Favored 'General case' 0 C--N 1.34 0.19 0 CA-C-N 120.532 1.515 . . . . 2.37 109.087 177.224 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -58.55 -34.42 71.0 Favored 'General case' 0 CA--C 1.533 0.317 0 CA-C-O 121.739 0.78 . . . . 2.89 110.366 178.479 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -59.31 -34.0 71.78 Favored 'General case' 0 N--CA 1.451 -0.42 0 O-C-N 121.536 -0.728 . . . . 1.71 112.922 175.277 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 12.5 mt-10 -74.19 -42.62 59.54 Favored 'General case' 0 N--CA 1.45 -0.427 0 O-C-N 121.278 -0.889 . . . . 1.85 110.408 174.932 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 66' ' ' PHE . . . . . 0.441 ' CD1' ' HA2' ' A' ' 52' ' ' GLY . 57.9 t80 -49.91 -50.45 46.1 Favored 'General case' 0 N--CA 1.455 -0.206 0 C-N-CA 123.173 0.589 . . . . 0.54 111.115 173.709 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 76.3 t80 -63.42 -42.44 98.72 Favored 'General case' 0 CA--C 1.537 0.448 0 O-C-N 121.589 -0.694 . . . . 0.7 111.28 178.291 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -70.97 -39.55 72.47 Favored 'General case' 0 CA--C 1.535 0.396 0 O-C-N 121.095 -1.003 . . . . 1.77 111.802 -172.616 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -76.71 -31.72 57.37 Favored 'General case' 0 N--CA 1.449 -0.484 0 O-C-N 121.281 -0.887 . . . . 3.27 109.232 179.121 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -55.02 -47.28 74.92 Favored 'General case' 0 C--O 1.222 -0.355 0 O-C-N 121.684 -0.635 . . . . 1.49 109.394 167.944 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -50.47 -47.41 57.03 Favored 'General case' 0 N--CA 1.468 0.442 0 CA-C-N 119.289 0.95 . . . . 4.83 112.212 172.098 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 49.5 ttp85 -53.35 -52.17 60.1 Favored 'General case' 0 CA--C 1.534 0.345 0 CA-C-N 118.71 0.687 . . . . 4.19 109.95 176.659 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . 0.405 HD12 ' CG2' ' A' ' 85' ' ' VAL . 0.2 OUTLIER -71.44 -25.36 62.28 Favored 'General case' 0 C--N 1.327 -0.372 0 C-N-CA 123.88 0.872 . . . . 1.72 111.717 -173.888 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 38.9 mmm -62.16 -39.74 93.67 Favored 'General case' 0 C--O 1.234 0.265 0 C-N-CA 124.751 1.22 . . . . 3.81 110.537 178.829 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 8.7 p80 -96.87 -8.56 30.58 Favored 'General case' 0 N--CA 1.455 -0.185 0 CA-C-O 116.24 -1.838 . . . . 1.34 113.151 -177.857 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 3.2 m -33.71 119.74 0.39 Allowed 'General case' 0 C--N 1.344 0.343 0 C-N-CA 124.763 1.225 . . . . 1.88 111.089 -170.476 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 1.3 p -51.02 -42.26 60.32 Favored 'General case' 0 N--CA 1.45 -0.43 0 CA-C-N 113.481 -1.691 . . . . 2.12 108.863 -177.938 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 12.6 t0 -71.4 110.06 5.78 Favored 'General case' 0 N--CA 1.447 -0.613 0 CA-C-O 121.998 0.904 . . . . 1.91 109.344 164.578 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 6.9 p80 -50.41 -37.43 37.76 Favored 'General case' 0 N--CA 1.452 -0.347 0 CA-C-N 115.867 -0.606 . . . . 5.75 111.866 172.719 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -60.17 -47.73 84.69 Favored 'General case' 0 N--CA 1.454 -0.255 0 CA-C-N 118.413 0.551 . . . . 2.03 110.224 -177.327 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 13.6 mt-10 -47.95 -41.29 24.59 Favored 'General case' 0 N--CA 1.453 -0.278 0 C-N-CA 124.057 0.943 . . . . 2.87 111.212 175.748 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 4.2 mtp180 -63.4 -48.16 79.01 Favored 'General case' 0 C--N 1.329 -0.317 0 N-CA-C 108.968 -0.753 . . . . 3.54 108.968 178.623 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 1.5 mm? -62.37 -23.71 66.96 Favored 'General case' 0 N--CA 1.452 -0.334 0 CA-C-O 117.513 -1.232 . . . . 2.0 112.932 175.88 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -63.42 -43.19 98.17 Favored 'General case' 0 N--CA 1.462 0.156 0 CA-C-N 121.678 2.035 . . . . 2.53 108.122 171.407 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 85' ' ' VAL . . . . . 0.405 ' CG2' HD12 ' A' ' 73' ' ' LEU . 86.5 t -62.22 -62.29 1.22 Allowed 'Isoleucine or valine' 0 C--O 1.218 -0.579 0 CA-C-O 117.405 -1.283 . . . . 1.65 110.629 173.696 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 1.9 mt-30 -48.86 -49.78 37.87 Favored 'General case' 0 N--CA 1.464 0.264 0 CA-C-N 120.946 1.703 . . . . 2.54 111.464 -175.628 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 51.9 tttt -55.41 -51.78 65.74 Favored 'General case' 0 N--CA 1.445 -0.707 0 C-N-CA 123.422 0.689 . . . . 2.88 111.138 178.769 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 85.7 m-20 -80.39 -5.79 57.01 Favored 'General case' 0 CA--C 1.531 0.239 0 CA-C-O 119.481 -0.295 . . . . 1.48 111.703 -176.722 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -163.92 68.0 1.57 Allowed Pre-proline 0 N--CA 1.448 -0.545 0 C-N-CA 124.223 1.009 . . . . 1.34 110.418 -167.364 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 59.5 Cg_endo -70.57 0.33 6.41 Favored 'Trans proline' 0 N--CA 1.457 -0.648 0 C-N-CA 123.057 2.504 . . . . 1.7 112.76 -174.629 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 91' ' ' LYS . . . . . 0.535 ' HE2' ' OE2' ' A' ' 51' ' ' GLU . 0.4 OUTLIER -115.81 -41.97 3.15 Favored 'General case' 0 N--CA 1.453 -0.315 0 C-N-CA 125.248 1.419 . . . . 3.84 110.15 -178.812 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 92' ' ' THR . . . . . 0.414 ' HG1' ' CG2' ' A' ' 47' ' ' ILE . 2.5 m -57.6 -44.77 85.66 Favored 'General case' 0 C--O 1.226 -0.14 0 CA-C-N 119.591 1.087 . . . . 1.5 110.74 174.66 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 9.0 t80 -60.64 -48.33 82.28 Favored 'General case' 0 CA--C 1.511 -0.556 0 CA-C-O 121.75 0.786 . . . . 3.06 110.655 179.526 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 30.3 tt0 -54.93 -34.52 63.28 Favored 'General case' 0 N--CA 1.44 -0.936 0 CA-C-N 114.762 -1.108 . . . . 2.18 110.369 177.313 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 5.5 t80 -59.82 -59.65 5.1 Favored 'General case' 0 N--CA 1.454 -0.235 0 C-N-CA 124.363 1.065 . . . . 1.2 110.573 -174.157 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 3.7 mp -60.81 -38.54 79.21 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.231 0 N-CA-C 109.04 -0.726 . . . . 2.18 109.04 176.653 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 4.3 t30 -60.46 -28.67 68.5 Favored 'General case' 0 CA--C 1.533 0.291 0 O-C-N 121.781 -0.575 . . . . 2.0 111.66 -178.965 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -68.92 -57.51 5.41 Favored 'General case' 0 N--CA 1.456 -0.146 0 C-N-CA 124.725 1.21 . . . . 2.21 109.076 174.976 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 32.4 mm-40 -80.44 89.42 5.6 Favored 'General case' 0 N--CA 1.451 -0.421 0 CA-C-O 121.378 0.608 . . . . 3.46 110.521 -177.033 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -51.28 139.76 6.48 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.42 0 CA-C-O 121.829 0.823 . . . . 6.45 112.386 -179.874 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -87.69 119.1 27.68 Favored 'General case' 0 N--CA 1.455 -0.184 0 O-C-N 121.279 -0.888 . . . . 11.83 109.759 -176.648 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 102' ' ' PHE . . . . . . . . . . . . . 4.5 t80 -153.83 99.71 2.3 Favored 'General case' 0 N--CA 1.454 -0.251 0 N-CA-C 107.646 -1.242 . . . . 7.76 107.646 173.266 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -145.69 130.13 11.86 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.287 0 N-CA-C 106.692 -1.596 . . . . 5.25 106.692 179.981 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 104' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER 59.46 175.48 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.535 0.4 0 C-N-CA 124.687 1.195 . . . . 7.59 110.876 -171.563 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -155.5 174.25 15.52 Favored 'General case' 0 C--N 1.331 -0.215 0 N-CA-C 107.261 -1.385 . . . . 7.58 107.261 162.235 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 16.4 m . . . . . 0 C--O 1.252 1.196 0 CA-C-O 117.18 -1.391 . . . . 9.28 109.3 168.216 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.469 0.866 0 N-CA-C 108.363 -1.895 . . . . 12.13 108.363 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -135.16 168.06 19.84 Favored 'General case' 0 C--N 1.332 -0.191 0 C-N-CA 124.481 1.113 . . . . 11.82 109.585 -163.242 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -166.16 158.04 13.95 Favored 'General case' 0 N--CA 1.463 0.209 0 N-CA-C 109.658 -0.497 . . . . 14.79 109.658 175.672 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 101.8 -158.39 18.5 Favored Glycine 0 C--N 1.331 0.298 0 N-CA-C 110.125 -1.19 . . . . 12.54 110.125 176.177 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 27.7 m -84.78 -158.71 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.442 -0.833 0 N-CA-C 107.753 -1.202 . . . . 12.84 107.753 163.822 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 11.3 pt-20 -99.69 119.11 37.59 Favored 'General case' 0 N--CA 1.445 -0.681 0 CA-C-O 121.998 0.904 . . . . 9.18 111.25 174.426 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 1.9 mm? -108.71 36.5 2.83 Favored 'General case' 0 N--CA 1.454 -0.271 0 C-N-CA 124.062 0.945 . . . . 8.46 109.46 -177.89 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 4.3 mmm-85 67.78 -77.57 0.05 OUTLIER 'General case' 0 N--CA 1.465 0.321 0 N-CA-C 108.263 -1.014 . . . . 8.88 108.263 -168.314 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 3.6 m-20 -44.52 -42.04 6.9 Favored 'General case' 0 C--O 1.224 -0.255 0 C-N-CA 125.5 1.52 . . . . 2.83 112.682 178.014 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 22.5 t70 -66.85 -46.13 76.02 Favored 'General case' 0 C--O 1.224 -0.274 0 C-N-CA 119.635 -0.826 . . . . 2.32 111.184 -179.934 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -64.13 -56.44 14.84 Favored 'General case' 0 C--O 1.233 0.225 0 CA-C-O 122.334 1.064 . . . . 2.29 110.041 -177.041 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 9.2 pt-20 -69.31 -28.97 66.73 Favored 'General case' 0 N--CA 1.453 -0.322 0 C-N-CA 123.75 0.82 . . . . 3.1 109.821 -175.998 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -61.91 -45.79 95.44 Favored Glycine 0 CA--C 1.525 0.686 0 C-N-CA 124.287 0.946 . . . . 0.92 110.969 169.278 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -59.51 -55.37 35.47 Favored 'General case' 0 C--N 1.333 -0.117 0 CA-C-N 118.011 0.905 . . . . 4.73 109.081 -174.465 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER -67.71 -27.69 39.0 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.25 0 O-C-N 121.656 -0.652 . . . . 1.79 111.588 179.316 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 6.6 t60 -60.79 -47.9 84.24 Favored 'General case' 0 CA--C 1.534 0.351 0 N-CA-C 107.369 -1.345 . . . . 0.94 107.369 175.36 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 32.7 mt-10 -59.42 -40.7 87.55 Favored 'General case' 0 CA--C 1.528 0.111 0 O-C-N 121.254 -0.904 . . . . 2.03 111.186 177.439 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 2.4 m-85 -50.73 -47.33 59.31 Favored 'General case' 0 CA--C 1.519 -0.229 0 CA-C-N 118.938 0.79 . . . . 5.01 110.764 173.478 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -48.81 -43.68 30.35 Favored Glycine 0 CA--C 1.533 1.192 0 CA-C-N 118.352 0.524 . . . . 0.83 111.88 176.71 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 58.0 m-70 -62.12 -49.52 75.56 Favored 'General case' 0 C--O 1.226 -0.169 0 O-C-N 121.435 -1.038 . . . . 5.12 111.768 174.481 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -59.17 -27.39 65.64 Favored 'General case' 0 CA--C 1.533 0.319 0 O-C-N 122.043 -0.41 . . . . 1.58 111.214 -178.758 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 71.4 t -68.07 -42.96 85.57 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.19 0 O-C-N 121.029 -1.044 . . . . 2.12 110.477 175.311 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 4.3 m-20 -61.22 -20.28 62.62 Favored 'General case' 0 N--CA 1.462 0.17 0 N-CA-C 111.747 0.277 . . . . 1.96 111.747 173.489 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 12.1 t70 -71.97 -54.52 9.7 Favored 'General case' 0 N--CA 1.452 -0.355 0 N-CA-C 108.778 -0.823 . . . . 2.1 108.778 -178.798 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 18.1 t80 -64.34 -51.26 64.23 Favored 'General case' 0 CA--C 1.52 -0.207 0 CA-C-N 116.472 -0.331 . . . . 3.61 110.513 -178.236 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -56.58 -31.31 64.12 Favored 'General case' 0 N--CA 1.452 -0.352 0 CA-C-O 118.269 -0.872 . . . . 2.01 111.185 175.356 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -60.86 -66.42 2.7 Favored Glycine 0 CA--C 1.524 0.616 0 CA-C-N 119.166 0.894 . . . . 1.43 111.506 172.625 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 1.2 t80 -54.69 -35.41 63.58 Favored 'General case' 0 CA--C 1.535 0.367 0 O-C-N 122.029 -0.689 . . . . 2.81 111.511 -171.09 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -85.33 -30.49 23.66 Favored 'General case' 0 N--CA 1.449 -0.494 0 N-CA-C 113.92 1.082 . . . . 2.2 113.92 -179.87 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 10.8 mt -127.14 111.37 13.92 Favored 'General case' 0 C--O 1.221 -0.4 0 CA-C-N 119.823 1.192 . . . . 2.73 108.354 -167.672 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . 0.41 0.4 OUTLIER 79.28 -165.4 0.03 OUTLIER 'General case' 0 CA--C 1.539 0.526 0 C-N-CA 124.81 1.244 . . . . 4.35 108.853 -162.387 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 179.71 -25.6 0.0 OUTLIER 'General case' 0 N--CA 1.471 0.597 0 C-N-CA 125.505 1.522 . . . . 7.32 110.366 -177.301 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 1.9 p30 -129.26 162.31 28.2 Favored 'General case' 0 N--CA 1.434 -1.235 0 C-N-CA 125.779 1.631 . . . . 8.76 107.146 179.622 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 22.5 tp60 74.49 34.73 0.75 Allowed 'General case' 0 CA--C 1.537 0.446 0 C-N-CA 124.449 1.1 . . . . 10.04 111.718 -176.375 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER 100.93 118.71 0.01 OUTLIER 'General case' 0 C--O 1.219 -0.541 0 C-N-CA 130.266 3.426 . . . . 5.78 107.177 179.548 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -68.94 -38.04 79.23 Favored 'General case' 0 N--CA 1.466 0.366 0 C-N-CA 122.584 0.354 . . . . 6.91 111.472 -171.953 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 7.6 mp -68.19 143.99 55.13 Favored 'General case' 0 C--O 1.226 -0.132 0 N-CA-C 107.835 -1.172 . . . . 3.06 107.835 174.484 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 13.8 p -75.55 24.7 0.05 OUTLIER 'Isoleucine or valine' 0 CA--C 1.555 1.158 0 C-N-CA 123.44 0.696 . . . . 2.82 112.214 -178.612 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 10.9 t -68.69 140.03 55.42 Favored 'General case' 0 CA--C 1.535 0.385 0 O-C-N 120.25 -1.531 . . . . 3.48 108.751 -178.743 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 57.4 t30 50.87 60.7 3.69 Favored 'General case' 0 CA--C 1.531 0.216 0 C-N-CA 125.243 1.417 . . . . 5.92 113.27 179.484 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 73.8 m -125.9 171.7 10.51 Favored 'General case' 0 N--CA 1.455 -0.213 0 C-N-CA 122.992 0.517 . . . . 3.97 110.116 178.389 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 66.89 -73.39 0.08 Allowed 'General case' 0 C--O 1.225 -0.193 0 C-N-CA 125.768 1.627 . . . . 7.38 111.363 -173.32 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 12.2 tptt -72.43 -23.42 61.07 Favored 'General case' 0 C--O 1.223 -0.29 0 CA-C-N 118.643 0.656 . . . . 7.23 112.014 -178.867 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER 59.76 55.52 3.91 Favored 'General case' 0 CA--C 1.534 0.346 0 C-N-CA 123.369 0.668 . . . . 6.1 111.886 168.543 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . 0.309 0.1 OUTLIER 83.05 80.13 0.02 OUTLIER 'Isoleucine or valine' 0 CA--C 1.539 0.539 0 C-N-CA 127.103 2.161 . . . . 4.33 110.147 173.735 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 28.8 t0 -157.36 -66.39 0.1 Allowed 'General case' 0 N--CA 1.464 0.249 0 O-C-N 121.016 -1.053 . . . . 2.29 109.057 -173.972 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 8.2 mm -52.13 -54.17 15.3 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.413 0 C-N-CA 125.404 1.482 . . . . 1.82 109.5 177.966 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 36.5 t80 -64.0 -24.8 67.85 Favored 'General case' 0 N--CA 1.453 -0.305 0 O-C-N 121.346 -0.847 . . . . 0.61 113.206 178.372 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . 0.459 ' CA ' ' HE2' ' A' ' 49' ' ' LYS . 1.0 OUTLIER -66.77 -53.66 30.78 Favored 'General case' 0 N--CA 1.456 -0.168 0 C-N-CA 118.186 -1.406 . . . . 2.16 109.304 -178.85 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -84.49 -59.78 2.27 Favored 'General case' 0 N--CA 1.451 -0.385 0 N-CA-C 108.734 -0.839 . . . . 2.68 108.734 -172.812 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . 0.475 ' OE2' ' HE2' ' A' ' 91' ' ' LYS . 18.1 mm-40 -71.15 -31.24 67.45 Favored 'General case' 0 C--O 1.235 0.306 0 O-C-N 122.058 -0.401 . . . . 2.31 110.268 -170.44 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . 0.433 ' HA2' ' CD1' ' A' ' 66' ' ' PHE . . . -68.08 40.52 0.26 Allowed Glycine 0 CA--C 1.528 0.864 0 C-N-CA 126.644 2.069 . . . . 0.38 114.464 171.318 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 9.3 p -156.61 34.83 0.31 Allowed 'General case' 0 N--CA 1.449 -0.504 0 O-C-N 120.806 -1.409 . . . . 2.25 109.901 155.725 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 35.9 t-20 -135.6 -46.83 0.68 Allowed 'General case' 0 CA--C 1.521 -0.147 0 O-C-N 122.174 -0.329 . . . . 2.41 111.722 -169.74 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 17.8 mt -55.85 -40.47 72.91 Favored 'General case' 0 CA--C 1.53 0.18 0 CA-C-O 120.825 0.345 . . . . 1.9 111.196 -178.873 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 2.8 t 178.07 173.76 0.6 Allowed 'General case' 0 CA--C 1.533 0.301 0 C-N-CA 125.67 1.588 . . . . 1.63 107.766 -174.483 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 9.6 p -61.75 -36.29 80.59 Favored 'General case' 0 N--CA 1.456 -0.173 0 C-N-CA 123.499 0.72 . . . . 3.21 109.959 170.307 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -62.16 -14.4 36.94 Favored 'General case' 0 CA--C 1.537 0.446 0 N-CA-C 112.332 0.493 . . . . 1.82 112.332 174.342 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -87.12 -13.25 66.52 Favored Glycine 0 N--CA 1.446 -0.693 0 CA-C-O 118.802 -0.999 . . . . 0.39 111.603 177.649 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 71.5 ttt-85 -101.94 -17.7 16.01 Favored 'General case' 0 N--CA 1.461 0.077 0 CA-C-N 119.23 1.515 . . . . 3.06 112.252 176.985 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 1.4 p -60.01 -170.01 0.01 OUTLIER 'General case' 0 CA--C 1.538 0.489 0 C-N-CA 123.064 0.546 . . . . 1.87 110.529 168.736 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 83.6 m-20 -48.89 148.28 2.32 Favored 'General case' 0 N--CA 1.464 0.227 0 O-C-N 121.428 -0.795 . . . . 2.96 110.529 -174.751 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -60.34 -31.23 70.11 Favored 'General case' 0 C--O 1.224 -0.273 0 C-N-CA 120.526 -0.47 . . . . 2.93 110.7 -174.056 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -54.64 -38.35 66.76 Favored 'General case' 0 N--CA 1.453 -0.297 0 N-CA-C 113.013 0.745 . . . . 1.5 113.013 173.675 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 1.6 mt-10 -74.56 -44.79 49.3 Favored 'General case' 0 CA--C 1.505 -0.784 0 CA-C-O 118.622 -0.704 . . . . 2.22 110.148 178.569 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 66' ' ' PHE . . . . . 0.433 ' CD1' ' HA2' ' A' ' 52' ' ' GLY . 49.1 t80 -50.22 -47.33 54.93 Favored 'General case' 0 N--CA 1.45 -0.457 0 O-C-N 123.896 0.748 . . . . 0.37 111.594 174.397 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 76.8 t80 -64.75 -45.01 88.21 Favored 'General case' 0 N--CA 1.452 -0.327 0 O-C-N 121.421 -0.799 . . . . 0.46 110.355 175.605 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -64.83 -54.44 31.0 Favored 'General case' 0 CA--C 1.537 0.456 0 O-C-N 121.446 -0.784 . . . . 1.76 112.619 -172.023 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -55.1 -36.62 65.88 Favored 'General case' 0 N--CA 1.456 -0.126 0 C-N-CA 124.207 1.003 . . . . 3.59 111.071 169.534 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -53.18 -52.12 59.87 Favored 'General case' 0 C--O 1.22 -0.496 0 CA-C-N 118.913 0.779 . . . . 1.72 109.644 170.635 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 4.7 t80 -51.71 -49.81 61.73 Favored 'General case' 0 C--O 1.233 0.209 0 CA-C-N 119.764 1.165 . . . . 3.66 111.682 179.981 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 25.1 ttt180 -46.89 -58.66 3.71 Favored 'General case' 0 CA--C 1.536 0.434 0 CA-C-N 118.005 0.366 . . . . 2.55 110.341 172.389 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -67.31 -33.24 74.85 Favored 'General case' 0 C--N 1.329 -0.293 0 C-N-CA 123.607 0.763 . . . . 1.85 110.565 -170.317 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -61.5 -39.74 92.08 Favored 'General case' 0 CA--C 1.52 -0.199 0 C-N-CA 124.853 1.261 . . . . 7.51 109.939 -178.865 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 14.1 p80 -88.45 -33.29 17.9 Favored 'General case' 0 N--CA 1.453 -0.294 0 CA-C-O 116.702 -1.618 . . . . 1.09 110.991 -177.458 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 17.5 m -14.45 116.62 0.02 OUTLIER 'General case' 0 C--N 1.345 0.403 0 C-N-CA 128.561 2.744 . . . . 2.32 113.537 -167.204 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 7.7 p -45.29 -44.37 11.38 Favored 'General case' 0 N--CA 1.452 -0.365 0 C-N-CA 126.172 1.789 . . . . 2.32 110.017 -179.657 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 11.0 t0 -70.68 108.2 4.29 Favored 'General case' 0 N--CA 1.447 -0.624 0 CA-C-O 121.822 0.82 . . . . 2.03 109.614 168.054 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 57.8 m80 -52.27 -32.68 38.35 Favored 'General case' 0 N--CA 1.456 -0.155 0 CA-C-N 115.936 -0.574 . . . . 7.32 111.519 174.676 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -61.64 -51.19 69.49 Favored 'General case' 0 N--CA 1.449 -0.478 0 CA-C-O 118.325 -0.845 . . . . 1.62 110.37 177.935 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 1.9 mt-10 -47.26 -40.92 17.63 Favored 'General case' 0 N--CA 1.464 0.264 0 CA-C-N 119.331 0.969 . . . . 3.03 110.419 178.049 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -62.91 -52.57 62.53 Favored 'General case' 0 CA--C 1.515 -0.386 0 C-N-CA 120.108 -0.637 . . . . 4.25 110.145 178.581 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -61.98 -24.59 67.11 Favored 'General case' 0 N--CA 1.453 -0.319 0 CA-C-O 117.49 -1.243 . . . . 1.83 112.677 177.491 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 1.1 mptm? -61.29 -42.46 98.69 Favored 'General case' 0 C--O 1.225 -0.232 0 CA-C-N 121.166 1.803 . . . . 1.88 107.567 172.517 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 93.0 t -69.26 -55.36 15.62 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.473 0 CA-C-O 118.21 -0.9 . . . . 1.86 112.308 176.19 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -50.8 -41.38 57.16 Favored 'General case' 0 CA--C 1.531 0.243 0 CA-C-N 120.676 1.58 . . . . 2.86 111.237 -178.013 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 34.9 tttt -62.88 -60.62 3.22 Favored 'General case' 0 N--CA 1.448 -0.54 0 C-N-CA 124.747 1.219 . . . . 2.64 110.919 175.67 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 3.0 m120 -76.7 0.34 20.78 Favored 'General case' 0 CA--C 1.53 0.187 0 C-N-CA 123.539 0.735 . . . . 1.82 112.075 -174.069 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -158.33 68.58 3.68 Favored Pre-proline 0 N--CA 1.448 -0.53 0 C-N-CA 124.443 1.097 . . . . 1.36 108.7 -171.434 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 89.2 Cg_endo -80.3 56.64 6.15 Favored 'Trans proline' 0 CA--C 1.536 0.58 0 C-N-CA 124.378 3.386 . . . . 2.0 110.568 -173.3 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 91' ' ' LYS . . . . . 0.475 ' HE2' ' OE2' ' A' ' 51' ' ' GLU . 0.0 OUTLIER 176.18 -53.76 0.01 OUTLIER 'General case' 0 C--O 1.227 -0.127 0 C-N-CA 126.681 1.992 . . . . 3.43 109.669 -168.626 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 2.7 m -55.19 -46.51 75.84 Favored 'General case' 0 CA--C 1.518 -0.272 0 CA-C-N 118.855 0.752 . . . . 1.68 110.486 179.138 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 3.0 t80 -57.76 -49.02 77.97 Favored 'General case' 0 CA--C 1.506 -0.72 0 N-CA-C 109.677 -0.49 . . . . 3.73 109.677 178.246 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 3.8 tt0 -53.92 -33.78 57.67 Favored 'General case' 0 N--CA 1.443 -0.789 0 O-C-N 124.072 0.857 . . . . 2.77 110.694 -177.631 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 4.6 t80 -60.56 -56.25 23.56 Favored 'General case' 0 CA--C 1.529 0.173 0 C-N-CA 123.355 0.662 . . . . 1.12 109.945 -175.865 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 2.3 mp -61.67 -41.28 89.79 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.293 0 N-CA-C 108.853 -0.795 . . . . 2.14 108.853 176.817 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 11.7 t30 -58.7 -36.34 74.08 Favored 'General case' 0 CA--C 1.533 0.304 0 C-N-CA 123.143 0.577 . . . . 2.38 110.953 -175.896 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -62.76 -44.59 95.8 Favored 'General case' 0 CA--C 1.529 0.171 0 C-N-CA 126.588 1.955 . . . . 2.73 109.128 175.865 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 23.3 mm-40 -86.23 78.84 9.26 Favored 'General case' 0 N--CA 1.453 -0.276 0 O-C-N 121.079 -1.013 . . . . 4.2 110.507 174.12 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 1.9 tt -77.33 51.61 0.06 OUTLIER 'Isoleucine or valine' 0 CA--C 1.541 0.599 0 C-N-CA 123.828 0.851 . . . . 5.62 111.165 171.594 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 32.9 ttmt -159.51 157.49 30.09 Favored 'General case' 0 N--CA 1.457 -0.124 0 O-C-N 120.454 -1.404 . . . . 9.3 107.442 174.671 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 102' ' ' PHE . . . . . . . . . . . . . 38.6 p90 -151.65 -178.35 6.66 Favored 'General case' 0 C--N 1.33 -0.26 0 N-CA-C 108.711 -0.848 . . . . 9.4 108.711 -175.63 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 18.2 tt -61.29 141.45 17.44 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.308 0 C-N-CA 122.605 0.362 . . . . 6.11 110.121 179.632 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 104' ' ' ILE . . . . . . . . . . . . . 8.4 pt -72.24 165.64 2.88 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.305 0 O-C-N 121.78 -0.575 . . . . 7.72 110.089 175.836 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 96.8 m-20 61.33 100.81 0.03 OUTLIER 'General case' 0 N--CA 1.463 0.211 0 C-N-CA 126.388 1.875 . . . . 8.81 111.572 -176.321 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 19.0 p . . . . . 0 C--O 1.247 0.939 0 N-CA-C 106.963 -1.495 . . . . 9.01 106.963 -178.223 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.47 0.928 0 N-CA-C 107.697 -2.161 . . . . 16.72 107.697 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 2.1 m -153.09 -179.73 7.95 Favored 'General case' 0 N--CA 1.451 -0.383 0 N-CA-C 108.38 -0.97 . . . . 16.67 108.38 -165.089 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 32.6 ttpt -139.03 -80.31 0.32 Allowed 'General case' 0 N--CA 1.454 -0.231 0 N-CA-C 109.127 -0.694 . . . . 24.37 109.127 175.509 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -109.01 94.14 0.82 Allowed Glycine 0 C--N 1.332 0.351 0 N-CA-C 108.655 -1.778 . . . . 15.51 108.655 175.025 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 27.1 m -123.94 -152.1 0.12 Allowed 'Isoleucine or valine' 0 N--CA 1.438 -1.03 0 N-CA-C 107.57 -1.27 . . . . 12.79 107.57 172.635 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 17.4 mt-10 -107.26 97.93 7.63 Favored 'General case' 0 N--CA 1.449 -0.508 0 CA-C-O 122.133 0.968 . . . . 8.41 111.397 -177.598 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 1.4 mm? -84.33 40.74 0.79 Allowed 'General case' 0 N--CA 1.449 -0.499 0 CA-C-N 115.325 -0.852 . . . . 11.94 110.703 -178.028 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 7.6 mtm-85 -131.97 -92.49 0.39 Allowed 'General case' 0 N--CA 1.438 -1.052 0 C-N-CA 127.023 2.129 . . . . 8.5 105.41 178.6 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 8.1 m120 -65.72 -44.71 85.22 Favored 'General case' 0 CA--C 1.515 -0.391 0 N-CA-C 113.657 0.984 . . . . 4.51 113.657 -175.328 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 6.8 t70 -63.36 -44.56 94.46 Favored 'General case' 0 C--O 1.224 -0.279 0 CA-C-N 119.006 0.821 . . . . 2.49 109.394 179.706 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 58.5 m -60.03 -54.92 40.27 Favored 'General case' 0 CA--C 1.532 0.254 0 O-C-N 121.291 -0.881 . . . . 2.19 113.245 177.287 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 34.2 mt-10 -59.46 -40.65 87.57 Favored 'General case' 0 C--N 1.329 -0.3 0 C-N-CA 126.415 1.886 . . . . 3.81 109.451 -177.127 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -55.73 -56.7 22.46 Favored Glycine 0 CA--C 1.528 0.886 0 N-CA-C 110.644 -0.983 . . . . 1.12 110.644 170.256 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -52.44 -55.49 21.53 Favored 'General case' 0 C--N 1.333 -0.151 0 C-N-CA 124.477 1.111 . . . . 4.92 110.82 -175.034 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 1.1 pt -70.67 -27.14 29.85 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.283 0 O-C-N 121.613 -0.679 . . . . 2.11 112.479 -178.322 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 1.1 t-160 -58.31 -57.76 11.48 Favored 'General case' 0 CA--C 1.529 0.163 0 N-CA-C 105.894 -1.891 . . . . 0.77 105.894 174.015 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 43.5 mt-10 -55.4 -43.35 75.14 Favored 'General case' 0 N--CA 1.456 -0.158 0 C-N-CA 123.967 0.907 . . . . 2.47 110.663 -178.859 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 16.1 t80 -53.53 -51.49 62.67 Favored 'General case' 0 N--CA 1.455 -0.176 0 C-N-CA 123.493 0.717 . . . . 3.35 110.533 177.273 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -48.64 -43.56 29.02 Favored Glycine 0 CA--C 1.525 0.676 0 N-CA-C 111.347 -0.701 . . . . 0.75 111.347 174.889 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 2.3 t-160 -61.18 -48.94 79.22 Favored 'General case' 0 N--CA 1.45 -0.466 0 O-C-N 121.967 -0.726 . . . . 2.58 111.047 178.299 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -58.63 -32.41 69.01 Favored 'General case' 0 N--CA 1.454 -0.232 0 CA-C-N 118.279 0.49 . . . . 2.15 110.346 177.802 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 41.4 t -67.6 -33.83 64.46 Favored 'Isoleucine or valine' 0 N--CA 1.46 0.059 0 O-C-N 121.256 -0.902 . . . . 2.13 111.537 179.13 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 12.1 t0 -57.19 -32.4 66.43 Favored 'General case' 0 CA--C 1.533 0.295 0 CA-C-O 122.082 0.944 . . . . 1.96 110.688 174.309 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 7.4 t0 -66.98 -51.31 56.64 Favored 'General case' 0 N--CA 1.454 -0.273 0 CA-C-O 122.555 1.169 . . . . 2.04 108.243 -177.864 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 1.2 t80 -52.78 -42.97 65.53 Favored 'General case' 0 N--CA 1.457 -0.125 0 CA-C-N 114.945 -1.025 . . . . 4.75 110.743 174.52 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -61.14 -33.23 73.07 Favored 'General case' 0 N--CA 1.449 -0.485 0 CA-C-O 118.693 -0.67 . . . . 2.03 111.377 -179.878 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -72.72 -32.65 61.21 Favored Glycine 0 CA--C 1.523 0.565 0 CA-C-N 118.929 0.786 . . . . 1.65 111.759 177.342 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -72.56 -44.07 62.6 Favored 'General case' 0 N--CA 1.453 -0.304 0 O-C-N 121.667 -0.902 . . . . 3.56 110.611 -179.312 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 2.0 mm? -83.84 -34.93 24.55 Favored 'General case' 0 N--CA 1.45 -0.434 0 C-N-CA 124.081 0.953 . . . . 3.53 112.807 -174.861 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 1.9 mt -125.38 165.9 17.55 Favored 'General case' 0 N--CA 1.449 -0.518 0 N-CA-C 107.973 -1.121 . . . . 3.54 107.973 -170.164 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 1.6 t70 68.48 162.07 0.2 Allowed 'General case' 0 CA--C 1.534 0.365 0 C-N-CA 123.803 0.841 . . . . 4.77 109.484 -163.745 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 1.4 tptm -128.79 -7.79 5.03 Favored 'General case' 0 C--N 1.331 -0.219 0 O-C-N 120.947 -1.096 . . . . 9.64 110.993 179.798 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 36.0 t-20 -85.35 166.17 16.66 Favored 'General case' 0 N--CA 1.446 -0.66 0 N-CA-C 108.028 -1.101 . . . . 7.0 108.028 177.31 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -65.73 -6.9 13.01 Favored 'General case' 0 CA--C 1.537 0.48 0 N-CA-C 112.802 0.667 . . . . 7.17 112.802 173.757 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 12.1 m -72.12 88.19 1.1 Allowed 'General case' 0 N--CA 1.448 -0.566 0 C-N-CA 123.596 0.758 . . . . 6.19 110.549 176.124 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 10.5 m-20 -62.99 168.94 3.62 Favored 'General case' 0 CA--C 1.533 0.326 0 C-N-CA 122.742 0.417 . . . . 6.88 110.113 166.651 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 7.1 mp 68.74 106.26 0.05 Allowed 'General case' 0 CA--C 1.531 0.233 0 C-N-CA 127.527 2.331 . . . . 3.16 110.8 -172.2 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 53.9 t -87.11 76.43 1.32 Allowed 'Isoleucine or valine' 0 N--CA 1.455 -0.222 0 CA-C-O 123.108 1.432 . . . . 4.22 108.181 178.781 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -113.91 116.04 28.65 Favored 'General case' 0 N--CA 1.442 -0.871 0 N-CA-C 107.158 -1.423 . . . . 4.44 107.158 -177.482 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 61.0 m-80 41.72 51.17 4.01 Favored 'General case' 0 N--CA 1.467 0.386 0 C-N-CA 125.061 1.344 . . . . 8.18 114.488 -178.863 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 22.4 t -62.58 -74.13 0.1 Allowed 'General case' 0 CA--C 1.539 0.529 0 C-N-CA 122.856 0.462 . . . . 3.26 110.737 177.061 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -53.13 -54.75 31.1 Favored 'General case' 0 N--CA 1.472 0.626 0 O-C-N 120.741 -1.224 . . . . 8.04 112.92 -171.83 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -72.0 -19.91 61.79 Favored 'General case' 0 C--O 1.223 -0.34 0 CA-C-O 118.706 -0.664 . . . . 8.01 112.063 -178.671 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER 63.75 85.5 0.13 Allowed 'General case' 0 N--CA 1.451 -0.382 0 C-N-CA 125.402 1.481 . . . . 6.05 112.266 170.732 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 15.5 tt 41.75 74.56 0.06 OUTLIER 'Isoleucine or valine' 0 CA--C 1.539 0.545 0 C-N-CA 125.989 1.715 . . . . 3.36 111.794 -178.832 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 19.8 t70 -134.9 -55.97 0.82 Allowed 'General case' 0 N--CA 1.465 0.319 0 C-N-CA 123.43 0.692 . . . . 2.11 110.784 -170.808 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 47' ' ' ILE . . . . . 0.435 ' CG2' ' HG1' ' A' ' 92' ' ' THR . 5.9 mm -56.53 -46.49 82.45 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.315 0 CA-C-O 122.943 1.354 . . . . 1.88 109.102 175.873 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 24.7 t80 -63.62 -23.14 67.26 Favored 'General case' 0 N--CA 1.451 -0.401 0 O-C-N 120.561 -1.337 . . . . 0.64 112.187 177.085 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . 0.436 ' HA ' ' CE ' ' A' ' 49' ' ' LYS . 0.9 OUTLIER -71.85 -48.96 42.38 Favored 'General case' 0 N--CA 1.448 -0.549 0 O-C-N 120.053 -1.655 . . . . 2.35 110.343 -179.653 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 21.8 tp10 -90.31 -55.82 3.45 Favored 'General case' 0 C--N 1.331 -0.208 0 O-C-N 123.541 0.526 . . . . 2.48 109.619 -173.04 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 33.0 mp0 -75.67 -28.43 58.7 Favored 'General case' 0 C--O 1.236 0.359 0 O-C-N 121.25 -0.906 . . . . 2.6 110.904 -176.261 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . 0.46 ' HA2' ' CD1' ' A' ' 66' ' ' PHE . . . -70.92 45.72 0.71 Allowed Glycine 0 CA--C 1.531 1.055 0 C-N-CA 125.805 1.669 . . . . 0.38 114.843 169.935 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 46.8 t -162.66 46.13 0.14 Allowed 'General case' 0 N--CA 1.449 -0.476 0 N-CA-C 107.182 -1.414 . . . . 2.82 107.182 157.636 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 4.8 t-20 -147.45 -50.85 0.19 Allowed 'General case' 0 CA--C 1.519 -0.243 0 N-CA-C 111.746 0.276 . . . . 2.33 111.746 -170.116 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 28.0 mt -59.97 -37.07 78.55 Favored 'General case' 0 N--CA 1.462 0.14 0 CA-C-O 120.885 0.374 . . . . 1.61 111.048 -176.907 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -178.0 170.52 1.85 Allowed 'General case' 0 C--N 1.33 -0.277 0 N-CA-C 107.81 -1.181 . . . . 1.54 107.81 -175.982 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 11.6 t -63.02 -35.23 79.52 Favored 'General case' 0 CA--C 1.533 0.312 0 C-N-CA 123.195 0.598 . . . . 2.18 109.713 170.184 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -67.1 -9.52 40.43 Favored 'General case' 0 N--CA 1.466 0.342 0 O-C-N 121.737 -0.602 . . . . 1.67 112.237 172.811 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -85.58 -5.08 84.94 Favored Glycine 0 C--O 1.22 -0.745 0 CA-C-O 118.797 -1.002 . . . . 0.57 111.287 173.195 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -114.11 -16.66 12.07 Favored 'General case' 0 C--N 1.334 -0.07 0 CA-C-N 119.291 1.546 . . . . 3.74 112.239 -175.583 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 24.1 p -64.45 -149.72 0.01 OUTLIER 'General case' 0 CA--C 1.54 0.565 0 C-N-CA 125.629 1.571 . . . . 1.85 109.881 176.299 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 15.9 m120 -58.3 143.8 43.48 Favored 'General case' 0 N--CA 1.455 -0.184 0 O-C-N 119.298 -2.126 . . . . 2.96 109.212 177.307 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 66.3 tt0 -56.55 -29.03 61.5 Favored 'General case' 0 CA--C 1.534 0.335 0 CA-C-O 121.785 0.802 . . . . 3.11 111.466 -178.52 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -60.23 -39.82 88.03 Favored 'General case' 0 N--CA 1.449 -0.49 0 C-N-CA 123.349 0.659 . . . . 2.09 112.224 175.126 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 9.6 mt-10 -70.91 -42.0 70.52 Favored 'General case' 0 N--CA 1.451 -0.384 0 O-C-N 121.365 -0.834 . . . . 2.37 110.757 176.443 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 66' ' ' PHE . . . . . 0.46 ' CD1' ' HA2' ' A' ' 52' ' ' GLY . 49.8 t80 -49.98 -52.5 33.32 Favored 'General case' 0 N--CA 1.454 -0.23 0 C-N-CA 122.858 0.463 . . . . 0.58 110.861 174.753 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 75.9 t80 -60.92 -41.81 96.88 Favored 'General case' 0 CA--C 1.534 0.346 0 C-N-CA 122.508 0.323 . . . . 0.86 110.827 177.716 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -63.95 -45.67 88.14 Favored 'General case' 0 CA--C 1.54 0.577 0 O-C-N 121.209 -0.932 . . . . 1.84 111.838 -176.109 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 18.8 mm-40 -58.42 -43.9 88.84 Favored 'General case' 0 CA--C 1.521 -0.143 0 C-N-CA 124.447 1.099 . . . . 4.28 110.187 171.38 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -52.07 -54.5 29.54 Favored 'General case' 0 N--CA 1.454 -0.257 0 N-CA-C 108.359 -0.978 . . . . 1.65 108.359 178.021 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 39.4 t80 -50.45 -51.13 49.58 Favored 'General case' 0 N--CA 1.456 -0.173 0 C-N-CA 123.551 0.74 . . . . 3.19 111.986 179.616 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 13.6 ttt180 -47.55 -57.93 4.84 Favored 'General case' 0 CA--C 1.534 0.354 0 CA-C-N 118.62 0.646 . . . . 2.71 110.094 176.154 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -67.4 -24.47 65.67 Favored 'General case' 0 C--O 1.222 -0.355 0 C-N-CA 125.132 1.373 . . . . 1.95 110.984 -172.505 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 33.4 mmt -57.0 -45.72 82.8 Favored 'General case' 0 N--CA 1.468 0.437 0 CA-C-N 119.041 0.837 . . . . 6.64 111.486 178.409 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 6.6 p80 -95.94 -29.36 14.21 Favored 'General case' 0 C--N 1.334 -0.102 0 CA-C-O 116.388 -1.768 . . . . 3.38 113.556 -175.589 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 81.3 p -13.18 117.08 0.02 OUTLIER 'General case' 0 C--N 1.344 0.337 0 C-N-CA 127.87 2.468 . . . . 3.16 113.672 -173.047 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 1.9 p -44.93 -42.39 8.07 Favored 'General case' 0 C--N 1.33 -0.276 0 C-N-CA 125.173 1.389 . . . . 2.06 110.87 176.994 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 11.1 t0 -66.98 103.03 1.06 Allowed 'General case' 0 N--CA 1.452 -0.374 0 N-CA-C 108.857 -0.794 . . . . 2.32 108.857 166.206 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 4.6 t-80 -59.87 -23.05 63.11 Favored 'General case' 0 CA--C 1.531 0.237 0 O-C-N 121.522 -0.736 . . . . 7.27 111.679 179.896 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -66.09 -46.17 78.63 Favored 'General case' 0 N--CA 1.451 -0.41 0 CA-C-O 118.525 -0.75 . . . . 1.55 110.918 176.493 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 1.1 mt-10 -47.77 -38.85 16.46 Favored 'General case' 0 N--CA 1.465 0.306 0 CA-C-N 119.025 0.829 . . . . 3.25 109.908 177.655 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 11.3 mtp180 -62.19 -54.54 39.52 Favored 'General case' 0 CA--C 1.517 -0.32 0 N-CA-C 108.822 -0.807 . . . . 3.56 108.822 -178.439 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 1.5 mm? -65.36 -19.08 65.79 Favored 'General case' 0 N--CA 1.451 -0.409 0 CA-C-O 118.095 -0.955 . . . . 1.61 112.726 178.2 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 24.3 mttt -68.73 -43.6 75.59 Favored 'General case' 0 CA--C 1.517 -0.302 0 CA-C-N 120.885 1.675 . . . . 2.42 108.317 172.351 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 92.8 t -61.23 -62.34 1.16 Allowed 'Isoleucine or valine' 0 C--O 1.217 -0.633 0 CA-C-O 118.413 -0.803 . . . . 1.69 109.893 171.584 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -50.09 -46.13 53.27 Favored 'General case' 0 C--O 1.224 -0.249 0 CA-C-N 120.213 1.37 . . . . 2.88 112.082 -175.084 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 41.7 tttt -58.91 -53.37 59.18 Favored 'General case' 0 N--CA 1.448 -0.529 0 O-C-N 121.459 -0.776 . . . . 2.88 110.879 177.299 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 64.4 m-20 -79.82 -7.15 58.52 Favored 'General case' 0 C--N 1.33 -0.258 0 C-N-CA 122.386 0.274 . . . . 1.4 111.486 -174.449 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -164.88 62.94 0.96 Allowed Pre-proline 0 N--CA 1.447 -0.576 0 C-N-CA 124.558 1.143 . . . . 1.87 109.624 -163.709 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 20.8 Cg_endo -57.6 -41.13 74.4 Favored 'Trans proline' 0 N--CA 1.454 -0.813 0 C-N-CA 122.54 2.16 . . . . 2.58 109.884 -173.123 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 1.2 ptpt -74.29 -43.13 58.11 Favored 'General case' 0 N--CA 1.453 -0.325 0 C-N-CA 126.584 1.954 . . . . 3.19 113.222 -178.789 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 92' ' ' THR . . . . . 0.435 ' HG1' ' CG2' ' A' ' 47' ' ' ILE . 3.7 m -59.04 -45.74 89.99 Favored 'General case' 0 CA--C 1.517 -0.296 0 CA-C-N 119.924 1.238 . . . . 1.75 110.048 179.967 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 2.5 t80 -59.27 -46.39 88.65 Favored 'General case' 0 CA--C 1.512 -0.502 0 C-N-CA 120.123 -0.631 . . . . 3.03 110.162 175.577 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 2.8 tt0 -52.36 -32.72 39.75 Favored 'General case' 0 N--CA 1.448 -0.552 0 CA-C-N 115.532 -0.758 . . . . 1.99 111.066 179.942 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 2.3 t80 -58.15 -62.56 1.74 Allowed 'General case' 0 N--CA 1.456 -0.166 0 C-N-CA 124.091 0.956 . . . . 1.47 110.191 -178.269 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 3.5 mp -63.05 -36.08 74.35 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.286 0 N-CA-C 109.218 -0.66 . . . . 2.0 109.218 -179.762 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 7.3 t-20 -57.96 -39.0 77.05 Favored 'General case' 0 CA--C 1.536 0.426 0 CA-C-N 117.953 0.342 . . . . 3.14 110.743 -179.486 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 6.9 t0 -57.88 -38.16 75.25 Favored 'General case' 0 N--CA 1.463 0.197 0 C-N-CA 125.225 1.41 . . . . 2.19 110.141 177.327 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 28.5 mm100 -78.87 70.51 5.22 Favored 'General case' 0 N--CA 1.448 -0.567 0 CA-C-O 121.684 0.754 . . . . 3.39 109.436 179.245 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 2.3 tp -67.84 162.09 3.58 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.434 0 N-CA-C 108.884 -0.784 . . . . 6.26 108.884 -179.655 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 17.9 mmtp 52.62 81.59 0.08 Allowed 'General case' 0 C--N 1.339 0.147 0 CA-C-O 121.99 0.9 . . . . 10.05 109.674 -167.56 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 102' ' ' PHE . . . . . . . . . . . . . 70.5 m-85 -50.05 155.42 0.94 Allowed 'General case' 0 N--CA 1.451 -0.376 0 CA-C-N 114.449 -1.25 . . . . 12.4 110.194 171.195 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 6.7 tp -55.2 129.41 16.49 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.515 0 N-CA-C 109.461 -0.57 . . . . 4.38 109.461 -174.703 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 104' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -63.53 155.7 5.49 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.489 0 N-CA-C 108.905 -0.776 . . . . 7.1 108.905 177.826 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 2.5 m-20 67.59 89.53 0.1 Allowed 'General case' 0 CA--C 1.528 0.104 0 C-N-CA 126.043 1.737 . . . . 7.33 110.968 -177.232 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 8.4 m . . . . . 0 C--O 1.252 1.223 0 CA-C-O 116.692 -1.623 . . . . 9.65 109.971 164.912 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . 0.435 ' N ' ' OE2' ' A' ' 17' ' ' GLU . . . . . . . . 0 N--CA 1.47 0.906 0 N-CA-C 108.868 -1.693 . . . . 13.51 108.868 . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 2.0 m -50.54 152.76 1.82 Allowed 'General case' 0 N--CA 1.455 -0.193 0 CA-C-N 117.711 0.756 . . . . 14.68 110.866 173.12 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -141.68 150.19 41.57 Favored 'General case' 0 N--CA 1.454 -0.252 0 N-CA-C 108.155 -1.054 . . . . 17.38 108.155 175.712 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 159.69 -159.68 30.81 Favored Glycine 0 N--CA 1.45 -0.415 0 N-CA-C 108.291 -1.924 . . . . 16.34 108.291 -174.801 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -67.38 -175.69 0.12 Allowed 'Isoleucine or valine' 0 N--CA 1.454 -0.265 0 CA-C-O 120.943 0.401 . . . . 17.11 111.151 173.99 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 4.6 pt-20 -82.35 117.51 22.47 Favored 'General case' 0 N--CA 1.444 -0.729 0 CA-C-O 122.85 1.309 . . . . 11.72 111.297 173.612 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -154.2 53.34 0.68 Allowed 'General case' 0 N--CA 1.442 -0.86 0 C-N-CA 125.997 1.719 . . . . 11.18 107.284 174.49 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 16.3 mmm180 64.48 36.64 8.63 Favored 'General case' 0 CA--C 1.531 0.216 0 C-N-CA 123.216 0.607 . . . . 8.07 111.134 179.31 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 7.3 m-20 -50.82 -36.04 35.31 Favored 'General case' 0 N--CA 1.468 0.461 0 CA-C-N 118.612 0.642 . . . . 3.33 112.492 -178.974 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 8.0 t70 -61.57 -55.09 34.63 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 120.979 0.419 . . . . 2.27 110.825 175.083 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 7.7 t -65.07 -48.78 72.55 Favored 'General case' 0 N--CA 1.454 -0.225 0 C-N-CA 123.126 0.571 . . . . 2.53 109.972 -171.907 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . 0.4 ' HA ' ' CD1' ' A' ' 15' ' ' ILE . 8.5 pt-20 -80.59 -23.34 39.92 Favored 'General case' 0 N--CA 1.453 -0.29 0 CA-C-O 121.172 0.511 . . . . 3.82 110.09 -177.25 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -61.16 -45.81 95.79 Favored Glycine 0 N--CA 1.448 -0.514 0 N-CA-C 109.202 -1.559 . . . . 1.21 109.202 172.198 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 2.9 t80 -59.06 -52.53 65.33 Favored 'General case' 0 N--CA 1.454 -0.273 0 CA-C-N 117.659 0.73 . . . . 4.03 110.699 -176.673 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . 0.4 ' CD1' ' HA ' ' A' ' 12' ' ' GLU . 0.7 OUTLIER -67.26 -36.31 76.36 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.499 0 O-C-N 121.229 -0.919 . . . . 1.81 112.184 -178.859 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 3.0 t60 -57.34 -53.7 55.1 Favored 'General case' 0 CA--C 1.531 0.213 0 N-CA-C 107.228 -1.397 . . . . 1.05 107.228 176.383 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . 0.435 ' OE2' ' N ' ' A' ' 1' ' ' GLY . 45.8 mt-10 -64.99 -32.21 73.82 Favored 'General case' 0 N--CA 1.449 -0.487 0 C-N-CA 125.105 1.362 . . . . 2.36 111.131 -175.333 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 1.1 m-85 -54.39 -53.84 48.66 Favored 'General case' 0 CA--C 1.517 -0.318 0 CA-C-N 119.56 1.073 . . . . 4.42 110.129 167.762 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -49.76 -47.91 37.65 Favored Glycine 0 CA--C 1.526 0.742 0 N-CA-C 110.825 -0.91 . . . . 0.72 110.825 176.857 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 2.5 t60 -62.28 -43.7 98.21 Favored 'General case' 0 N--CA 1.447 -0.592 0 O-C-N 122.058 -0.672 . . . . 2.77 112.017 -178.661 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -61.84 -32.28 72.6 Favored 'General case' 0 N--CA 1.451 -0.394 0 N-CA-C 109.224 -0.658 . . . . 1.86 109.224 -178.863 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 84.8 t -71.46 -40.83 72.75 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.164 0 C-N-CA 119.314 -0.954 . . . . 2.04 111.086 176.967 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 15.1 t0 -58.76 -30.54 67.6 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 121.807 0.813 . . . . 1.97 110.981 172.182 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 10.4 t70 -67.68 -49.6 61.97 Favored 'General case' 0 N--CA 1.455 -0.195 0 N-CA-C 107.556 -1.275 . . . . 2.52 107.556 -173.712 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 16.4 t80 -56.92 -46.61 81.88 Favored 'General case' 0 N--CA 1.453 -0.301 0 CA-C-N 115.677 -0.692 . . . . 4.22 110.361 174.048 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -57.51 -33.87 68.5 Favored 'General case' 0 N--CA 1.452 -0.367 0 CA-C-O 118.686 -0.673 . . . . 2.18 111.288 178.11 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -89.42 -13.63 61.27 Favored Glycine 0 CA--C 1.526 0.769 0 CA-C-N 119.028 0.831 . . . . 2.17 112.908 -176.791 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 16.0 t80 -82.69 -49.61 9.6 Favored 'General case' 0 N--CA 1.453 -0.303 0 CA-C-N 118.263 1.031 . . . . 5.09 108.915 173.665 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -78.3 -38.86 41.41 Favored 'General case' 0 CA--C 1.516 -0.341 0 C-N-CA 124.173 0.989 . . . . 3.03 111.716 -176.755 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 3.4 mt -119.42 166.89 12.49 Favored 'General case' 0 N--CA 1.447 -0.611 0 N-CA-C 106.491 -1.67 . . . . 3.06 106.491 -176.935 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 1.3 t0 70.35 117.61 0.04 OUTLIER 'General case' 0 CA--C 1.536 0.417 0 C-N-CA 124.2 1.0 . . . . 5.4 110.339 -177.658 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -118.02 156.73 28.07 Favored 'General case' 0 CA--C 1.518 -0.272 0 O-C-N 120.426 -1.421 . . . . 9.78 107.728 -172.74 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 3.2 t30 63.31 111.7 0.02 OUTLIER 'General case' 0 N--CA 1.451 -0.397 0 C-N-CA 127.371 2.268 . . . . 7.07 109.388 -163.596 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 20.5 tt0 59.59 51.02 6.72 Favored 'General case' 0 CA--C 1.535 0.397 0 C-N-CA 123.528 0.731 . . . . 9.42 109.974 -173.11 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 9.6 p -61.45 99.69 0.11 Allowed 'General case' 0 N--CA 1.454 -0.24 0 C-N-CA 125.07 1.348 . . . . 8.36 108.715 175.721 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 20.6 t70 -147.35 -51.82 0.2 Allowed 'General case' 0 C--N 1.33 -0.242 0 C-N-CA 124.748 1.219 . . . . 6.25 108.975 -171.572 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 12.6 mt -141.46 153.05 44.75 Favored 'General case' 0 C--N 1.339 0.15 0 C-N-CA 125.56 1.544 . . . . 4.41 107.872 -177.933 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 6.4 p -88.63 36.46 0.07 OUTLIER 'Isoleucine or valine' 0 N--CA 1.472 0.65 0 CA-C-N 119.822 1.192 . . . . 3.06 111.801 -173.771 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 9.0 t -78.1 12.1 1.99 Allowed 'General case' 0 CA--C 1.543 0.682 0 O-C-N 120.679 -1.263 . . . . 4.06 112.314 -170.237 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 44.6 m-20 -135.13 46.03 2.45 Favored 'General case' 0 N--CA 1.464 0.232 0 CA-C-N 120.64 1.564 . . . . 7.45 110.592 178.371 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 5.2 t -150.91 -166.89 2.66 Favored 'General case' 0 C--O 1.233 0.199 0 O-C-N 120.452 -1.405 . . . . 3.94 110.942 175.661 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 3.7 mmpt? 67.21 -64.14 0.26 Allowed 'General case' 0 N--CA 1.467 0.401 0 C-N-CA 128.246 2.618 . . . . 6.96 113.015 177.319 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -138.95 14.12 2.66 Favored 'General case' 0 C--O 1.222 -0.378 0 C-N-CA 126.452 1.901 . . . . 7.95 110.921 179.412 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 1.6 t80 60.29 71.4 0.57 Allowed 'General case' 0 CA--C 1.533 0.318 0 C-N-CA 124.484 1.114 . . . . 5.94 110.57 177.161 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 18.8 tt 36.16 71.68 0.05 OUTLIER 'Isoleucine or valine' 0 CA--C 1.536 0.416 0 C-N-CA 126.584 1.954 . . . . 3.66 112.32 177.934 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 30.3 t70 -120.34 -48.83 2.29 Favored 'General case' 0 N--CA 1.465 0.289 0 CA-C-O 122.057 0.932 . . . . 2.38 110.232 -172.297 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 3.4 mm -52.06 -51.2 31.62 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.19 0 C-N-CA 124.739 1.216 . . . . 1.78 109.932 175.948 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 25.7 t80 -61.29 -32.74 72.58 Favored 'General case' 0 C--O 1.224 -0.268 0 O-C-N 121.781 -0.575 . . . . 1.03 111.895 175.88 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . 0.444 ' HA ' ' HE2' ' A' ' 49' ' ' LYS . 7.6 mmpt? -67.74 -44.05 78.48 Favored 'General case' 0 N--CA 1.451 -0.403 0 O-C-N 120.544 -1.347 . . . . 2.47 110.728 -176.668 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 18.5 mm-40 -82.31 -64.67 1.13 Allowed 'General case' 0 CA--C 1.532 0.274 0 CA-C-O 122.294 1.045 . . . . 3.35 109.749 -179.738 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 21.1 mm-40 -74.18 -28.28 61.21 Favored 'General case' 0 C--O 1.235 0.338 0 C-N-CA 123.281 0.632 . . . . 2.22 110.829 -169.084 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . 0.42 ' HA2' ' CD1' ' A' ' 66' ' ' PHE . . . -71.46 38.21 0.58 Allowed Glycine 0 CA--C 1.533 1.165 0 C-N-CA 124.295 0.95 . . . . 0.41 113.287 170.184 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -148.61 33.16 0.78 Allowed 'General case' 0 N--CA 1.451 -0.414 0 C-N-CA 124.518 1.127 . . . . 2.96 108.75 163.195 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 11.3 t-20 -144.37 -43.27 0.25 Allowed 'General case' 0 C--N 1.339 0.14 0 N-CA-C 112.331 0.493 . . . . 2.44 112.331 -169.402 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 18.6 mt -62.64 -36.5 83.0 Favored 'General case' 0 N--CA 1.462 0.133 0 O-C-N 121.753 -0.592 . . . . 1.61 111.239 -176.347 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER 175.06 169.84 0.29 Allowed 'General case' 0 CA--C 1.531 0.23 0 C-N-CA 125.989 1.716 . . . . 1.61 107.48 -177.338 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 14.5 m -61.13 -36.46 79.81 Favored 'General case' 0 N--CA 1.455 -0.2 0 C-N-CA 123.092 0.557 . . . . 1.41 110.557 169.497 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 1.6 m-85 -68.08 -9.23 44.57 Favored 'General case' 0 N--CA 1.466 0.34 0 O-C-N 121.927 -0.483 . . . . 3.07 112.182 173.473 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -90.25 2.41 81.15 Favored Glycine 0 N--CA 1.443 -0.845 0 CA-C-O 118.828 -0.985 . . . . 0.47 111.06 173.54 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 3.2 tmt_? -125.91 -13.79 6.26 Favored 'General case' 0 C--O 1.226 -0.136 0 CA-C-N 119.157 1.479 . . . . 3.15 112.925 -176.888 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 3.6 p -59.67 -104.09 0.0 OUTLIER 'General case' 0 C--N 1.333 -0.148 0 C-N-CA 126.656 1.982 . . . . 1.88 110.583 177.175 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 4.5 t30 -93.53 152.23 19.19 Favored 'General case' 0 N--CA 1.45 -0.462 0 N-CA-C 107.681 -1.229 . . . . 2.64 107.681 175.594 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 1.6 tm-20 -58.58 -35.72 72.85 Favored 'General case' 0 CA--C 1.532 0.271 0 CA-C-O 121.422 0.629 . . . . 3.48 109.737 176.205 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -61.43 -31.64 71.58 Favored 'General case' 0 N--CA 1.453 -0.298 0 N-CA-C 113.785 1.032 . . . . 1.71 113.785 176.315 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 10.0 mt-10 -76.47 -41.16 48.19 Favored 'General case' 0 CA--C 1.513 -0.446 0 O-C-N 121.546 -0.721 . . . . 2.25 109.534 176.548 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 66' ' ' PHE . . . . . 0.42 ' CD1' ' HA2' ' A' ' 52' ' ' GLY . 49.4 t80 -53.34 -51.63 61.82 Favored 'General case' 0 N--CA 1.451 -0.394 0 C-N-CA 123.027 0.531 . . . . 0.45 111.251 173.804 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 71.2 t80 -64.94 -49.8 68.95 Favored 'General case' 0 N--CA 1.45 -0.468 0 C-N-CA 122.768 0.427 . . . . 0.55 110.425 -178.283 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -60.11 -47.52 85.54 Favored 'General case' 0 CA--C 1.54 0.581 0 O-C-N 121.607 -0.683 . . . . 1.79 112.274 -177.347 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 6.2 mm-40 -59.68 -41.54 90.9 Favored 'General case' 0 C--N 1.332 -0.167 0 C-N-CA 124.425 1.09 . . . . 4.43 110.468 172.823 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -58.28 -41.84 85.23 Favored 'General case' 0 N--CA 1.453 -0.301 0 O-C-N 121.413 -0.804 . . . . 1.48 109.373 179.67 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -54.59 -52.37 62.35 Favored 'General case' 0 C--O 1.232 0.149 0 C-N-CA 124.678 1.191 . . . . 4.47 111.488 172.016 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 7.6 ttt180 -48.58 -61.35 2.07 Favored 'General case' 0 CA--C 1.529 0.173 0 N-CA-C 109.432 -0.581 . . . . 3.25 109.432 177.151 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -61.06 -28.04 68.78 Favored 'General case' 0 C--N 1.327 -0.411 0 C-N-CA 125.127 1.371 . . . . 1.54 111.233 -176.18 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER -62.64 -40.71 97.87 Favored 'General case' 0 C--O 1.234 0.255 0 CA-C-N 118.745 0.702 . . . . 3.24 110.744 -179.273 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 15.4 p80 -95.96 -20.48 18.7 Favored 'General case' 0 C--O 1.228 -0.067 0 CA-C-O 116.628 -1.653 . . . . 1.22 113.259 -179.109 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 33.2 m -31.92 115.22 0.16 Allowed 'General case' 0 C--O 1.221 -0.425 0 C-N-CA 125.776 1.63 . . . . 1.79 111.823 -172.085 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 1.2 p -45.83 -39.58 8.66 Favored 'General case' 0 C--N 1.329 -0.291 0 C-N-CA 125.908 1.683 . . . . 1.99 110.994 -177.367 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 12.6 t0 -63.48 104.87 0.68 Allowed 'General case' 0 N--CA 1.449 -0.514 0 CA-C-O 121.912 0.863 . . . . 2.48 109.872 167.402 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 9.1 m-70 -52.07 -33.87 41.06 Favored 'General case' 0 N--CA 1.457 -0.118 0 CA-C-O 118.596 -0.716 . . . . 6.11 111.613 175.438 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -59.06 -54.11 50.72 Favored 'General case' 0 N--CA 1.448 -0.534 0 CA-C-O 118.04 -0.981 . . . . 2.16 109.957 178.988 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 4.4 mt-10 -42.73 -46.31 5.07 Favored 'General case' 0 CA--C 1.516 -0.352 0 C-N-CA 124.593 1.157 . . . . 2.71 111.055 178.561 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 12.4 mtp-105 -64.24 -51.2 64.79 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.162 -0.927 . . . . 4.42 109.423 -176.532 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 1.2 mm? -66.39 -18.88 65.62 Favored 'General case' 0 N--CA 1.451 -0.39 0 CA-C-O 117.674 -1.155 . . . . 1.85 113.054 176.708 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -67.37 -44.19 79.56 Favored 'General case' 0 C--O 1.221 -0.445 0 CA-C-N 121.377 1.899 . . . . 3.05 107.106 168.893 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 93.8 t -63.95 -46.08 95.05 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.564 0 CA-C-O 117.559 -1.21 . . . . 1.49 111.556 177.069 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 7.2 mt-30 -63.03 -49.62 73.9 Favored 'General case' 0 N--CA 1.463 0.217 0 CA-C-N 121.864 2.12 . . . . 2.34 111.737 178.636 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 44.9 tttt -57.83 -52.26 66.19 Favored 'General case' 0 N--CA 1.449 -0.497 0 O-C-N 121.769 -0.582 . . . . 3.01 110.325 -176.523 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 8.0 m-20 -67.22 -33.3 75.07 Favored 'General case' 0 N--CA 1.453 -0.315 0 C-N-CA 123.704 0.802 . . . . 1.52 110.394 -179.147 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -136.04 84.24 31.54 Favored Pre-proline 0 C--O 1.236 0.373 0 C-N-CA 125.984 1.714 . . . . 1.36 110.233 -173.728 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 97.4 Cg_endo -81.48 48.78 2.98 Favored 'Trans proline' 0 CA--C 1.538 0.683 0 C-N-CA 123.567 2.845 . . . . 1.64 111.333 -175.791 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 2.3 ptmt -168.5 -53.55 0.02 OUTLIER 'General case' 0 N--CA 1.454 -0.231 0 C-N-CA 125.813 1.645 . . . . 3.08 110.173 -174.025 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 6.6 m -51.21 -46.6 62.27 Favored 'General case' 0 N--CA 1.464 0.274 0 CA-C-N 118.874 0.761 . . . . 1.83 111.674 179.404 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 7.6 t80 -57.47 -47.07 82.85 Favored 'General case' 0 CA--C 1.511 -0.544 0 CA-C-O 121.486 0.66 . . . . 3.03 111.149 178.678 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 12.6 tt0 -61.06 -31.1 70.77 Favored 'General case' 0 N--CA 1.441 -0.889 0 CA-C-N 115.052 -0.976 . . . . 2.32 110.185 -179.41 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -60.69 -60.21 4.16 Favored 'General case' 0 N--CA 1.46 0.047 0 C-N-CA 123.663 0.785 . . . . 1.43 109.09 -176.64 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 3.0 mp -53.81 -44.21 59.09 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.302 0 N-CA-C 108.783 -0.821 . . . . 1.91 108.783 175.964 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 52.6 t30 -60.34 -37.58 81.07 Favored 'General case' 0 CA--C 1.535 0.401 0 C-N-CA 120.336 -0.546 . . . . 1.94 112.137 -177.306 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -67.81 -42.55 81.37 Favored 'General case' 0 CA--C 1.533 0.317 0 C-N-CA 126.878 2.071 . . . . 3.15 108.946 -179.999 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 25.4 mm-40 -78.0 87.68 4.16 Favored 'General case' 0 N--CA 1.457 -0.1 0 O-C-N 120.866 -1.147 . . . . 3.53 109.656 170.702 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 2.0 tp -40.63 122.8 0.34 Allowed 'Isoleucine or valine' 0 CA--C 1.535 0.382 0 C-N-CA 124.168 0.987 . . . . 5.43 109.556 174.173 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.92 80.77 0.47 Allowed 'General case' 0 C--O 1.226 -0.153 0 C-N-CA 123.973 0.909 . . . . 10.11 109.542 -174.132 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 102' ' ' PHE . . . . . . . . . . . . . 0.8 OUTLIER -143.65 117.19 9.16 Favored 'General case' 0 N--CA 1.447 -0.583 0 N-CA-C 107.398 -1.334 . . . . 7.12 107.398 -172.198 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 19.1 tt -132.9 -38.77 0.51 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.233 0 C-N-CA 123.975 0.91 . . . . 5.18 110.773 -176.996 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 104' ' ' ILE . . . . . . . . . . . . . 6.6 tp -131.88 -57.73 0.83 Allowed 'Isoleucine or valine' 0 N--CA 1.453 -0.315 0 N-CA-C 108.021 -1.103 . . . . 7.12 108.021 177.235 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 59.3 t30 -154.13 173.17 16.43 Favored 'General case' 0 C--O 1.235 0.315 0 N-CA-C 107.535 -1.283 . . . . 8.51 107.535 174.386 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 20.3 t . . . . . 0 C--O 1.25 1.093 0 CA-C-O 115.739 -2.077 . . . . 10.63 108.285 155.326 . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . 0.428 ' N ' ' OE2' ' A' ' 17' ' ' GLU . . . . . . . . 0 N--CA 1.473 1.157 0 N-CA-C 110.496 -1.042 . . . . 11.94 110.496 . . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -128.66 -44.97 1.33 Allowed 'General case' 0 C--O 1.223 -0.307 0 CA-C-N 117.399 0.599 . . . . 11.52 110.785 -148.785 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 58.18 -153.99 0.37 Allowed 'General case' 0 CA--C 1.538 0.509 0 CA-C-O 117.976 -1.011 . . . . 16.4 108.929 -171.722 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -107.08 -116.41 4.11 Favored Glycine 0 C--N 1.337 0.621 0 CA-C-N 119.469 1.032 . . . . 11.71 110.716 -166.168 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 19.7 m -77.59 -167.68 0.08 OUTLIER 'Isoleucine or valine' 0 N--CA 1.447 -0.62 0 N-CA-C 109.381 -0.6 . . . . 12.18 109.381 175.146 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 2.4 pm0 -76.7 112.48 13.32 Favored 'General case' 0 N--CA 1.443 -0.813 0 CA-C-O 122.767 1.27 . . . . 9.16 112.168 176.979 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -147.88 43.85 1.07 Allowed 'General case' 0 N--CA 1.451 -0.402 0 C-N-CA 124.243 1.017 . . . . 8.02 110.033 175.35 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 42.3 mtp180 72.25 -61.57 0.49 Allowed 'General case' 0 N--CA 1.468 0.456 0 C-N-CA 126.61 1.964 . . . . 9.82 111.829 -179.251 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -50.82 -36.03 35.25 Favored 'General case' 0 CA--C 1.514 -0.426 0 C-N-CA 126.1 1.76 . . . . 4.94 113.578 177.912 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -55.68 -59.78 4.37 Favored 'General case' 0 C--N 1.323 -0.546 0 C-N-CA 123.614 0.766 . . . . 3.83 109.828 170.217 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 6.9 m -63.92 -49.05 74.17 Favored 'General case' 0 N--CA 1.449 -0.522 0 CA-C-O 121.901 0.858 . . . . 2.38 109.801 -168.83 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 6.7 pt-20 -66.22 -34.91 79.09 Favored 'General case' 0 N--CA 1.45 -0.453 0 CA-C-N 115.477 -0.783 . . . . 3.99 109.579 179.459 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -59.07 -45.91 94.55 Favored Glycine 0 CA--C 1.528 0.893 0 N-CA-C 111.526 -0.63 . . . . 1.22 111.526 172.779 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -59.84 -57.88 10.98 Favored 'General case' 0 N--CA 1.451 -0.407 0 C-N-CA 125.144 1.378 . . . . 5.11 108.441 -173.758 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 0.6 OUTLIER -69.41 -24.88 28.01 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.306 0 CA-C-N 115.815 -0.63 . . . . 2.09 112.317 179.631 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 16' ' ' HIS . . . . . 0.417 ' HD1' ' CD ' ' A' ' 69' ' ' GLU . 1.0 OUTLIER -59.41 -54.14 50.13 Favored 'General case' 0 N--CA 1.455 -0.215 0 N-CA-C 106.753 -1.573 . . . . 0.71 106.753 175.28 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . 0.428 ' OE2' ' N ' ' A' ' 1' ' ' GLY . 2.6 mt-10 -59.45 -35.56 74.27 Favored 'General case' 0 CA--C 1.516 -0.348 0 CA-C-O 118.254 -0.879 . . . . 3.58 111.189 179.22 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 10.0 t80 -52.43 -47.47 66.35 Favored 'General case' 0 C--N 1.333 -0.146 0 CA-C-N 119.001 0.819 . . . . 4.68 110.815 173.984 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -49.75 -48.8 36.03 Favored Glycine 0 CA--C 1.525 0.658 0 N-CA-C 111.478 -0.649 . . . . 0.45 111.478 172.148 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 1.8 t-160 -63.01 -41.74 99.64 Favored 'General case' 0 N--CA 1.454 -0.274 0 O-C-N 121.66 -0.906 . . . . 2.72 111.663 -178.504 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -62.14 -32.98 73.64 Favored 'General case' 0 N--CA 1.449 -0.482 0 N-CA-C 109.684 -0.487 . . . . 1.6 109.684 178.817 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 93.9 t -67.44 -40.35 84.38 Favored 'Isoleucine or valine' 0 C--O 1.233 0.209 0 C-N-CA 119.611 -0.836 . . . . 1.74 110.121 175.112 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -62.08 -20.02 63.57 Favored 'General case' 0 CA--C 1.527 0.088 0 CA-C-O 119.46 -0.305 . . . . 2.2 111.292 176.145 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 17.6 t70 -63.92 -57.27 10.3 Favored 'General case' 0 N--CA 1.454 -0.241 0 N-CA-C 109.076 -0.713 . . . . 2.91 109.076 -179.377 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 63.7 t80 -54.94 -52.48 62.85 Favored 'General case' 0 CA--C 1.521 -0.168 0 C-N-CA 123.196 0.598 . . . . 4.85 110.217 178.844 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -58.92 -34.69 72.01 Favored 'General case' 0 N--CA 1.45 -0.47 0 C-N-CA 120.364 -0.534 . . . . 1.85 111.282 -177.721 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -69.21 -46.97 55.62 Favored Glycine 0 C--O 1.224 -0.509 0 N-CA-C 110.359 -1.096 . . . . 1.1 110.359 178.209 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -54.67 -48.22 72.64 Favored 'General case' 0 N--CA 1.454 -0.254 0 C-N-CA 125.084 1.353 . . . . 3.05 110.029 -176.993 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 3.2 mm? -76.14 -41.03 51.26 Favored 'General case' 0 N--CA 1.445 -0.678 0 C-N-CA 123.847 0.859 . . . . 2.67 111.871 -178.423 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 11.2 mt -112.42 52.12 0.79 Allowed 'General case' 0 N--CA 1.454 -0.247 0 N-CA-C 107.713 -1.217 . . . . 3.12 107.713 -170.955 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 24.5 t0 -72.43 149.27 44.39 Favored 'General case' 0 CA--C 1.53 0.21 0 CA-C-N 115.525 -0.762 . . . . 6.49 110.983 -165.98 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 2.1 pttt -162.63 -43.25 0.04 OUTLIER 'General case' 0 N--CA 1.455 -0.204 0 C-N-CA 124.962 1.305 . . . . 13.51 111.113 -173.718 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 54.8 t-20 -113.89 110.56 20.3 Favored 'General case' 0 N--CA 1.45 -0.438 0 N-CA-C 108.091 -1.077 . . . . 9.75 108.091 -166.582 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 3.1 mt-30 -61.03 -11.62 8.91 Favored 'General case' 0 CA--C 1.534 0.336 0 N-CA-C 113.83 1.048 . . . . 8.34 113.83 -174.554 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 18.7 t -138.11 30.85 2.44 Favored 'General case' 0 N--CA 1.454 -0.23 0 CA-C-N 119.454 1.025 . . . . 8.42 110.806 177.697 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 5.2 t0 -150.73 -168.39 3.09 Favored 'General case' 0 CA--C 1.533 0.312 0 N-CA-C 107.465 -1.309 . . . . 8.06 107.465 167.763 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 3.3 mm? -117.96 -157.07 0.66 Allowed 'General case' 0 CA--C 1.536 0.415 0 N-CA-C 108.228 -1.027 . . . . 3.89 108.228 -175.91 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 14.0 p -57.1 -40.41 72.92 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.275 0 O-C-N 121.076 -1.015 . . . . 2.39 109.879 177.594 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 39' ' ' THR . . . . . . . . . . . . 0.264 1.0 OUTLIER 27.03 84.41 0.01 OUTLIER 'General case' 0 CA--C 1.55 0.979 0 C-N-CA 126.271 1.828 . . . . 3.61 113.218 175.697 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 76.0 m-20 53.86 27.74 7.57 Favored 'General case' 0 CA--C 1.537 0.472 0 C-N-CA 127.255 2.222 . . . . 8.49 116.581 174.983 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 58.1 m -36.19 -56.36 0.76 Allowed 'General case' 0 N--CA 1.47 0.539 0 N-CA-C 116.056 1.872 . . . . 3.53 116.056 -178.155 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . 0.423 ' O ' ' HE2' ' A' ' 42' ' ' LYS . 1.2 tmtt? -57.0 -32.64 66.33 Favored 'General case' 0 N--CA 1.465 0.288 0 CA-C-N 119.264 0.938 . . . . 7.82 112.181 -172.054 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 2.1 ttmp? -124.28 63.99 1.08 Allowed 'General case' 0 N--CA 1.453 -0.296 0 N-CA-C 106.388 -1.708 . . . . 8.04 106.388 172.6 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 37.6 p90 -46.32 114.07 0.74 Allowed 'General case' 0 N--CA 1.448 -0.527 0 C-N-CA 125.697 1.599 . . . . 6.64 110.067 -176.608 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . 0.269 0.1 OUTLIER 60.66 73.09 0.1 OUTLIER 'Isoleucine or valine' 0 CA--C 1.542 0.636 0 CA-C-O 123.107 1.432 . . . . 3.82 110.709 173.37 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 10.0 t0 -156.89 -60.73 0.09 Allowed 'General case' 0 N--CA 1.465 0.278 0 O-C-N 120.109 -1.62 . . . . 2.19 109.608 -179.083 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 9.4 mm -51.4 -51.8 22.82 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.481 0 C-N-CA 125.711 1.604 . . . . 1.68 108.651 173.79 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 32.5 t80 -62.5 -32.4 73.3 Favored 'General case' 0 N--CA 1.45 -0.448 0 O-C-N 120.422 -1.424 . . . . 0.48 113.357 175.728 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -63.42 -50.93 67.85 Favored 'General case' 0 N--CA 1.455 -0.186 0 C-N-CA 118.209 -1.396 . . . . 2.36 110.116 -176.135 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 31.3 mt-10 -79.94 -66.59 0.86 Allowed 'General case' 0 N--CA 1.454 -0.275 0 N-CA-C 108.669 -0.863 . . . . 3.71 108.669 -178.699 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 17.1 mp0 -71.83 -28.44 63.57 Favored 'General case' 0 C--O 1.236 0.384 0 O-C-N 121.865 -0.522 . . . . 2.63 110.589 -165.808 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . 0.406 ' HA2' ' CD1' ' A' ' 66' ' ' PHE . . . -70.6 38.74 0.48 Allowed Glycine 0 CA--C 1.529 0.91 0 C-N-CA 124.874 1.226 . . . . 0.35 113.686 169.603 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 36.1 p -148.88 29.94 0.81 Allowed 'General case' 0 N--CA 1.446 -0.645 0 O-C-N 120.832 -1.393 . . . . 2.5 109.983 158.328 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 2.7 t-20 -141.04 -42.1 0.39 Allowed 'General case' 0 CA--C 1.52 -0.199 0 N-CA-C 113.005 0.743 . . . . 2.78 113.005 -170.946 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 31.1 mt -59.18 -38.05 78.89 Favored 'General case' 0 N--CA 1.463 0.199 0 CA-C-O 120.874 0.369 . . . . 1.84 111.2 -175.66 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -179.12 171.1 1.38 Allowed 'General case' 0 CA--C 1.533 0.312 0 C-N-CA 125.356 1.462 . . . . 1.77 107.35 -179.585 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 13.3 m -61.63 -36.41 80.69 Favored 'General case' 0 CA--C 1.53 0.209 0 O-C-N 121.648 -0.657 . . . . 1.28 110.506 169.413 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -69.13 -4.31 16.87 Favored 'General case' 0 CA--C 1.533 0.321 0 N-CA-C 112.346 0.499 . . . . 2.05 112.346 172.82 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -91.87 -7.88 64.02 Favored Glycine 0 N--CA 1.444 -0.817 0 CA-C-O 118.66 -1.078 . . . . 0.62 111.071 173.632 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 4.1 tmt_? -111.8 -12.86 13.77 Favored 'General case' 0 C--N 1.338 0.082 0 CA-C-N 119.095 1.447 . . . . 3.62 112.162 -178.656 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 17.6 p -64.57 -161.09 0.01 OUTLIER 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 124.372 1.069 . . . . 1.94 109.542 168.439 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 85.8 m-20 -51.87 147.51 6.88 Favored 'General case' 0 C--N 1.34 0.165 0 O-C-N 120.699 -1.251 . . . . 2.06 111.162 -176.651 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 28.6 tt0 -60.74 -25.0 66.15 Favored 'General case' 0 CA--C 1.536 0.415 0 CA-C-O 121.775 0.798 . . . . 3.32 111.094 -175.829 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -58.39 -47.16 84.77 Favored 'General case' 0 N--CA 1.452 -0.374 0 C-N-CA 124.823 1.249 . . . . 1.54 112.829 169.86 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 12.3 mt-10 -69.48 -42.52 74.7 Favored 'General case' 0 CA--C 1.514 -0.409 0 O-C-N 121.466 -0.771 . . . . 2.08 110.258 179.148 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 66' ' ' PHE . . . . . 0.406 ' CD1' ' HA2' ' A' ' 52' ' ' GLY . 53.9 t80 -49.34 -52.54 27.37 Favored 'General case' 0 N--CA 1.453 -0.297 0 C-N-CA 123.288 0.635 . . . . 0.39 110.814 174.462 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 75.8 t80 -59.78 -43.65 94.3 Favored 'General case' 0 N--CA 1.451 -0.415 0 C-N-CA 122.581 0.352 . . . . 0.46 110.842 177.55 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -62.27 -45.62 92.46 Favored 'General case' 0 CA--C 1.54 0.572 0 O-C-N 121.404 -0.81 . . . . 1.61 111.762 -176.404 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . 0.417 ' CD ' ' HD1' ' A' ' 16' ' ' HIS . 15.2 mm-40 -59.93 -43.43 94.95 Favored 'General case' 0 CA--C 1.521 -0.141 0 C-N-CA 123.505 0.722 . . . . 4.13 109.651 173.318 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -55.77 -43.51 76.81 Favored 'General case' 0 N--CA 1.451 -0.412 0 N-CA-C 109.791 -0.448 . . . . 1.59 109.791 -179.705 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 7.2 t80 -61.28 -50.4 73.16 Favored 'General case' 0 CA--C 1.531 0.232 0 C-N-CA 123.065 0.546 . . . . 3.72 111.578 178.332 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 17.2 ttt180 -46.76 -59.36 3.1 Favored 'General case' 0 N--CA 1.468 0.426 0 C-N-CA 124.225 1.01 . . . . 2.88 109.789 175.251 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -65.16 -27.78 68.95 Favored 'General case' 0 N--CA 1.451 -0.412 0 C-N-CA 124.729 1.212 . . . . 2.04 110.748 -175.351 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 2.0 ttp -58.43 -39.93 81.12 Favored 'General case' 0 C--O 1.234 0.272 0 CA-C-O 121.306 0.574 . . . . 3.47 111.552 -178.052 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 15.1 p80 -94.46 -42.96 8.58 Favored 'General case' 0 C--O 1.223 -0.31 0 CA-C-O 116.063 -1.923 . . . . 2.74 112.561 178.283 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 53.6 p 3.56 112.58 0.0 OUTLIER 'General case' 0 N--CA 1.472 0.643 0 C-N-CA 128.617 2.767 . . . . 3.22 114.602 -171.288 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 2.3 p -41.05 -44.43 2.43 Favored 'General case' 0 N--CA 1.455 -0.209 0 C-N-CA 125.703 1.601 . . . . 2.22 111.678 178.677 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 57.1 t0 -76.56 106.31 8.13 Favored 'General case' 0 N--CA 1.452 -0.349 0 C-N-CA 117.072 -1.851 . . . . 2.11 108.649 166.886 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 5.3 p-80 -42.44 -35.63 1.09 Allowed 'General case' 0 N--CA 1.454 -0.258 0 C-N-CA 124.474 1.11 . . . . 5.64 112.758 171.415 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -56.61 -47.88 78.67 Favored 'General case' 0 N--CA 1.449 -0.485 0 C-N-CA 123.149 0.58 . . . . 1.83 110.415 -178.955 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -54.37 -34.36 61.02 Favored 'General case' 0 CA--C 1.515 -0.374 0 C-N-CA 122.489 0.316 . . . . 3.75 111.343 -179.286 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 3.5 mtp-105 -63.28 -51.97 63.96 Favored 'General case' 0 N--CA 1.447 -0.588 0 N-CA-C 108.642 -0.873 . . . . 4.62 108.642 177.937 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 2.4 mm? -61.42 -25.81 67.45 Favored 'General case' 0 N--CA 1.453 -0.315 0 CA-C-O 118.092 -0.956 . . . . 1.95 112.276 177.908 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 2.4 mptm? -62.53 -46.0 90.42 Favored 'General case' 0 CA--C 1.52 -0.19 0 CA-C-N 120.37 1.441 . . . . 2.41 108.504 173.681 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 86.3 t -62.66 -63.75 0.77 Allowed 'Isoleucine or valine' 0 C--O 1.217 -0.652 0 CA-C-O 118.356 -0.831 . . . . 1.53 109.795 174.712 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -47.82 -51.01 24.28 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 119.53 1.059 . . . . 2.3 111.514 -171.869 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 13.5 pttp -66.06 -40.08 90.63 Favored 'General case' 0 CA--C 1.532 0.276 0 O-C-N 121.991 -0.443 . . . . 5.03 110.722 -177.24 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 55.1 m-20 -82.07 -7.43 59.61 Favored 'General case' 0 CA--C 1.534 0.351 0 CA-C-N 118.178 0.445 . . . . 1.43 111.244 -179.776 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -158.57 74.51 3.65 Favored Pre-proline 0 N--CA 1.448 -0.553 0 C-N-CA 125.477 1.511 . . . . 1.27 108.907 -170.326 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 67.8 Cg_endo -81.6 44.17 1.68 Allowed 'Trans proline' 0 CA--C 1.537 0.641 0 C-N-CA 124.234 3.289 . . . . 1.59 111.254 -174.947 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -160.95 -56.31 0.05 Allowed 'General case' 0 N--CA 1.451 -0.382 0 C-N-CA 125.636 1.574 . . . . 3.38 108.66 -176.1 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 2.5 m -49.22 -48.6 45.35 Favored 'General case' 0 N--CA 1.464 0.256 0 C-N-CA 123.822 0.849 . . . . 1.47 111.359 176.603 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 6.5 t80 -59.55 -51.19 70.89 Favored 'General case' 0 CA--C 1.509 -0.61 0 CA-C-O 121.348 0.594 . . . . 3.18 110.561 -179.301 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 32.2 tt0 -59.93 -28.19 67.41 Favored 'General case' 0 N--CA 1.442 -0.847 0 CA-C-N 114.928 -1.033 . . . . 2.18 110.207 -178.315 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 8.4 t80 -65.35 -56.93 9.87 Favored 'General case' 0 N--CA 1.452 -0.333 0 C-N-CA 124.068 0.947 . . . . 1.91 109.423 -175.136 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 3.4 mp -59.06 -41.51 83.65 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.161 0 N-CA-C 108.924 -0.769 . . . . 2.14 108.924 174.832 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -60.13 -30.44 69.29 Favored 'General case' 0 CA--C 1.536 0.419 0 CA-C-N 118.03 0.377 . . . . 2.34 111.208 -178.85 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 10.3 t70 -70.69 -45.02 65.78 Favored 'General case' 0 CA--C 1.522 -0.102 0 C-N-CA 123.771 0.828 . . . . 2.34 109.302 177.104 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 54.0 mm-40 -63.13 -56.29 18.07 Favored 'General case' 0 N--CA 1.451 -0.405 0 CA-C-N 115.861 -0.609 . . . . 3.56 111.088 -176.501 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -74.36 87.54 0.58 Allowed 'Isoleucine or valine' 0 CA--C 1.532 0.256 0 CA-C-O 121.924 0.869 . . . . 6.04 110.455 -175.997 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 2.8 mmpt? -115.47 -63.29 1.48 Allowed 'General case' 0 CA--C 1.52 -0.206 0 C-N-CA 123.897 0.879 . . . . 11.47 108.659 176.13 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 102' ' ' PHE . . . . . . . . . . . . . 26.3 m-85 -141.81 121.29 13.25 Favored 'General case' 0 N--CA 1.45 -0.462 0 N-CA-C 106.257 -1.757 . . . . 9.82 106.257 172.41 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -133.87 -50.83 0.62 Allowed 'Isoleucine or valine' 0 N--CA 1.455 -0.212 0 N-CA-C 108.011 -1.107 . . . . 6.24 108.011 174.328 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 104' ' ' ILE . . . . . . . . . . . . . 9.5 tt -145.59 179.6 1.09 Allowed 'Isoleucine or valine' 0 N--CA 1.452 -0.337 0 N-CA-C 106.543 -1.651 . . . . 7.15 106.543 169.618 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 49.9 t30 -137.39 139.71 40.91 Favored 'General case' 0 N--CA 1.455 -0.223 0 N-CA-C 107.994 -1.113 . . . . 12.18 107.994 178.462 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 49.3 m . . . . . 0 C--O 1.249 1.056 0 CA-C-O 116.975 -1.488 . . . . 10.58 110.384 -159.147 . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.47 0.958 0 N-CA-C 107.16 -2.376 . . . . 19.13 107.16 . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 14.8 m 61.44 170.5 0.11 Allowed 'General case' 0 CA--C 1.536 0.441 0 O-C-N 124.393 0.702 . . . . 19.41 110.563 -160.315 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 17.4 ptpt -155.4 158.57 38.85 Favored 'General case' 0 N--CA 1.458 -0.071 0 N-CA-C 108.082 -1.081 . . . . 28.32 108.082 174.436 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 161.19 162.88 13.23 Favored Glycine 0 N--CA 1.451 -0.313 0 N-CA-C 109.44 -1.464 . . . . 18.61 109.44 176.581 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -74.96 -176.94 0.26 Allowed 'Isoleucine or valine' 0 N--CA 1.445 -0.697 0 CA-C-O 121.184 0.516 . . . . 18.33 110.392 164.564 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 7.8 pt-20 -108.85 109.69 20.85 Favored 'General case' 0 N--CA 1.44 -0.928 0 C-N-CA 123.865 0.866 . . . . 12.7 110.331 -170.832 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -150.21 26.18 0.79 Allowed 'General case' 0 N--CA 1.454 -0.271 0 C-N-CA 125.881 1.672 . . . . 11.69 110.974 -175.658 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 41.0 mtp180 -150.35 119.07 6.56 Favored 'General case' 0 N--CA 1.452 -0.352 0 N-CA-C 107.857 -1.164 . . . . 12.58 107.857 172.889 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 2.3 m120 -51.51 -33.65 32.67 Favored 'General case' 0 C--O 1.221 -0.418 0 C-N-CA 123.739 0.816 . . . . 2.97 111.65 169.875 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 7.1 t0 -57.85 -52.13 66.76 Favored 'General case' 0 N--CA 1.447 -0.601 0 C-N-CA 124.04 0.936 . . . . 2.64 110.61 175.438 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 13.4 m -69.41 -46.84 65.88 Favored 'General case' 0 CA--C 1.534 0.355 0 O-C-N 120.968 -1.082 . . . . 2.44 112.338 -179.764 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 1.9 mt-10 -62.81 -36.29 82.69 Favored 'General case' 0 N--CA 1.464 0.225 0 CA-C-O 122.175 0.988 . . . . 3.28 109.8 -179.048 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -65.42 -50.85 53.34 Favored Glycine 0 N--CA 1.449 -0.464 0 N-CA-C 109.231 -1.547 . . . . 0.87 109.231 175.215 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -48.92 -59.11 3.87 Favored 'General case' 0 C--O 1.224 -0.277 0 C-N-CA 124.527 1.131 . . . . 5.26 110.464 -179.114 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 0.5 OUTLIER -61.92 -34.67 64.03 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.348 0 O-C-N 121.709 -0.619 . . . . 1.59 111.948 -176.505 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 6.6 t60 -60.05 -55.52 32.92 Favored 'General case' 0 CA--C 1.532 0.269 0 N-CA-C 107.207 -1.405 . . . . 0.73 107.207 178.051 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 31.7 mt-10 -56.87 -38.29 72.53 Favored 'General case' 0 N--CA 1.453 -0.301 0 C-N-CA 124.152 0.981 . . . . 1.94 111.832 178.654 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 1.7 m-85 -54.94 -49.17 72.01 Favored 'General case' 0 CA--C 1.517 -0.295 0 CA-C-N 119.42 1.009 . . . . 4.39 109.661 176.165 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -50.01 -45.87 41.75 Favored Glycine 0 CA--C 1.525 0.694 0 N-CA-C 110.804 -0.918 . . . . 0.46 110.804 174.866 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 1.8 t60 -62.16 -45.6 92.69 Favored 'General case' 0 N--CA 1.451 -0.398 0 O-C-N 121.896 -0.767 . . . . 2.55 111.783 179.458 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -64.61 -28.0 69.33 Favored 'General case' 0 N--CA 1.454 -0.271 0 O-C-N 121.199 -0.938 . . . . 1.56 110.228 179.619 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 92.7 t -71.67 -37.45 63.04 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.168 0 O-C-N 120.921 -1.112 . . . . 1.79 109.682 176.242 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 8.6 t70 -56.78 -30.19 63.41 Favored 'General case' 0 C--N 1.334 -0.101 0 CA-C-O 121.179 0.514 . . . . 2.23 111.136 172.895 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 22.7 t70 -68.61 -50.17 53.56 Favored 'General case' 0 N--CA 1.452 -0.346 0 N-CA-C 108.885 -0.783 . . . . 2.13 108.885 -176.536 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 44.2 t80 -58.46 -45.28 88.91 Favored 'General case' 0 N--CA 1.455 -0.206 0 CA-C-N 116.127 -0.488 . . . . 4.24 110.507 177.665 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -57.77 -35.82 71.28 Favored 'General case' 0 N--CA 1.454 -0.245 0 CA-C-O 119.259 -0.401 . . . . 1.96 111.299 176.789 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -62.87 -61.58 6.32 Favored Glycine 0 C--N 1.333 0.376 0 N-CA-C 109.759 -1.336 . . . . 1.22 109.759 176.018 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -50.61 -50.11 54.9 Favored 'General case' 0 N--CA 1.454 -0.247 0 C-N-CA 125.015 1.326 . . . . 2.5 111.069 -174.136 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -76.53 -33.87 58.57 Favored 'General case' 0 CA--C 1.514 -0.44 0 N-CA-C 112.851 0.685 . . . . 2.14 112.851 -175.701 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 10.1 mt -112.99 33.04 5.28 Favored 'General case' 0 N--CA 1.455 -0.22 0 N-CA-C 108.861 -0.792 . . . . 2.32 108.861 -171.127 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 65.8 t0 -57.27 131.42 49.96 Favored 'General case' 0 N--CA 1.452 -0.365 0 C-N-CA 124.362 1.065 . . . . 6.26 108.857 179.511 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 5.1 ptmt -176.83 -43.88 0.01 OUTLIER 'General case' 0 CA--C 1.517 -0.295 0 C-N-CA 124.649 1.18 . . . . 9.6 109.987 -174.859 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -74.91 164.61 26.38 Favored 'General case' 0 N--CA 1.449 -0.509 0 N-CA-C 108.118 -1.067 . . . . 10.25 108.118 175.138 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 1.2 mm-40 -66.3 -27.88 68.26 Favored 'General case' 0 CA--C 1.533 0.319 0 C-N-CA 120.213 -0.595 . . . . 8.21 110.119 172.806 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 3.1 m -59.74 134.1 56.71 Favored 'General case' 0 N--CA 1.449 -0.491 0 C-N-CA 124.522 1.129 . . . . 6.93 112.061 178.165 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 38.5 t70 -67.9 -24.27 65.2 Favored 'General case' 0 CA--C 1.536 0.425 0 C-N-CA 124.9 1.28 . . . . 5.61 112.66 179.846 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 4.2 mp -117.62 175.05 5.82 Favored 'General case' 0 CA--C 1.528 0.097 0 N-CA-C 108.266 -1.013 . . . . 2.73 108.266 175.269 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 11.5 p -71.81 9.21 0.34 Allowed 'Isoleucine or valine' 0 CA--C 1.552 1.032 0 O-C-N 121.173 -0.954 . . . . 2.49 112.917 -177.036 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 10.0 t -59.53 84.59 0.01 OUTLIER 'General case' 0 CA--C 1.537 0.473 0 C-N-CA 127.971 2.508 . . . . 4.11 110.753 175.358 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER 171.2 -35.87 0.0 OUTLIER 'General case' 0 N--CA 1.463 0.22 0 C-N-CA 126.064 1.746 . . . . 6.57 111.741 174.102 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 7.6 t -68.88 174.23 4.61 Favored 'General case' 0 CA--C 1.535 0.376 0 CA-C-O 121.314 0.578 . . . . 4.31 112.291 -167.432 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 26.9 tptt 70.05 98.78 0.06 Allowed 'General case' 0 CA--C 1.53 0.21 0 C-N-CA 126.999 2.119 . . . . 7.8 108.727 -167.791 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 2.9 mmpt? 49.26 -113.43 0.61 Allowed 'General case' 0 CA--C 1.531 0.245 0 CA-C-O 117.762 -1.113 . . . . 7.92 108.269 -166.772 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -142.83 92.62 2.42 Favored 'General case' 0 N--CA 1.453 -0.285 0 CA-C-N 119.684 1.129 . . . . 5.53 108.015 176.668 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . 0.259 10.2 tt 49.69 21.18 0.09 OUTLIER 'Isoleucine or valine' 0 CA--C 1.549 0.921 0 C-N-CA 126.562 1.945 . . . . 3.67 113.552 177.103 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 6.8 m-20 -65.39 -44.62 86.93 Favored 'General case' 0 N--CA 1.463 0.177 0 O-C-N 120.557 -1.339 . . . . 3.61 111.271 -170.389 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 3.2 mm -53.13 -50.96 43.35 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.232 0 C-N-CA 124.268 1.027 . . . . 1.63 109.416 -176.259 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 24.6 t80 -64.07 -36.76 85.07 Favored 'General case' 0 N--CA 1.451 -0.378 0 O-C-N 121.614 -0.679 . . . . 0.43 111.396 177.15 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . 0.463 ' HA ' ' HE2' ' A' ' 49' ' ' LYS . 0.3 OUTLIER -60.3 -47.2 87.04 Favored 'General case' 0 C--N 1.33 -0.246 0 C-N-CA 118.791 -1.164 . . . . 2.17 111.615 -177.292 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 3.5 tp10 -86.42 -59.64 2.22 Favored 'General case' 0 CA--C 1.532 0.268 0 CA-C-O 121.871 0.843 . . . . 2.89 109.598 -176.27 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 19.2 mm-40 -73.57 -28.84 62.06 Favored 'General case' 0 CA--C 1.535 0.402 0 O-C-N 121.654 -0.654 . . . . 2.19 110.621 -170.131 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . 0.402 ' HA2' ' CD1' ' A' ' 66' ' ' PHE . . . -68.06 40.57 0.26 Allowed Glycine 0 CA--C 1.531 1.05 0 C-N-CA 126.509 2.004 . . . . 0.34 114.715 172.332 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 20.9 t -146.45 22.59 1.31 Allowed 'General case' 0 N--CA 1.45 -0.432 0 O-C-N 120.778 -1.425 . . . . 2.81 110.019 156.679 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -135.53 -23.3 1.44 Allowed 'General case' 0 C--N 1.342 0.282 0 N-CA-C 113.712 1.005 . . . . 3.64 113.712 -167.539 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 22.0 mt -71.48 -41.65 69.09 Favored 'General case' 0 C--N 1.331 -0.233 0 O-C-N 121.404 -0.81 . . . . 1.61 109.919 175.99 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 1.7 t 179.13 175.16 0.67 Allowed 'General case' 0 CA--C 1.533 0.305 0 C-N-CA 125.408 1.483 . . . . 1.54 107.939 -174.741 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 39.4 t -60.88 -36.02 78.13 Favored 'General case' 0 CA--C 1.532 0.288 0 O-C-N 121.688 -0.632 . . . . 2.6 109.781 168.888 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -65.59 -11.64 46.05 Favored 'General case' 0 N--CA 1.465 0.285 0 N-CA-C 112.468 0.544 . . . . 1.49 112.468 174.581 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -88.61 -7.17 72.2 Favored Glycine 0 C--O 1.221 -0.688 0 CA-C-O 119.124 -0.82 . . . . 0.43 111.117 176.31 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 64.1 ttt180 -113.52 -14.1 12.72 Favored 'General case' 0 N--CA 1.458 -0.07 0 CA-C-N 118.875 1.337 . . . . 4.36 112.036 -178.672 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 19.9 p -64.48 -159.03 0.01 OUTLIER 'General case' 0 CA--C 1.539 0.536 0 C-N-CA 123.408 0.683 . . . . 1.84 109.432 168.582 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 3.8 t-20 -53.05 145.85 12.35 Favored 'General case' 0 CA--C 1.53 0.196 0 O-C-N 120.403 -1.436 . . . . 1.87 110.271 -176.305 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -59.56 -31.87 69.83 Favored 'General case' 0 CA--C 1.535 0.368 0 CA-C-O 121.461 0.648 . . . . 3.36 110.663 -176.278 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -58.59 -36.19 73.6 Favored 'General case' 0 N--CA 1.453 -0.311 0 N-CA-C 112.968 0.729 . . . . 1.7 112.968 174.531 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 8.1 mt-10 -70.93 -48.57 52.79 Favored 'General case' 0 CA--C 1.511 -0.533 0 CA-C-O 118.301 -0.857 . . . . 2.22 110.261 174.599 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 66' ' ' PHE . . . . . 0.402 ' CD1' ' HA2' ' A' ' 52' ' ' GLY . 30.6 t80 -46.49 -47.05 19.42 Favored 'General case' 0 CA--C 1.533 0.305 0 C-N-CA 124.385 1.074 . . . . 0.35 111.448 175.145 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 78.9 t80 -65.33 -44.38 87.96 Favored 'General case' 0 CA--C 1.537 0.447 0 O-C-N 121.172 -0.955 . . . . 0.55 111.12 177.29 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -66.16 -51.34 58.77 Favored 'General case' 0 CA--C 1.539 0.554 0 C-N-CA 123.959 0.904 . . . . 1.45 112.668 -174.331 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -60.72 -40.06 90.92 Favored 'General case' 0 C--N 1.332 -0.186 0 O-C-N 120.858 -1.151 . . . . 3.59 110.618 172.451 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -56.18 -40.68 74.31 Favored 'General case' 0 C--O 1.222 -0.362 0 CA-C-N 118.727 0.694 . . . . 1.8 110.176 174.72 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -55.75 -49.89 71.88 Favored 'General case' 0 N--CA 1.465 0.298 0 C-N-CA 124.513 1.125 . . . . 4.72 111.833 172.137 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -50.8 -56.65 11.11 Favored 'General case' 0 CA--C 1.531 0.236 0 N-CA-C 109.222 -0.659 . . . . 5.18 109.222 176.739 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -66.4 -25.91 66.99 Favored 'General case' 0 C--N 1.327 -0.402 0 C-N-CA 124.346 1.059 . . . . 1.58 111.236 -175.511 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -63.49 -39.16 93.71 Favored 'General case' 0 C--O 1.231 0.125 0 CA-C-N 118.646 0.657 . . . . 3.09 109.912 -179.42 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 7.1 p80 -97.62 -9.72 26.4 Favored 'General case' 0 CA--C 1.531 0.246 0 CA-C-O 116.277 -1.821 . . . . 1.21 114.191 179.331 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 5.1 m -36.2 114.88 0.31 Allowed 'General case' 0 CA--C 1.512 -0.511 0 CA-C-N 120.698 1.59 . . . . 1.79 111.162 -173.303 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -51.62 -37.25 49.3 Favored 'General case' 0 N--CA 1.448 -0.568 0 CA-C-N 114.259 -1.337 . . . . 2.01 110.7 -173.67 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 53.9 t0 -73.41 107.19 5.57 Favored 'General case' 0 N--CA 1.452 -0.365 0 C-N-CA 116.95 -1.9 . . . . 2.4 109.563 164.955 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 20.9 p-80 -38.97 -38.22 0.43 Allowed 'General case' 0 N--CA 1.454 -0.234 0 C-N-CA 125.247 1.419 . . . . 5.76 112.5 169.431 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -53.89 -54.67 35.48 Favored 'General case' 0 N--CA 1.449 -0.485 0 CA-C-N 118.197 0.453 . . . . 1.32 109.789 -179.23 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -57.06 -35.88 69.86 Favored 'General case' 0 CA--C 1.514 -0.431 0 C-N-CA 122.957 0.503 . . . . 4.58 111.852 -175.238 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 22.0 mtp180 -61.97 -50.03 73.74 Favored 'General case' 0 N--CA 1.449 -0.52 0 C-N-CA 119.744 -0.783 . . . . 3.09 109.397 175.987 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 1.6 mm? -67.24 -18.54 65.27 Favored 'General case' 0 N--CA 1.456 -0.17 0 CA-C-O 118.093 -0.956 . . . . 1.79 113.41 176.743 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 2.5 mptm? -65.44 -50.47 65.27 Favored 'General case' 0 CA--C 1.517 -0.294 0 CA-C-N 120.65 1.568 . . . . 2.04 107.413 169.827 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 94.4 t -57.39 -50.17 77.81 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.528 0 CA-C-O 118.85 -0.595 . . . . 1.68 110.458 176.387 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -62.38 -52.56 63.13 Favored 'General case' 0 N--CA 1.45 -0.432 0 CA-C-N 119.472 1.033 . . . . 3.19 111.223 -173.518 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 29.5 pttt -63.58 -40.25 96.47 Favored 'General case' 0 CA--C 1.53 0.176 0 O-C-N 121.78 -0.575 . . . . 3.66 109.96 -175.531 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 50.8 m-20 -72.14 -28.47 63.28 Favored 'General case' 0 C--O 1.224 -0.249 0 C-N-CA 122.763 0.425 . . . . 1.37 110.635 -178.855 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -141.43 74.7 23.64 Favored Pre-proline 0 C--O 1.237 0.419 0 C-N-CA 125.901 1.68 . . . . 1.73 108.914 -170.559 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 85.5 Cg_endo -78.29 68.55 7.9 Favored 'Trans proline' 0 N--CA 1.457 -0.655 0 C-N-CA 123.874 3.05 . . . . 1.86 110.146 -171.307 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 1.2 ptmt 166.47 -55.23 0.0 OUTLIER 'General case' 0 C--O 1.224 -0.272 0 C-N-CA 126.432 1.893 . . . . 2.77 111.204 -167.083 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 6.0 m -56.47 -44.03 80.18 Favored 'General case' 0 CA--C 1.518 -0.265 0 CA-C-N 120.071 1.305 . . . . 1.64 110.514 -178.404 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 13.9 t80 -57.16 -48.87 77.65 Favored 'General case' 0 CA--C 1.513 -0.475 0 C-N-CA 120.073 -0.651 . . . . 3.1 110.68 175.865 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 19.3 tt0 -59.87 -28.97 67.99 Favored 'General case' 0 N--CA 1.443 -0.779 0 CA-C-N 114.93 -1.032 . . . . 1.98 110.844 -179.104 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 2.6 t80 -63.26 -57.02 11.81 Favored 'General case' 0 N--CA 1.457 -0.113 0 C-N-CA 124.258 1.023 . . . . 1.36 109.133 -176.213 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 3.3 mp -60.24 -42.69 91.35 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.302 0 N-CA-C 108.498 -0.927 . . . . 1.89 108.498 177.069 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 12.8 t-20 -56.89 -36.34 70.0 Favored 'General case' 0 CA--C 1.537 0.466 0 CA-C-N 117.836 0.289 . . . . 2.93 111.589 -177.892 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -58.79 -49.75 76.5 Favored 'General case' 0 N--CA 1.462 0.144 0 C-N-CA 125.172 1.389 . . . . 2.13 109.399 175.756 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 13.3 mm-40 -77.72 84.86 4.04 Favored 'General case' 0 N--CA 1.451 -0.392 0 CA-C-N 115.986 -0.552 . . . . 3.48 109.92 179.954 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 2.2 pp -45.26 125.92 1.25 Allowed 'Isoleucine or valine' 0 CA--C 1.535 0.374 0 C-N-CA 124.352 1.061 . . . . 6.48 111.664 -178.22 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -77.84 79.32 4.32 Favored 'General case' 0 N--CA 1.457 -0.084 0 O-C-N 121.537 -0.727 . . . . 11.82 110.077 -174.6 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 102' ' ' PHE . . . . . . . . . . . . . 9.4 t80 -142.69 99.93 3.57 Favored 'General case' 0 N--CA 1.454 -0.247 0 O-C-N 121.632 -0.667 . . . . 7.63 109.222 178.077 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 6.7 tp -147.18 28.58 0.15 Allowed 'Isoleucine or valine' 0 CA--C 1.535 0.366 0 CA-C-O 121.663 0.744 . . . . 4.14 111.019 -177.946 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 104' ' ' ILE . . . . . . . . . . . . . 16.1 tt -154.92 146.85 13.29 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.241 0 N-CA-C 106.916 -1.513 . . . . 7.17 106.916 179.788 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 79.5 m-20 53.4 84.73 0.06 Allowed 'General case' 0 N--CA 1.463 0.207 0 C-N-CA 124.785 1.234 . . . . 7.68 110.972 -168.927 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 22.9 t . . . . . 0 C--O 1.25 1.122 0 CA-C-O 115.963 -1.97 . . . . 12.08 107.452 176.353 . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.471 0.989 0 N-CA-C 108.804 -1.718 . . . . 20.54 108.804 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 12.4 m -155.41 172.84 17.56 Favored 'General case' 0 C--N 1.332 -0.163 0 N-CA-C 107.747 -1.205 . . . . 19.33 107.747 -176.211 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 3.9 ptpp? -155.36 157.08 36.55 Favored 'General case' 0 N--CA 1.457 -0.093 0 N-CA-C 108.861 -0.792 . . . . 26.28 108.861 -179.585 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 118.73 -168.03 13.18 Favored Glycine 0 C--N 1.332 0.326 0 N-CA-C 108.827 -1.709 . . . . 18.98 108.827 -175.092 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 34.4 m -78.72 -177.66 0.33 Allowed 'Isoleucine or valine' 0 N--CA 1.444 -0.756 0 N-CA-C 109.14 -0.689 . . . . 18.13 109.14 165.76 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 2.8 pm0 -77.7 121.03 23.45 Favored 'General case' 0 N--CA 1.449 -0.498 0 N-CA-C 113.146 0.795 . . . . 11.99 113.146 177.987 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -113.01 19.94 16.8 Favored 'General case' 0 C--N 1.343 0.293 0 C-N-CA 123.798 0.839 . . . . 11.07 111.263 -179.508 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 20.3 mtp180 -146.51 114.15 6.4 Favored 'General case' 0 N--CA 1.446 -0.656 0 N-CA-C 107.441 -1.318 . . . . 11.73 107.441 -172.799 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -47.18 -34.37 6.22 Favored 'General case' 0 C--O 1.222 -0.374 0 C-N-CA 124.956 1.302 . . . . 3.81 111.228 166.627 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -58.28 -51.81 68.22 Favored 'General case' 0 N--CA 1.449 -0.497 0 C-N-CA 123.523 0.729 . . . . 2.85 111.294 173.79 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 17.2 m -65.01 -53.29 48.4 Favored 'General case' 0 CA--C 1.53 0.208 0 CA-C-N 118.971 0.805 . . . . 2.16 111.653 -178.385 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . 0.406 ' HB2' ' CZ ' ' A' ' 72' ' ' ARG . 16.2 pt-20 -70.2 -27.47 64.52 Favored 'General case' 0 CA--C 1.533 0.291 0 CA-C-O 121.707 0.765 . . . . 3.86 110.483 -175.25 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -66.63 -47.6 67.58 Favored Glycine 0 N--CA 1.446 -0.698 0 N-CA-C 109.147 -1.581 . . . . 0.69 109.147 172.313 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -54.31 -52.32 61.87 Favored 'General case' 0 CA--C 1.52 -0.175 0 CA-C-N 117.794 0.797 . . . . 5.15 110.638 -173.712 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 0.7 OUTLIER -64.59 -38.88 83.77 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.303 0 N-CA-C 112.069 0.396 . . . . 1.45 112.069 179.354 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 12.4 t60 -59.29 -56.18 25.37 Favored 'General case' 0 CA--C 1.53 0.184 0 N-CA-C 107.741 -1.207 . . . . 0.84 107.741 -179.67 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 34.3 mt-10 -57.87 -37.55 74.13 Favored 'General case' 0 N--CA 1.451 -0.418 0 C-N-CA 124.406 1.083 . . . . 2.42 111.057 178.507 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -54.47 -52.15 62.77 Favored 'General case' 0 CA--C 1.521 -0.165 0 CA-C-N 119.457 1.026 . . . . 4.98 109.871 173.878 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -47.82 -46.37 25.23 Favored Glycine 0 CA--C 1.526 0.75 0 N-CA-C 110.696 -0.961 . . . . 0.63 110.696 173.849 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 2.6 t60 -65.66 -45.97 80.9 Favored 'General case' 0 N--CA 1.454 -0.248 0 O-C-N 121.951 -0.735 . . . . 2.54 112.272 -177.883 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -61.78 -34.32 75.68 Favored 'General case' 0 N--CA 1.452 -0.353 0 O-C-N 120.925 -1.109 . . . . 2.03 109.123 179.298 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 94.2 t -76.77 -26.88 16.48 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.428 0 C-N-CA 120.233 -0.587 . . . . 2.77 110.284 179.509 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 34.7 t0 -57.87 -36.93 73.06 Favored 'General case' 0 N--CA 1.456 -0.171 0 CA-C-O 121.953 0.883 . . . . 2.35 110.328 172.141 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 17.6 t70 -69.36 -53.13 21.05 Favored 'General case' 0 N--CA 1.449 -0.491 0 CA-C-O 121.78 0.8 . . . . 2.65 108.948 -175.876 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 36.1 t80 -65.87 -50.91 62.83 Favored 'General case' 0 N--CA 1.452 -0.326 0 CA-C-N 115.463 -0.789 . . . . 3.14 109.494 -173.858 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -53.21 -37.92 62.44 Favored 'General case' 0 N--CA 1.451 -0.388 0 C-N-CA 123.885 0.874 . . . . 3.0 111.264 174.24 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -58.01 -54.4 37.81 Favored Glycine 0 C--N 1.334 0.461 0 N-CA-C 109.762 -1.335 . . . . 2.57 109.762 178.484 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 2.1 t80 -63.2 -46.15 88.4 Favored 'General case' 0 CA--C 1.533 0.303 0 CA-C-O 120.906 0.384 . . . . 5.53 110.961 -177.036 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -73.8 -27.78 61.3 Favored 'General case' 0 N--CA 1.449 -0.521 0 N-CA-C 114.435 1.272 . . . . 3.01 114.435 -171.921 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 38.7 mt -120.42 -70.82 0.77 Allowed 'General case' 0 N--CA 1.463 0.176 0 CA-C-N 119.783 1.174 . . . . 5.02 113.073 -161.074 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 23.3 t0 -62.25 122.33 15.37 Favored 'General case' 0 C--N 1.337 0.042 0 N-CA-C 109.458 -0.571 . . . . 7.15 109.458 -165.886 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 18.3 tptm -63.0 -19.81 64.71 Favored 'General case' 0 C--O 1.226 -0.152 0 N-CA-C 112.211 0.448 . . . . 10.28 112.211 -165.448 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 18.4 t-20 -60.87 -41.19 95.46 Favored 'General case' 0 CA--C 1.531 0.228 0 C-N-CA 123.009 0.524 . . . . 8.99 111.031 174.87 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 1.1 tm0? 73.62 -30.79 0.21 Allowed 'General case' 0 CA--C 1.531 0.234 0 C-N-CA 127.183 2.193 . . . . 10.09 112.875 -177.425 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 14.3 m -67.36 162.31 23.2 Favored 'General case' 0 CA--C 1.531 0.247 0 CA-C-N 119.191 0.905 . . . . 7.61 109.701 171.639 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 64.9 m-20 60.89 -145.65 0.46 Allowed 'General case' 0 CA--C 1.535 0.378 0 C-N-CA 124.726 1.21 . . . . 7.77 110.831 -179.361 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 4.2 mp -123.24 -165.16 1.28 Allowed 'General case' 0 CA--C 1.532 0.282 0 N-CA-C 106.986 -1.487 . . . . 3.98 106.986 -179.56 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 9.8 p -83.25 43.23 0.05 OUTLIER 'Isoleucine or valine' 0 CA--C 1.538 0.503 0 CA-C-N 120.667 1.576 . . . . 3.53 110.089 177.702 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 13.3 t -143.78 139.31 29.31 Favored 'General case' 0 N--CA 1.446 -0.63 0 N-CA-C 104.836 -2.283 . . . . 4.2 104.836 169.616 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 5.4 p30 131.39 -48.16 0.01 OUTLIER 'General case' 0 N--CA 1.47 0.545 0 C-N-CA 130.494 3.518 . . . . 7.75 108.024 -168.252 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 9.9 t -76.86 179.19 6.3 Favored 'General case' 0 N--CA 1.454 -0.256 0 C-N-CA 124.531 1.132 . . . . 3.96 110.997 -168.458 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . 0.429 ' HE3' ' OD2' ' A' ' 98' ' ' ASP . 21.4 tttm 71.05 -53.9 0.67 Allowed 'General case' 0 N--CA 1.467 0.412 0 C-N-CA 126.705 2.002 . . . . 7.6 113.016 -177.187 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 9.7 ttmm -139.52 106.39 5.41 Favored 'General case' 0 N--CA 1.454 -0.242 0 N-CA-C 105.272 -2.121 . . . . 7.98 105.272 176.106 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -51.44 96.57 0.01 OUTLIER 'General case' 0 N--CA 1.465 0.324 0 C-N-CA 125.637 1.575 . . . . 5.83 112.334 -161.404 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 5.9 tt 38.59 38.45 0.2 Allowed 'Isoleucine or valine' 0 CA--C 1.541 0.605 0 C-N-CA 126.023 1.729 . . . . 3.11 111.51 -174.701 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 2.5 m-20 -92.92 -43.3 9.02 Favored 'General case' 0 CA--C 1.521 -0.169 0 O-C-N 120.773 -1.204 . . . . 3.28 109.072 -177.162 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 11.3 mm -49.52 -56.6 2.81 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.229 0 C-N-CA 125.329 1.451 . . . . 1.8 108.922 -178.443 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 28.9 t80 -61.69 -37.5 84.37 Favored 'General case' 0 N--CA 1.453 -0.311 0 C-N-CA 124.614 1.166 . . . . 0.55 112.337 175.551 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . 0.418 ' HA ' ' HE2' ' A' ' 49' ' ' LYS . 0.2 OUTLIER -62.0 -45.17 94.77 Favored 'General case' 0 CA--C 1.519 -0.218 0 CA-C-N 119.652 1.115 . . . . 2.12 111.1 -175.502 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 2.9 tp10 -80.19 -67.51 0.76 Allowed 'General case' 0 N--CA 1.451 -0.425 0 CA-C-O 122.387 1.089 . . . . 2.62 108.962 179.074 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . 0.566 ' OE2' ' HE2' ' A' ' 91' ' ' LYS . 59.2 mm-40 -76.45 -19.69 57.8 Favored 'General case' 0 N--CA 1.453 -0.293 0 C-N-CA 123.389 0.675 . . . . 3.05 111.51 -164.773 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -68.83 36.31 0.28 Allowed Glycine 0 CA--C 1.532 1.145 0 C-N-CA 124.393 0.997 . . . . 0.63 113.12 167.684 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 59.9 p -148.84 23.63 0.97 Allowed 'General case' 0 N--CA 1.448 -0.532 0 O-C-N 120.444 -1.621 . . . . 2.37 110.855 161.488 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 58.7 t-20 -135.51 -43.52 0.69 Allowed 'General case' 0 CA--C 1.52 -0.209 0 CA-C-O 120.896 0.379 . . . . 2.95 111.444 -160.15 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 20.6 mt -66.14 -37.16 85.0 Favored 'General case' 0 C--N 1.331 -0.205 0 C-N-CA 120.445 -0.502 . . . . 1.7 110.674 -179.41 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 2.7 t 175.78 173.1 0.32 Allowed 'General case' 0 CA--C 1.533 0.301 0 C-N-CA 125.269 1.428 . . . . 1.56 108.193 -173.136 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 8.8 p -64.04 -36.3 83.54 Favored 'General case' 0 N--CA 1.455 -0.188 0 C-N-CA 123.889 0.876 . . . . 2.88 110.504 172.666 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -64.38 -14.8 58.52 Favored 'General case' 0 N--CA 1.464 0.266 0 N-CA-C 112.041 0.385 . . . . 1.47 112.041 172.247 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -75.57 -13.6 82.8 Favored Glycine 0 N--CA 1.443 -0.885 0 N-CA-C 110.848 -0.901 . . . . 0.44 110.848 174.339 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 3.6 tmt_? -113.75 -8.65 13.21 Favored 'General case' 0 CA--C 1.52 -0.174 0 CA-C-N 118.967 1.384 . . . . 3.51 113.028 -171.34 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 18.8 p -69.09 -115.21 0.0 OUTLIER 'General case' 0 C--N 1.327 -0.377 0 C-N-CA 124.368 1.067 . . . . 1.8 110.042 177.215 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 9.8 t-20 -86.94 154.1 21.07 Favored 'General case' 0 N--CA 1.454 -0.228 0 O-C-N 120.553 -1.342 . . . . 2.35 107.724 177.829 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 78.8 tt0 -58.68 -34.57 71.41 Favored 'General case' 0 CA--C 1.535 0.383 0 CA-C-N 118.87 0.759 . . . . 2.95 109.731 175.416 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -65.93 -29.04 69.39 Favored 'General case' 0 N--CA 1.455 -0.215 0 N-CA-C 113.128 0.788 . . . . 1.49 113.128 177.521 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 11.9 mt-10 -77.42 -45.68 25.05 Favored 'General case' 0 CA--C 1.513 -0.471 0 O-C-N 121.075 -1.016 . . . . 2.22 110.05 175.856 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 49.8 t80 -47.64 -48.71 28.55 Favored 'General case' 0 C--N 1.33 -0.271 0 C-N-CA 125.717 1.607 . . . . 0.65 111.27 172.19 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 56.5 t80 -63.26 -43.78 97.0 Favored 'General case' 0 CA--C 1.538 0.517 0 O-C-N 121.174 -0.954 . . . . 1.02 110.833 177.013 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -66.49 -52.33 47.22 Favored 'General case' 0 CA--C 1.539 0.534 0 O-C-N 121.114 -0.991 . . . . 1.6 112.851 -174.185 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -57.63 -39.8 77.75 Favored 'General case' 0 C--N 1.331 -0.215 0 O-C-N 120.701 -1.249 . . . . 4.0 111.017 170.382 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -56.71 -44.0 81.12 Favored 'General case' 0 N--CA 1.451 -0.416 0 CA-C-O 118.4 -0.81 . . . . 1.61 110.251 176.648 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 71.3 t80 -55.92 -49.98 71.95 Favored 'General case' 0 N--CA 1.466 0.371 0 CA-C-N 119.725 1.148 . . . . 4.26 111.672 173.517 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 72' ' ' ARG . . . . . 0.406 ' CZ ' ' HB2' ' A' ' 12' ' ' GLU . 64.1 ttt180 -47.98 -57.59 5.55 Favored 'General case' 0 CA--C 1.533 0.325 0 CA-C-N 118.568 0.622 . . . . 3.12 109.899 177.537 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -67.3 -27.6 67.31 Favored 'General case' 0 C--N 1.327 -0.385 0 C-N-CA 124.538 1.135 . . . . 1.78 111.263 -176.476 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 1.2 ttp -62.29 -38.32 88.91 Favored 'General case' 0 N--CA 1.454 -0.244 0 C-N-CA 122.814 0.445 . . . . 3.24 109.852 179.763 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 23.1 p80 -91.27 -36.61 13.8 Favored 'General case' 0 N--CA 1.452 -0.334 0 CA-C-O 115.886 -2.007 . . . . 1.12 111.572 -175.083 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 18.6 m -6.11 118.4 0.01 OUTLIER 'General case' 0 C--N 1.347 0.492 0 C-N-CA 128.493 2.717 . . . . 1.59 114.575 -174.655 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 4.9 p -46.21 -47.24 17.91 Favored 'General case' 0 N--CA 1.451 -0.376 0 C-N-CA 125.234 1.414 . . . . 1.83 109.638 175.136 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 12.9 t0 -70.36 114.18 8.23 Favored 'General case' 0 N--CA 1.451 -0.393 0 CA-C-O 122.13 0.967 . . . . 2.39 109.929 169.7 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 13.2 m170 -63.04 -29.41 70.8 Favored 'General case' 0 N--CA 1.451 -0.377 0 CA-C-N 115.779 -0.646 . . . . 7.51 111.189 176.964 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -63.21 -46.1 88.59 Favored 'General case' 0 N--CA 1.453 -0.29 0 CA-C-N 119.313 0.96 . . . . 2.57 110.07 179.369 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 81' ' ' GLU . . . . . 0.411 ' OE1' ' NZ ' ' A' ' 84' ' ' LYS . 0.2 OUTLIER -48.66 -41.99 33.09 Favored 'General case' 0 C--O 1.231 0.13 0 C-N-CA 124.554 1.142 . . . . 4.23 110.771 175.105 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -64.35 -52.52 57.94 Favored 'General case' 0 C--N 1.33 -0.247 0 N-CA-C 109.417 -0.586 . . . . 4.21 109.417 179.39 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 1.3 mm? -66.19 -16.88 64.36 Favored 'General case' 0 CA--C 1.522 -0.128 0 N-CA-C 112.861 0.689 . . . . 2.42 112.861 179.239 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 84' ' ' LYS . . . . . 0.411 ' NZ ' ' OE1' ' A' ' 81' ' ' GLU . 33.5 mttt -66.4 -51.24 59.04 Favored 'General case' 0 N--CA 1.45 -0.454 0 N-CA-C 106.953 -1.499 . . . . 3.15 106.953 168.865 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 98.8 t -56.18 -46.3 81.17 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.449 0 CA-C-O 118.195 -0.907 . . . . 1.74 111.994 174.557 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 1.6 mt-30 -66.84 -49.89 64.27 Favored 'General case' 0 C--O 1.224 -0.252 0 CA-C-N 120.662 1.574 . . . . 2.91 112.183 -175.589 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 5.3 pttp -68.11 -38.39 82.22 Favored 'General case' 0 C--O 1.226 -0.161 0 O-C-N 121.178 -0.951 . . . . 4.89 109.978 -174.678 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 3.1 m120 -62.38 -45.42 93.24 Favored 'General case' 0 N--CA 1.453 -0.322 0 N-CA-C 108.866 -0.79 . . . . 1.57 108.866 175.883 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -128.53 86.19 58.35 Favored Pre-proline 0 N--CA 1.451 -0.385 0 C-N-CA 126.324 1.85 . . . . 1.44 109.755 -172.467 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 92.1 Cg_endo -80.46 46.18 2.18 Favored 'Trans proline' 0 CA--C 1.539 0.737 0 C-N-CA 123.361 2.707 . . . . 1.85 111.596 -176.899 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 91' ' ' LYS . . . . . 0.566 ' HE2' ' OE2' ' A' ' 51' ' ' GLU . 21.1 pttt -160.88 -53.2 0.05 OUTLIER 'General case' 0 N--CA 1.452 -0.339 0 C-N-CA 125.443 1.497 . . . . 3.48 110.743 177.27 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 3.4 m -50.43 -47.06 56.83 Favored 'General case' 0 N--CA 1.464 0.228 0 C-N-CA 123.649 0.78 . . . . 1.75 111.781 -178.135 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 12.2 t80 -57.47 -49.56 75.89 Favored 'General case' 0 CA--C 1.516 -0.343 0 CA-C-O 121.793 0.806 . . . . 3.85 110.883 178.845 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 1.4 mt-30 -59.69 -26.48 65.61 Favored 'General case' 0 N--CA 1.446 -0.634 0 CA-C-N 114.657 -1.156 . . . . 2.04 110.773 -179.027 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 3.6 t80 -66.93 -58.39 5.07 Favored 'General case' 0 N--CA 1.451 -0.383 0 C-N-CA 123.586 0.755 . . . . 1.2 110.227 -178.16 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 3.3 mp -55.63 -42.54 69.41 Favored 'Isoleucine or valine' 0 CA--C 1.528 0.098 0 N-CA-C 108.701 -0.852 . . . . 2.15 108.701 175.638 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 21.8 t-20 -55.8 -43.91 77.33 Favored 'General case' 0 CA--C 1.537 0.452 0 CA-C-O 120.886 0.374 . . . . 2.34 111.181 -179.869 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 98' ' ' ASP . . . . . 0.429 ' OD2' ' HE3' ' A' ' 42' ' ' LYS . 0.2 OUTLIER -55.76 -37.52 68.62 Favored 'General case' 0 CA--C 1.533 0.318 0 C-N-CA 124.44 1.096 . . . . 2.27 110.178 177.523 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -70.2 -55.61 8.9 Favored 'General case' 0 CA--C 1.532 0.266 0 C-N-CA 123.347 0.659 . . . . 5.35 111.026 -179.649 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 2.5 pt -76.28 74.24 0.48 Allowed 'Isoleucine or valine' 0 CA--C 1.532 0.287 0 CA-C-O 121.771 0.796 . . . . 6.62 111.283 -171.92 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 5.7 tmtm? -133.8 -43.32 0.82 Allowed 'General case' 0 N--CA 1.456 -0.136 0 O-C-N 121.745 -0.597 . . . . 10.76 110.74 -169.292 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 102' ' ' PHE . . . . . . . . . . . . . 52.2 t80 -112.45 -32.0 6.63 Favored 'General case' 0 CA--C 1.532 0.265 0 C-N-CA 123.112 0.565 . . . . 10.06 111.283 177.382 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -60.47 128.52 21.71 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.343 0 O-C-N 121.853 -0.529 . . . . 6.5 109.749 178.402 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 104' ' ' ILE . . . . . . . . . . . . . 5.0 pt -77.37 134.46 28.52 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.171 0 N-CA-C 109.547 -0.538 . . . . 7.82 109.547 176.768 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 18.2 p-10 -144.28 155.49 43.86 Favored 'General case' 0 N--CA 1.454 -0.261 0 N-CA-C 109.264 -0.643 . . . . 12.19 109.264 177.782 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 38.9 m . . . . . 0 C--O 1.247 0.953 0 C-N-CA 126.888 2.075 . . . . 10.73 107.214 173.524 . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.471 1.018 0 N-CA-C 111.212 -0.755 . . . . 12.05 111.212 . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 8.2 m -140.71 -32.03 0.59 Allowed 'General case' 0 N--CA 1.465 0.295 0 N-CA-C 113.294 0.85 . . . . 14.87 113.294 -175.355 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -139.06 160.99 38.47 Favored 'General case' 0 N--CA 1.451 -0.393 0 N-CA-C 107.547 -1.279 . . . . 17.62 107.547 -179.33 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 118.81 166.91 13.69 Favored Glycine 0 N--CA 1.45 -0.402 0 N-CA-C 107.991 -2.044 . . . . 14.26 107.991 -170.508 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 21.4 m -97.37 -160.63 0.1 OUTLIER 'Isoleucine or valine' 0 N--CA 1.441 -0.896 0 N-CA-C 107.57 -1.27 . . . . 14.96 107.57 163.348 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 5.4 pt-20 -109.13 104.49 13.68 Favored 'General case' 0 N--CA 1.448 -0.574 0 CA-C-O 122.684 1.231 . . . . 10.62 111.569 -173.555 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 1.1 mm? -98.23 36.21 1.63 Allowed 'General case' 0 N--CA 1.452 -0.328 0 O-C-N 121.395 -0.816 . . . . 10.47 109.763 -173.076 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 14.4 mmm180 69.17 -71.16 0.12 Allowed 'General case' 0 N--CA 1.467 0.378 0 C-N-CA 124.87 1.268 . . . . 7.29 109.366 -170.67 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 9.7 m-80 -50.14 -37.39 34.2 Favored 'General case' 0 CA--C 1.51 -0.589 0 C-N-CA 125.099 1.36 . . . . 4.29 112.733 175.758 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 24.8 t70 -64.85 -41.44 95.69 Favored 'General case' 0 C--O 1.218 -0.577 0 C-N-CA 118.324 -1.351 . . . . 3.97 110.53 179.401 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -67.43 -55.09 15.1 Favored 'General case' 0 CA--C 1.535 0.381 0 CA-C-N 119.052 0.842 . . . . 2.86 110.444 179.738 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 6.3 tp10 -71.68 -17.55 62.23 Favored 'General case' 0 CA--C 1.537 0.469 0 CA-C-O 121.993 0.902 . . . . 5.85 110.233 -175.42 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -80.75 -37.11 20.7 Favored Glycine 0 CA--C 1.526 0.76 0 C-N-CA 125.039 1.304 . . . . 1.07 110.951 168.935 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 9.2 t80 -55.7 -49.2 73.64 Favored 'General case' 0 C--O 1.219 -0.541 0 C-N-CA 124.403 1.081 . . . . 3.94 108.71 -172.664 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -59.19 -37.16 67.01 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.389 0 N-CA-C 113.087 0.773 . . . . 1.62 113.087 176.421 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 6.4 t60 -61.03 -54.01 50.09 Favored 'General case' 0 N--CA 1.465 0.277 0 N-CA-C 106.354 -1.721 . . . . 0.67 106.354 177.775 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 67.9 mt-10 -53.26 -40.64 64.8 Favored 'General case' 0 C--O 1.223 -0.333 0 C-N-CA 122.698 0.399 . . . . 2.55 110.512 176.988 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -60.84 -50.17 74.54 Favored 'General case' 0 CA--C 1.518 -0.251 0 C-N-CA 125.173 1.389 . . . . 3.22 109.379 -175.291 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -49.04 -46.33 33.11 Favored Glycine 0 CA--C 1.528 0.9 0 N-CA-C 110.447 -1.061 . . . . 0.51 110.447 173.161 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 2.1 t60 -63.34 -42.15 98.93 Favored 'General case' 0 N--CA 1.451 -0.417 0 O-C-N 122.035 -0.685 . . . . 2.57 111.784 179.571 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -65.5 -30.42 71.18 Favored 'General case' 0 N--CA 1.452 -0.372 0 O-C-N 121.378 -0.826 . . . . 1.68 109.956 -179.938 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 82.5 t -70.01 -40.05 78.1 Favored 'Isoleucine or valine' 0 C--O 1.232 0.165 0 O-C-N 121.328 -0.857 . . . . 2.03 109.609 176.355 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 3.6 m-20 -59.76 -22.85 62.67 Favored 'General case' 0 C--N 1.334 -0.099 0 N-CA-C 112.047 0.388 . . . . 2.5 112.047 172.375 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 11.6 t70 -67.45 -50.02 61.04 Favored 'General case' 0 N--CA 1.452 -0.348 0 N-CA-C 108.565 -0.902 . . . . 1.81 108.565 179.695 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -58.73 -57.45 12.95 Favored 'General case' 0 N--CA 1.456 -0.172 0 C-N-CA 123.21 0.604 . . . . 5.1 110.547 177.343 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -58.15 -32.89 68.62 Favored 'General case' 0 N--CA 1.453 -0.292 0 O-C-N 121.824 -0.547 . . . . 1.99 111.333 -178.705 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -59.72 -59.87 9.75 Favored Glycine 0 CA--C 1.521 0.439 0 N-CA-C 110.833 -0.907 . . . . 1.09 110.833 173.101 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -53.85 -29.52 41.49 Favored 'General case' 0 CA--C 1.533 0.301 0 C-N-CA 124.882 1.273 . . . . 2.43 112.385 -173.449 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 2.9 mm? -94.32 -21.69 18.83 Favored 'General case' 0 N--CA 1.445 -0.683 0 N-CA-C 114.25 1.204 . . . . 2.5 114.25 -179.779 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 28.6 mt -127.07 49.07 2.12 Favored 'General case' 0 CA--C 1.534 0.362 0 CA-C-N 120.052 1.296 . . . . 2.6 111.042 -166.696 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 22.5 p-10 -120.54 87.58 2.78 Favored 'General case' 0 CA--C 1.532 0.279 0 C-N-CA 125.248 1.419 . . . . 6.01 111.483 -166.694 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 49.3 mttm -64.43 -57.34 9.54 Favored 'General case' 0 N--CA 1.465 0.302 0 O-C-N 119.987 -1.695 . . . . 8.53 111.216 175.456 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 4.2 t-20 -163.72 158.51 20.38 Favored 'General case' 0 N--CA 1.455 -0.219 0 N-CA-C 108.179 -1.045 . . . . 7.85 108.179 177.391 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 27.1 tt0 42.67 34.91 0.62 Allowed 'General case' 0 CA--C 1.537 0.475 0 C-N-CA 126.819 2.048 . . . . 10.49 113.733 172.693 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 6.7 t -160.77 80.37 0.64 Allowed 'General case' 0 N--CA 1.453 -0.277 0 N-CA-C 107.069 -1.456 . . . . 7.45 107.069 179.548 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 70.8 m-20 -72.34 -45.63 59.03 Favored 'General case' 0 N--CA 1.462 0.158 0 CA-C-O 121.699 0.761 . . . . 5.67 109.81 -173.738 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 2.5 mt -86.3 141.29 29.35 Favored 'General case' 0 N--CA 1.454 -0.254 0 N-CA-C 107.087 -1.449 . . . . 3.06 107.087 172.387 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 9.9 p -63.94 116.42 3.51 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.312 0 N-CA-C 105.435 -2.061 . . . . 3.35 105.435 173.28 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 18.7 p -129.02 85.48 2.33 Favored 'General case' 0 N--CA 1.452 -0.359 0 N-CA-C 106.332 -1.729 . . . . 4.17 106.332 -179.228 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 9.4 t-20 64.38 -74.63 0.05 OUTLIER 'General case' 0 CA--C 1.53 0.194 0 C-N-CA 125.892 1.677 . . . . 8.95 110.958 -166.796 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 6.3 t 67.96 158.86 0.15 Allowed 'General case' 0 N--CA 1.453 -0.318 0 C-N-CA 126.487 1.915 . . . . 3.4 110.948 -175.32 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 49.2 tttm 70.8 -63.03 0.43 Allowed 'General case' 0 CA--C 1.532 0.279 0 C-N-CA 125.177 1.391 . . . . 8.38 111.843 -174.563 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -86.75 168.21 13.74 Favored 'General case' 0 N--CA 1.457 -0.088 0 CA-C-N 119.287 0.948 . . . . 7.64 109.421 174.307 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -85.1 58.74 5.2 Favored 'General case' 0 CA--C 1.533 0.292 0 C-N-CA 123.606 0.762 . . . . 7.85 109.279 -175.648 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 3.8 pt 39.01 39.21 0.22 Allowed 'Isoleucine or valine' 0 CA--C 1.541 0.624 0 C-N-CA 125.459 1.504 . . . . 5.11 112.369 -175.719 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 12.8 t70 -60.68 -44.04 96.99 Favored 'General case' 0 N--CA 1.465 0.308 0 C-N-CA 124.716 1.206 . . . . 2.37 111.032 -173.874 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 5.7 mm -50.63 -52.59 15.81 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.308 0 C-N-CA 124.559 1.144 . . . . 1.85 108.677 177.461 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 20.0 t80 -67.52 -33.7 75.6 Favored 'General case' 0 N--CA 1.452 -0.332 0 C-N-CA 123.403 0.681 . . . . 0.93 112.043 177.201 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . 0.506 ' HE2' ' N ' ' A' ' 49' ' ' LYS . 0.6 OUTLIER -61.93 -49.16 77.25 Favored 'General case' 0 CA--C 1.519 -0.235 0 CA-C-N 119.899 1.227 . . . . 2.58 109.195 -174.44 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 7.3 mm-40 -80.08 -66.17 0.91 Allowed 'General case' 0 N--CA 1.448 -0.563 0 CA-C-O 122.14 0.971 . . . . 3.16 109.089 -178.461 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 17.8 mm-40 -73.79 -21.52 60.14 Favored 'General case' 0 C--O 1.235 0.298 0 C-N-CA 123.442 0.697 . . . . 2.57 110.659 -164.791 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . 0.412 ' HA2' ' CD1' ' A' ' 66' ' ' PHE . . . -68.2 37.52 0.25 Allowed Glycine 0 CA--C 1.531 1.064 0 C-N-CA 125.429 1.49 . . . . 0.42 113.454 169.073 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 61.5 p -148.94 23.25 0.97 Allowed 'General case' 0 N--CA 1.446 -0.663 0 O-C-N 120.673 -1.486 . . . . 2.66 110.839 163.388 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 3.2 t-20 -136.19 -39.84 0.67 Allowed 'General case' 0 CA--C 1.517 -0.301 0 N-CA-C 113.147 0.795 . . . . 2.44 113.147 -164.799 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 16.2 mt -66.96 -36.86 83.15 Favored 'General case' 0 C--N 1.332 -0.194 0 C-N-CA 120.214 -0.594 . . . . 1.58 110.473 -178.533 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 1.2 t 178.83 170.3 0.87 Allowed 'General case' 0 C--N 1.331 -0.206 0 C-N-CA 125.451 1.5 . . . . 1.62 107.637 -178.581 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 9.6 m -57.56 -35.35 70.22 Favored 'General case' 0 N--CA 1.453 -0.279 0 C-N-CA 123.175 0.59 . . . . 1.29 110.554 170.056 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -58.5 -33.84 70.27 Favored 'General case' 0 C--N 1.34 0.154 0 CA-C-N 117.837 0.289 . . . . 1.9 110.418 173.842 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -63.96 -16.36 59.48 Favored Glycine 0 C--O 1.22 -0.74 0 CA-C-O 119.106 -0.83 . . . . 0.55 111.792 178.481 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 50.7 ttt-85 -104.6 -8.55 18.88 Favored 'General case' 0 N--CA 1.457 -0.111 0 CA-C-N 119.184 1.492 . . . . 2.76 113.735 178.942 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 44.0 p -67.65 -139.12 0.0 OUTLIER 'General case' 0 CA--C 1.54 0.596 0 CA-C-O 121.205 0.526 . . . . 1.87 110.585 174.567 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 1.1 t-20 -65.22 149.48 49.86 Favored 'General case' 0 N--CA 1.453 -0.307 0 O-C-N 120.067 -1.646 . . . . 1.95 108.703 178.473 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 3.4 tm-20 -60.58 -32.69 71.78 Favored 'General case' 0 CA--C 1.532 0.282 0 O-C-N 121.915 -0.491 . . . . 3.15 110.259 179.454 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -61.62 -29.76 70.26 Favored 'General case' 0 N--CA 1.454 -0.246 0 N-CA-C 113.798 1.036 . . . . 1.84 113.798 175.166 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 2.1 mt-10 -81.44 -41.03 22.44 Favored 'General case' 0 CA--C 1.508 -0.653 0 O-C-N 121.169 -0.957 . . . . 2.52 110.597 176.776 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 66' ' ' PHE . . . . . 0.412 ' CD1' ' HA2' ' A' ' 52' ' ' GLY . 37.3 t80 -50.42 -47.7 56.52 Favored 'General case' 0 N--CA 1.45 -0.437 0 C-N-CA 124.194 0.997 . . . . 0.35 111.155 170.283 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 42.1 t80 -64.59 -46.02 84.48 Favored 'General case' 0 CA--C 1.538 0.504 0 O-C-N 121.34 -0.85 . . . . 0.85 109.98 176.979 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -61.28 -54.61 41.88 Favored 'General case' 0 CA--C 1.539 0.53 0 O-C-N 121.082 -1.011 . . . . 1.55 113.061 -174.297 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -57.28 -39.86 76.56 Favored 'General case' 0 C--N 1.331 -0.211 0 O-C-N 121.008 -1.057 . . . . 3.9 110.86 171.511 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -56.69 -42.18 78.64 Favored 'General case' 0 N--CA 1.453 -0.316 0 CA-C-N 119.15 0.886 . . . . 1.5 110.806 175.995 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 76.7 t80 -58.53 -49.66 76.59 Favored 'General case' 0 N--CA 1.464 0.261 0 CA-C-N 119.912 1.233 . . . . 4.26 111.633 172.821 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 22.8 ttp180 -47.84 -57.75 5.24 Favored 'General case' 0 N--CA 1.465 0.284 0 CA-C-N 119.238 0.926 . . . . 3.42 110.203 177.449 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -63.6 -30.15 71.3 Favored 'General case' 0 C--N 1.326 -0.414 0 C-N-CA 124.838 1.255 . . . . 1.8 111.104 -177.153 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 1.2 ttp -59.2 -42.23 90.45 Favored 'General case' 0 C--O 1.233 0.227 0 C-N-CA 122.756 0.422 . . . . 3.31 110.488 -179.938 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 8.9 p80 -96.7 -6.12 37.17 Favored 'General case' 0 N--CA 1.455 -0.183 0 CA-C-O 116.365 -1.779 . . . . 1.12 113.68 -177.181 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 16.6 m -36.94 126.93 0.91 Allowed 'General case' 0 N--CA 1.453 -0.29 0 CA-C-O 123.267 1.508 . . . . 1.67 111.905 -171.697 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 7.8 p -52.83 -44.95 67.08 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 112.849 -1.978 . . . . 2.18 108.207 177.133 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 13.0 t0 -65.68 107.52 1.78 Allowed 'General case' 0 N--CA 1.45 -0.459 0 CA-C-O 121.863 0.84 . . . . 2.14 108.91 166.687 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -57.58 -33.01 67.74 Favored 'General case' 0 N--CA 1.454 -0.266 0 CA-C-N 116.068 -0.515 . . . . 6.81 110.432 177.452 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -61.95 -47.4 85.06 Favored 'General case' 0 N--CA 1.451 -0.38 0 CA-C-N 118.567 0.621 . . . . 1.95 110.745 179.952 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 5.7 mt-10 -49.1 -41.44 35.66 Favored 'General case' 0 CA--C 1.519 -0.245 0 C-N-CA 123.943 0.897 . . . . 2.6 110.908 178.444 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 2.2 mtp180 -62.45 -50.2 72.4 Favored 'General case' 0 C--N 1.327 -0.396 0 N-CA-C 109.056 -0.72 . . . . 3.85 109.056 178.484 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 1.3 mm? -64.99 -18.18 65.06 Favored 'General case' 0 N--CA 1.451 -0.398 0 CA-C-O 117.682 -1.152 . . . . 1.63 113.487 176.51 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 6.6 mttt -69.32 -48.8 60.38 Favored 'General case' 0 C--O 1.224 -0.27 0 CA-C-N 121.404 1.911 . . . . 2.11 107.511 168.774 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 33.4 t -58.57 -42.61 85.19 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.596 0 CA-C-O 118.112 -0.947 . . . . 1.94 111.449 176.237 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 1.3 mt-30 -69.44 -52.77 23.67 Favored 'General case' 0 C--O 1.224 -0.255 0 CA-C-N 121.253 1.842 . . . . 2.72 111.741 -179.949 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 35.6 tttt -51.96 -50.8 60.52 Favored 'General case' 0 N--CA 1.451 -0.393 0 C-N-CA 123.436 0.694 . . . . 3.05 110.075 -177.661 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 4.0 m-20 -65.93 -46.08 79.51 Favored 'General case' 0 N--CA 1.449 -0.479 0 C-N-CA 123.389 0.676 . . . . 1.57 109.565 179.276 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -130.63 78.1 74.55 Favored Pre-proline 0 C--O 1.238 0.45 0 C-N-CA 125.672 1.589 . . . . 1.31 110.847 -168.634 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 73.9 Cg_endo -74.7 15.9 0.66 Allowed 'Trans proline' 0 CA--C 1.536 0.594 0 C-N-CA 123.062 2.508 . . . . 1.51 112.683 -175.233 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 7.9 ptmt -128.69 -46.43 1.29 Allowed 'General case' 0 N--CA 1.451 -0.421 0 C-N-CA 125.773 1.629 . . . . 3.69 109.526 -177.751 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 3.3 m -54.61 -49.4 70.56 Favored 'General case' 0 N--CA 1.464 0.242 0 CA-C-N 119.533 1.061 . . . . 1.69 111.067 176.227 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 22.5 t80 -59.01 -50.48 73.92 Favored 'General case' 0 CA--C 1.51 -0.583 0 C-N-CA 119.927 -0.709 . . . . 2.97 110.428 -179.724 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 22.4 tt0 -57.72 -29.63 64.89 Favored 'General case' 0 N--CA 1.444 -0.732 0 CA-C-N 114.69 -1.141 . . . . 3.14 110.1 -177.158 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 13.1 t80 -66.07 -58.42 5.52 Favored 'General case' 0 N--CA 1.45 -0.45 0 C-N-CA 123.358 0.663 . . . . 1.85 109.34 -177.882 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 3.2 mp -55.02 -41.99 62.03 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.217 0 N-CA-C 109.297 -0.631 . . . . 1.93 109.297 175.718 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 14.0 t-20 -60.98 -35.73 77.58 Favored 'General case' 0 N--CA 1.455 -0.187 0 C-N-CA 123.382 0.673 . . . . 3.58 111.772 -175.957 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 27.0 t70 -70.83 -40.24 72.54 Favored 'General case' 0 CA--C 1.528 0.126 0 C-N-CA 123.585 0.754 . . . . 2.17 110.333 174.481 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -68.38 -58.33 4.52 Favored 'General case' 0 CA--C 1.534 0.353 0 C-N-CA 124.066 0.946 . . . . 4.91 110.431 -170.317 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 1.1 pt -74.44 129.23 36.72 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.238 0 O-C-N 121.471 -0.768 . . . . 6.69 109.225 179.107 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -147.52 -59.83 0.27 Allowed 'General case' 0 CA--C 1.518 -0.268 0 O-C-N 121.414 -0.804 . . . . 10.86 109.843 -175.265 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 102' ' ' PHE . . . . . . . . . . . . . 8.7 t80 -152.83 89.08 1.36 Allowed 'General case' 0 N--CA 1.453 -0.304 0 N-CA-C 108.051 -1.092 . . . . 7.95 108.051 172.19 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 11.1 tp -134.31 62.78 0.28 Allowed 'Isoleucine or valine' 0 C--O 1.227 -0.121 0 CA-C-O 122.685 1.231 . . . . 6.01 108.66 -177.664 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 104' ' ' ILE . . . . . . . . . . . . . 1.1 pt -136.74 156.14 34.65 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.546 0 N-CA-C 107.884 -1.154 . . . . 9.46 107.884 178.685 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 60.5 t30 -145.11 149.43 35.0 Favored 'General case' 0 N--CA 1.449 -0.501 0 N-CA-C 105.708 -1.96 . . . . 9.17 105.708 172.156 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 48.7 m . . . . . 0 C--O 1.248 1.012 0 CA-C-O 116.738 -1.601 . . . . 9.59 108.604 -177.074 . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . 0.419 ' CA ' ' OE1' ' A' ' 17' ' ' GLU . . . . . . . . 0 N--CA 1.471 1.016 0 CA-C-O 119.639 -0.534 . . . . 11.05 113.783 . . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 6.0 m -155.34 -85.24 0.06 Allowed 'General case' 0 N--CA 1.454 -0.272 0 CA-C-N 119.36 1.58 . . . . 12.19 107.77 174.252 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 9.6 ttmt -173.89 163.92 4.17 Favored 'General case' 0 N--CA 1.458 -0.052 0 N-CA-C 109.04 -0.726 . . . . 16.78 109.04 178.907 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 104.79 -153.98 17.39 Favored Glycine 0 C--N 1.333 0.411 0 N-CA-C 110.226 -1.149 . . . . 13.63 110.226 177.264 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 31.8 m -80.02 -156.59 0.04 OUTLIER 'Isoleucine or valine' 0 N--CA 1.445 -0.72 0 N-CA-C 108.069 -1.086 . . . . 14.01 108.069 167.859 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -96.28 124.87 40.43 Favored 'General case' 0 N--CA 1.446 -0.657 0 CA-C-O 121.889 0.852 . . . . 9.28 109.885 169.268 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 1.9 mm? -111.18 39.23 2.33 Favored 'General case' 0 N--CA 1.447 -0.585 0 C-N-CA 124.455 1.102 . . . . 9.48 108.091 179.945 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 11.3 mmm180 68.96 -76.37 0.06 Allowed 'General case' 0 N--CA 1.467 0.385 0 C-N-CA 123.555 0.742 . . . . 7.8 109.483 -174.217 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 7.0 m-20 -45.49 -43.66 11.8 Favored 'General case' 0 CA--C 1.513 -0.449 0 C-N-CA 124.9 1.28 . . . . 3.02 111.303 173.45 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 8.4 t70 -66.07 -38.76 89.11 Favored 'General case' 0 N--CA 1.449 -0.49 0 C-N-CA 118.168 -1.413 . . . . 3.59 111.315 -176.085 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -65.91 -59.63 3.66 Favored 'General case' 0 CA--C 1.53 0.2 0 C-N-CA 124.471 1.108 . . . . 1.98 110.532 177.481 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . 0.418 ' HA ' ' CD1' ' A' ' 15' ' ' ILE . 8.9 pt-20 -68.85 -25.8 64.83 Favored 'General case' 0 C--O 1.234 0.286 0 O-C-N 121.529 -0.732 . . . . 3.23 110.37 -172.27 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -72.34 -46.56 33.15 Favored Glycine 0 CA--C 1.526 0.765 0 C-N-CA 124.897 1.237 . . . . 0.85 110.881 170.75 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 16.0 t80 -58.21 -55.9 29.05 Favored 'General case' 0 C--O 1.223 -0.303 0 CA-C-N 118.576 1.188 . . . . 4.88 109.504 -176.956 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . 0.418 ' CD1' ' HA ' ' A' ' 12' ' ' GLU . 0.8 OUTLIER -60.74 -33.9 56.86 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.328 0 O-C-N 121.724 -0.61 . . . . 1.8 111.708 -179.894 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 13.6 t60 -61.7 -51.56 67.88 Favored 'General case' 0 CA--C 1.536 0.442 0 N-CA-C 107.796 -1.186 . . . . 1.11 107.796 177.607 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . 0.419 ' OE1' ' CA ' ' A' ' 1' ' ' GLY . 43.6 mt-10 -54.13 -40.69 67.61 Favored 'General case' 0 C--O 1.225 -0.22 0 O-C-N 121.013 -1.054 . . . . 2.29 110.668 175.173 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 1.3 t80 -58.23 -41.37 83.96 Favored 'General case' 0 N--CA 1.453 -0.314 0 C-N-CA 123.244 0.618 . . . . 3.52 109.931 178.752 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -49.87 -49.71 34.4 Favored Glycine 0 CA--C 1.529 0.927 0 N-CA-C 111.226 -0.75 . . . . 0.75 111.226 170.47 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 70.8 m-70 -57.15 -52.16 66.42 Favored 'General case' 0 C--O 1.227 -0.11 0 CA-C-N 117.93 0.865 . . . . 5.41 110.917 176.833 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -60.59 -27.42 67.71 Favored 'General case' 0 N--CA 1.454 -0.226 0 CA-C-N 117.802 0.273 . . . . 1.57 111.691 -177.904 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 54.2 t -71.83 -40.12 68.71 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.212 0 O-C-N 121.15 -0.969 . . . . 2.17 109.563 176.51 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 3.2 t0 -66.51 -12.86 59.61 Favored 'General case' 0 N--CA 1.451 -0.419 0 N-CA-C 112.215 0.45 . . . . 2.49 112.215 179.837 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 17.1 t70 -59.02 -51.31 70.61 Favored 'General case' 0 N--CA 1.454 -0.26 0 N-CA-C 108.497 -0.927 . . . . 3.81 108.497 177.672 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -55.73 -43.58 76.74 Favored 'General case' 0 N--CA 1.453 -0.307 0 C-N-CA 123.473 0.709 . . . . 3.97 110.518 177.922 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -57.74 -40.82 80.54 Favored 'General case' 0 N--CA 1.447 -0.603 0 CA-C-O 118.714 -0.66 . . . . 2.31 110.434 179.768 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -70.79 -52.97 12.65 Favored Glycine 0 CA--C 1.526 0.754 0 N-CA-C 110.751 -0.94 . . . . 1.48 110.751 179.966 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -45.03 -47.77 11.64 Favored 'General case' 0 C--O 1.235 0.301 0 C-N-CA 125.083 1.353 . . . . 3.02 110.556 -177.374 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 3.3 mm? -79.19 -42.83 25.16 Favored 'General case' 0 N--CA 1.443 -0.82 0 C-N-CA 123.915 0.886 . . . . 3.9 112.238 177.938 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 6.4 mt -119.7 99.14 6.47 Favored 'General case' 0 CA--C 1.534 0.357 0 C-N-CA 123.772 0.829 . . . . 3.98 109.131 -165.967 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 5.8 t0 88.32 85.94 0.02 OUTLIER 'General case' 0 N--CA 1.47 0.564 0 C-N-CA 126.775 2.03 . . . . 4.96 107.151 -175.669 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.38 165.02 2.23 Favored 'General case' 0 N--CA 1.467 0.412 0 C-N-CA 123.093 0.557 . . . . 8.54 110.404 -171.887 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 54.6 t30 -34.71 89.76 0.0 OUTLIER 'General case' 0 N--CA 1.465 0.322 0 C-N-CA 126.804 2.042 . . . . 10.98 113.307 -174.091 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 48.3 tt0 -162.73 -44.49 0.04 OUTLIER 'General case' 0 C--N 1.334 -0.097 0 C-N-CA 124.262 1.025 . . . . 9.1 108.734 -169.858 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -120.09 148.24 43.85 Favored 'General case' 0 N--CA 1.449 -0.515 0 N-CA-C 106.092 -1.818 . . . . 5.6 106.092 160.964 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 38.8 t0 -93.88 132.76 37.98 Favored 'General case' 0 N--CA 1.454 -0.256 0 N-CA-C 107.605 -1.257 . . . . 7.1 107.605 -179.652 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 5.9 mp 64.68 177.15 0.19 Allowed 'General case' 0 CA--C 1.544 0.739 0 C-N-CA 124.891 1.276 . . . . 4.0 110.399 -167.594 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 2.7 p -89.26 40.41 0.07 OUTLIER 'Isoleucine or valine' 0 N--CA 1.471 0.605 0 O-C-N 119.707 -1.87 . . . . 3.04 110.227 -176.713 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 8.8 t -63.48 162.14 13.19 Favored 'General case' 0 N--CA 1.452 -0.359 0 O-C-N 121.375 -0.828 . . . . 4.45 110.082 179.831 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 5.2 m120 62.26 -84.52 0.02 OUTLIER 'General case' 0 N--CA 1.447 -0.607 0 C-N-CA 126.273 1.829 . . . . 7.48 109.9 -176.801 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 9.8 t 64.96 120.37 0.02 OUTLIER 'General case' 0 CA--C 1.538 0.517 0 CA-C-O 123.595 1.664 . . . . 4.09 111.412 -176.27 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -67.26 135.36 53.27 Favored 'General case' 0 N--CA 1.455 -0.187 0 O-C-N 120.142 -1.599 . . . . 14.57 108.411 -174.057 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER 51.99 35.4 15.95 Favored 'General case' 0 CA--C 1.535 0.381 0 C-N-CA 124.655 1.182 . . . . 10.57 111.138 -175.278 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 1.9 m-85 -139.4 -31.98 0.67 Allowed 'General case' 0 N--CA 1.455 -0.197 0 C-N-CA 123.67 0.788 . . . . 12.55 110.817 177.435 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 9.9 tt -48.74 -26.32 1.5 Allowed 'Isoleucine or valine' 0 CA--C 1.535 0.388 0 C-N-CA 124.147 0.979 . . . . 3.42 112.818 178.639 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 94.7 m-20 -42.49 -45.85 4.6 Favored 'General case' 0 N--CA 1.465 0.291 0 C-N-CA 125.878 1.671 . . . . 3.81 111.11 173.873 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 8.8 mm -47.65 -60.58 0.59 Allowed 'Isoleucine or valine' 0 CA--C 1.536 0.406 0 C-N-CA 125.692 1.597 . . . . 2.0 108.955 175.963 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 23.7 t80 -65.35 -30.6 71.45 Favored 'General case' 0 N--CA 1.454 -0.257 0 O-C-N 121.031 -1.043 . . . . 0.72 112.304 178.185 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -65.22 -49.55 69.26 Favored 'General case' 0 N--CA 1.454 -0.251 0 O-C-N 120.256 -1.527 . . . . 2.14 109.76 -176.942 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 26.8 mm-40 -85.94 -57.14 3.15 Favored 'General case' 0 N--CA 1.449 -0.499 0 CA-C-O 121.452 0.644 . . . . 4.33 109.557 -171.98 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 37.3 mt-10 -80.95 -23.32 38.92 Favored 'General case' 0 C--O 1.235 0.329 0 O-C-N 121.775 -0.578 . . . . 3.54 110.502 -171.692 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . 0.425 ' HA2' ' CD1' ' A' ' 66' ' ' PHE . . . -71.17 43.52 0.67 Allowed Glycine 0 CA--C 1.531 1.039 0 C-N-CA 125.791 1.662 . . . . 0.43 113.776 168.934 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 34.6 t -160.25 35.79 0.17 Allowed 'General case' 0 N--CA 1.447 -0.62 0 C-N-CA 125.022 1.329 . . . . 2.52 108.023 162.9 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 31.9 t30 -146.34 -34.76 0.29 Allowed 'General case' 0 C--N 1.341 0.228 0 N-CA-C 113.589 0.959 . . . . 2.76 113.589 -169.699 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 18.8 mt -64.01 -41.28 97.52 Favored 'General case' 0 CA--C 1.53 0.187 0 O-C-N 121.4 -0.813 . . . . 1.79 110.124 174.912 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 1.6 t 177.7 174.67 0.5 Allowed 'General case' 0 CA--C 1.534 0.337 0 C-N-CA 125.907 1.683 . . . . 1.64 107.67 -177.116 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 74.5 m -59.57 -31.5 69.49 Favored 'General case' 0 CA--C 1.529 0.166 0 O-C-N 121.584 -0.697 . . . . 1.83 110.472 166.935 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -64.65 -19.87 65.97 Favored 'General case' 0 CA--C 1.535 0.403 0 CA-C-N 118.066 0.394 . . . . 1.95 111.755 176.112 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -84.29 -11.9 77.21 Favored Glycine 0 N--CA 1.446 -0.642 0 CA-C-O 119.177 -0.791 . . . . 0.49 111.394 176.494 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 3.9 tmt_? -107.18 -13.85 15.05 Favored 'General case' 0 N--CA 1.455 -0.194 0 CA-C-N 118.29 1.045 . . . . 3.33 112.132 -178.106 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 1.1 p -62.73 -165.76 0.01 OUTLIER 'General case' 0 CA--C 1.538 0.501 0 C-N-CA 123.752 0.821 . . . . 1.81 110.162 164.987 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 14.6 m-20 -49.52 148.53 2.77 Favored 'General case' 0 CA--C 1.528 0.122 0 O-C-N 121.268 -0.895 . . . . 2.85 110.879 -178.679 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 60.4 tt0 -62.83 -27.86 69.61 Favored 'General case' 0 CA--C 1.533 0.322 0 CA-C-O 121.298 0.57 . . . . 2.64 111.117 -177.547 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -54.46 -40.43 68.42 Favored 'General case' 0 N--CA 1.455 -0.201 0 O-C-N 121.553 -0.717 . . . . 1.81 112.152 169.429 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 1.3 mt-10 -78.25 -39.37 40.39 Favored 'General case' 0 CA--C 1.507 -0.68 0 CA-C-O 118.418 -0.801 . . . . 2.85 110.022 -178.059 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 66' ' ' PHE . . . . . 0.425 ' CD1' ' HA2' ' A' ' 52' ' ' GLY . 56.5 t80 -51.47 -50.87 58.98 Favored 'General case' 0 N--CA 1.452 -0.354 0 C-N-CA 123.863 0.865 . . . . 0.52 111.354 171.735 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 79.1 t80 -62.89 -44.23 96.65 Favored 'General case' 0 CA--C 1.541 0.619 0 O-C-N 121.473 -0.767 . . . . 0.62 110.132 177.426 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -64.57 -55.54 19.79 Favored 'General case' 0 CA--C 1.537 0.448 0 N-CA-C 113.795 1.035 . . . . 1.5 113.795 -174.438 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -54.8 -39.44 68.47 Favored 'General case' 0 C--N 1.33 -0.244 0 O-C-N 120.665 -1.272 . . . . 3.85 111.404 169.047 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -59.02 -35.58 73.52 Favored 'General case' 0 CA--C 1.534 0.345 0 CA-C-N 119.63 1.104 . . . . 1.64 110.789 174.465 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -61.52 -53.33 57.87 Favored 'General case' 0 C--O 1.233 0.194 0 CA-C-N 119.085 0.857 . . . . 5.02 111.481 171.202 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 2.3 ttt180 -45.39 -64.53 0.7 Allowed 'General case' 0 CA--C 1.528 0.129 0 C-N-CA 123.202 0.601 . . . . 3.17 109.966 177.548 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -51.08 -53.51 33.4 Favored 'General case' 0 C--N 1.326 -0.448 0 C-N-CA 126.363 1.865 . . . . 1.64 110.063 -179.296 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -61.92 -30.15 70.7 Favored 'General case' 0 CA--C 1.535 0.37 0 O-C-N 121.742 -0.599 . . . . 3.66 112.238 -172.43 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 1.7 p80 -90.9 -18.71 24.3 Favored 'General case' 0 N--CA 1.463 0.201 0 CA-C-O 118.049 -0.977 . . . . 1.26 112.215 176.115 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 5.1 m -55.36 112.69 1.16 Allowed 'General case' 0 N--CA 1.446 -0.63 0 CA-C-N 119.82 1.191 . . . . 2.04 107.963 -173.989 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -44.74 -37.43 3.74 Favored 'General case' 0 C--N 1.325 -0.497 0 C-N-CA 125.684 1.593 . . . . 3.77 110.908 -178.051 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 19.1 t0 -55.33 99.23 0.03 OUTLIER 'General case' 0 N--CA 1.449 -0.493 0 CA-C-O 122.721 1.248 . . . . 2.14 111.439 168.348 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 14.2 p-80 -44.42 -36.73 3.01 Favored 'General case' 0 N--CA 1.449 -0.482 0 CA-C-N 114.467 -1.242 . . . . 6.07 112.558 171.251 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -63.23 -53.71 48.84 Favored 'General case' 0 N--CA 1.449 -0.507 0 CA-C-N 119.365 0.984 . . . . 1.61 110.746 -178.202 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -50.21 -44.37 53.16 Favored 'General case' 0 N--CA 1.465 0.276 0 CA-C-N 119.235 0.925 . . . . 3.56 109.525 178.287 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 44.0 mtp180 -62.59 -56.64 16.01 Favored 'General case' 0 N--CA 1.452 -0.327 0 CA-C-N 115.99 -0.55 . . . . 3.66 110.576 -177.812 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 1.1 mm? -63.72 -17.81 63.38 Favored 'General case' 0 N--CA 1.448 -0.538 0 C-N-CA 123.516 0.727 . . . . 1.66 112.634 179.491 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 45.5 mttt -70.09 -45.64 66.55 Favored 'General case' 0 CA--C 1.511 -0.552 0 CA-C-N 119.835 1.198 . . . . 1.91 108.567 170.51 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 57.2 t -54.28 -51.52 47.38 Favored 'Isoleucine or valine' 0 C--O 1.214 -0.791 0 C-N-CA 119.538 -0.865 . . . . 1.98 109.241 170.062 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 4.2 tm0? -67.06 -51.59 52.71 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 119.583 1.083 . . . . 3.53 111.927 -167.598 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 7.8 ttmm -55.38 -44.81 76.45 Favored 'General case' 0 C--N 1.331 -0.22 0 C-N-CA 124.651 1.18 . . . . 3.47 110.828 175.427 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 15.9 m-20 -77.63 -22.45 50.72 Favored 'General case' 0 CA--C 1.532 0.266 0 C-N-CA 122.732 0.413 . . . . 1.41 111.458 -177.068 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -155.9 69.7 5.14 Favored Pre-proline 0 C--O 1.238 0.459 0 C-N-CA 125.492 1.517 . . . . 1.35 109.365 -165.367 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 30.8 Cg_endo -61.22 -34.82 87.83 Favored 'Trans proline' 0 N--CA 1.449 -1.126 0 C-N-CA 121.873 1.716 . . . . 2.2 109.911 -175.388 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 11.1 tttt -79.45 -44.05 22.1 Favored 'General case' 0 N--CA 1.448 -0.545 0 C-N-CA 124.974 1.31 . . . . 5.57 110.414 -174.375 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 7.2 m -58.16 -47.4 83.49 Favored 'General case' 0 N--CA 1.464 0.269 0 CA-C-N 119.217 0.917 . . . . 1.67 108.983 176.384 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 12.9 t80 -59.59 -45.39 92.01 Favored 'General case' 0 CA--C 1.501 -0.931 0 O-C-N 122.018 -0.426 . . . . 3.09 111.543 -178.265 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 46.8 tt0 -48.99 -44.26 40.97 Favored 'General case' 0 N--CA 1.443 -0.795 0 O-C-N 124.332 1.02 . . . . 3.64 109.333 176.511 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 4.0 t80 -61.99 -54.31 43.46 Favored 'General case' 0 CA--C 1.529 0.148 0 N-CA-C 109.695 -0.483 . . . . 1.99 109.695 -177.378 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 34.8 mm -59.72 -29.41 42.77 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.199 0 C-N-CA 123.518 0.727 . . . . 2.95 111.512 -178.361 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -78.36 -33.89 48.71 Favored 'General case' 0 N--CA 1.453 -0.282 0 O-C-N 121.195 -0.941 . . . . 2.59 110.324 178.863 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -61.09 -56.13 24.49 Favored 'General case' 0 CA--C 1.53 0.199 0 C-N-CA 124.747 1.219 . . . . 2.13 108.799 177.404 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 42.9 mm-40 -78.14 96.92 5.29 Favored 'General case' 0 N--CA 1.452 -0.362 0 O-C-N 121.622 -0.674 . . . . 2.94 109.951 178.119 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 37.7 mt -46.38 130.92 3.06 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.37 0 C-N-CA 125.105 1.362 . . . . 5.38 110.45 179.244 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 1.4 mppt? -83.69 165.74 18.68 Favored 'General case' 0 N--CA 1.454 -0.244 0 N-CA-C 109.712 -0.477 . . . . 12.26 109.712 -177.909 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 102' ' ' PHE . . . . . . . . . . . . . 79.2 m-85 73.27 83.71 0.12 Allowed 'General case' 0 N--CA 1.464 0.226 0 C-N-CA 126.821 2.048 . . . . 13.52 110.903 179.865 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 5.0 tp -84.9 -35.78 10.49 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.405 0 CA-C-N 116.596 -0.274 . . . . 5.25 111.585 -175.149 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 104' ' ' ILE . . . . . . . . . . . . . 84.8 mt -78.77 -63.2 1.16 Allowed 'Isoleucine or valine' 0 CA--C 1.532 0.273 0 N-CA-C 108.128 -1.064 . . . . 8.45 108.128 176.313 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER 58.85 83.99 0.12 Allowed 'General case' 0 CA--C 1.533 0.324 0 C-N-CA 125.942 1.697 . . . . 8.65 113.305 177.39 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 51.1 m . . . . . 0 C--O 1.247 0.973 0 C-N-CA 128.358 2.663 . . . . 8.39 107.614 -178.422 . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.471 1.026 0 N-CA-C 108.948 -1.661 . . . . 13.61 108.948 . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 67.7 m -118.99 -176.09 3.04 Favored 'General case' 0 C--N 1.332 -0.194 0 N-CA-C 107.956 -1.127 . . . . 12.96 107.956 174.856 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 30.2 ttmt -130.93 -42.54 1.11 Allowed 'General case' 0 C--O 1.226 -0.157 0 C-N-CA 122.494 0.318 . . . . 16.84 110.86 -171.612 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -87.96 -174.23 47.87 Favored Glycine 0 C--N 1.334 0.424 0 N-CA-C 109.601 -1.4 . . . . 12.64 109.601 164.501 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 31.7 m -77.15 -159.59 0.04 OUTLIER 'Isoleucine or valine' 0 N--CA 1.446 -0.672 0 N-CA-C 109.142 -0.688 . . . . 12.97 109.142 169.102 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 28.6 mt-10 -103.16 111.24 23.51 Favored 'General case' 0 N--CA 1.447 -0.591 0 CA-C-O 121.474 0.654 . . . . 9.62 111.154 -176.653 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 1.2 mm? -96.33 34.76 1.56 Allowed 'General case' 0 N--CA 1.455 -0.209 0 C-N-CA 122.881 0.473 . . . . 8.3 109.741 -173.804 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 14.7 mtp85 68.84 -71.76 0.11 Allowed 'General case' 0 C--O 1.219 -0.509 0 C-N-CA 123.878 0.871 . . . . 8.18 109.253 -166.837 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 1.1 m120 -44.38 -38.61 4.09 Favored 'General case' 0 C--O 1.226 -0.158 0 N-CA-C 113.635 0.976 . . . . 2.9 113.635 177.205 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 10.3 t70 -73.23 -40.83 64.36 Favored 'General case' 0 C--O 1.225 -0.207 0 CA-C-N 118.296 0.498 . . . . 2.73 111.667 -179.752 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 4.9 t -64.7 -60.57 2.96 Favored 'General case' 0 N--CA 1.458 -0.036 0 N-CA-C 108.998 -0.741 . . . . 2.48 108.998 176.724 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . 0.421 ' HA ' ' CD1' ' A' ' 15' ' ' ILE . 1.1 mp0 -59.99 -36.75 77.85 Favored 'General case' 0 N--CA 1.451 -0.392 0 C-N-CA 124.327 1.051 . . . . 3.8 109.73 -175.215 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -60.91 -54.04 40.17 Favored Glycine 0 CA--C 1.527 0.824 0 N-CA-C 111.062 -0.815 . . . . 1.01 111.062 173.917 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 72.8 t80 -57.33 -54.89 41.66 Favored 'General case' 0 N--CA 1.455 -0.22 0 C-N-CA 123.924 0.889 . . . . 3.66 110.31 -176.344 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . 0.421 ' CD1' ' HA ' ' A' ' 12' ' ' GLU . 0.8 OUTLIER -66.29 -28.95 45.1 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.259 0 O-C-N 121.177 -0.952 . . . . 2.25 112.745 179.105 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 1.6 t-160 -58.82 -53.76 54.75 Favored 'General case' 0 C--N 1.342 0.248 0 N-CA-C 105.938 -1.875 . . . . 0.8 105.938 174.607 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 7.4 mt-10 -53.74 -43.01 68.77 Favored 'General case' 0 C--O 1.223 -0.308 0 CA-C-O 118.824 -0.607 . . . . 2.56 111.175 177.208 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 7.2 t80 -56.83 -44.94 82.58 Favored 'General case' 0 C--N 1.333 -0.137 0 CA-C-N 119.156 0.889 . . . . 3.32 111.228 178.498 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -51.49 -49.64 44.89 Favored Glycine 0 CA--C 1.524 0.645 0 N-CA-C 110.198 -1.161 . . . . 0.63 110.198 170.837 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 2.0 t60 -59.28 -44.46 92.47 Favored 'General case' 0 N--CA 1.45 -0.473 0 O-C-N 121.59 -0.947 . . . . 2.52 111.641 -178.72 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -61.29 -32.56 72.4 Favored 'General case' 0 N--CA 1.452 -0.343 0 CA-C-N 118.398 0.544 . . . . 1.58 109.849 178.212 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 3.5 t -67.16 -38.66 81.53 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.213 0 O-C-N 121.191 -0.943 . . . . 2.29 111.501 175.122 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 6.8 t0 -60.46 -27.75 67.77 Favored 'General case' 0 C--N 1.333 -0.149 0 CA-C-O 120.9 0.381 . . . . 1.99 110.702 175.02 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 13.8 t70 -65.26 -54.37 30.31 Favored 'General case' 0 N--CA 1.454 -0.253 0 N-CA-C 108.191 -1.04 . . . . 2.3 108.191 -177.137 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 10.9 t80 -59.56 -48.83 80.14 Favored 'General case' 0 CA--C 1.517 -0.32 0 CA-C-N 116.098 -0.501 . . . . 3.72 110.503 179.77 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -57.53 -39.67 77.11 Favored 'General case' 0 N--CA 1.448 -0.527 0 CA-C-O 118.646 -0.692 . . . . 2.05 111.014 -179.322 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -64.92 -59.18 8.36 Favored Glycine 0 C--O 1.223 -0.541 0 N-CA-C 109.725 -1.35 . . . . 1.69 109.725 177.767 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -47.97 -44.01 30.06 Favored 'General case' 0 CA--C 1.531 0.233 0 C-N-CA 124.942 1.297 . . . . 2.34 110.989 -174.26 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -82.96 -32.77 26.92 Favored 'General case' 0 N--CA 1.449 -0.499 0 N-CA-C 113.303 0.853 . . . . 2.11 113.303 179.537 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 13.7 mt -129.23 70.67 1.41 Allowed 'General case' 0 N--CA 1.456 -0.157 0 CA-C-N 119.115 0.87 . . . . 2.77 109.689 -166.623 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -131.65 153.3 50.11 Favored 'General case' 0 CA--C 1.518 -0.285 0 N-CA-C 108.917 -0.772 . . . . 4.66 108.917 176.305 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 4.3 ttmt -87.55 -69.55 0.68 Allowed 'General case' 0 C--O 1.226 -0.155 0 N-CA-C 108.011 -1.107 . . . . 11.61 108.011 176.909 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 56.0 t30 -160.32 149.67 17.5 Favored 'General case' 0 N--CA 1.449 -0.523 0 N-CA-C 108.373 -0.973 . . . . 7.65 108.373 169.826 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 35.8 tt0 43.53 42.8 4.22 Favored 'General case' 0 CA--C 1.537 0.476 0 C-N-CA 125.543 1.537 . . . . 8.91 113.185 167.277 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 66.1 m -144.42 46.6 1.4 Allowed 'General case' 0 C--O 1.223 -0.334 0 O-C-N 121.778 -0.576 . . . . 7.16 110.625 -176.897 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -44.12 121.19 2.39 Favored 'General case' 0 CA--C 1.531 0.23 0 C-N-CA 125.385 1.474 . . . . 4.95 113.08 -172.617 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 11.1 mp 101.52 139.33 0.01 OUTLIER 'General case' 0 N--CA 1.467 0.375 1 C-N-CA 131.715 4.006 . . . . 3.05 108.659 173.381 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 9.1 p -64.92 -31.82 55.55 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.223 0 C-N-CA 119.733 -0.787 . . . . 3.01 110.202 -175.053 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 10.3 t -53.52 -62.2 1.81 Allowed 'General case' 0 CA--C 1.537 0.471 0 C-N-CA 122.876 0.47 . . . . 4.72 111.345 -179.427 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 43.9 t30 -89.38 57.51 4.03 Favored 'General case' 0 N--CA 1.462 0.152 0 O-C-N 121.156 -0.965 . . . . 6.95 109.221 -175.121 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 23.2 t -166.84 -47.66 0.02 OUTLIER 'General case' 0 N--CA 1.454 -0.271 0 O-C-N 121.883 -0.51 . . . . 4.59 110.717 -174.465 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 7.8 tptt -55.4 121.04 8.08 Favored 'General case' 0 CA--C 1.532 0.256 0 O-C-N 121.385 -0.822 . . . . 7.83 109.26 179.877 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 24.4 mttm 56.76 -89.72 0.02 OUTLIER 'General case' 0 N--CA 1.463 0.208 0 C-N-CA 123.507 0.723 . . . . 6.98 110.139 -170.75 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 26.7 p90 -172.17 156.94 4.09 Favored 'General case' 0 N--CA 1.45 -0.461 0 C-N-CA 125.425 1.49 . . . . 9.66 107.388 -178.656 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -42.97 106.19 0.03 OUTLIER 'Isoleucine or valine' 0 CA--C 1.545 0.783 0 C-N-CA 123.842 0.857 . . . . 4.45 112.048 169.411 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 5.8 t70 -148.61 -60.04 0.23 Allowed 'General case' 0 N--CA 1.47 0.561 0 C-N-CA 124.554 1.141 . . . . 2.32 109.483 -179.891 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 47' ' ' ILE . . . . . 0.457 ' HA ' ' HE2' ' A' ' 91' ' ' LYS . 3.4 mm -50.99 -52.0 19.13 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.238 0 C-N-CA 124.989 1.316 . . . . 1.72 107.989 -179.967 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 28.5 t80 -61.82 -36.18 80.41 Favored 'General case' 0 N--CA 1.45 -0.469 0 C-N-CA 124.852 1.261 . . . . 0.45 113.665 173.845 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . 0.409 ' HA ' ' HE2' ' A' ' 49' ' ' LYS . 1.0 OUTLIER -59.54 -49.15 78.91 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 120.025 1.284 . . . . 1.94 110.926 -175.23 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 9.5 mm-40 -81.94 -64.02 1.27 Allowed 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 121.902 0.858 . . . . 2.7 109.302 178.708 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 25.6 mm-40 -75.04 -24.05 58.24 Favored 'General case' 0 C--O 1.235 0.341 0 O-C-N 121.703 -0.623 . . . . 2.82 111.208 -164.933 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -72.79 45.2 1.05 Allowed Glycine 0 N--CA 1.442 -0.956 0 C-N-CA 124.622 1.106 . . . . 0.37 112.551 168.716 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 22.2 t -153.2 32.9 0.47 Allowed 'General case' 0 N--CA 1.449 -0.492 0 O-C-N 121.147 -1.208 . . . . 3.08 109.058 151.89 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 2.2 t-20 -133.71 -45.56 0.81 Allowed 'General case' 0 CA--C 1.521 -0.171 0 CA-C-O 120.638 0.256 . . . . 2.5 111.276 -168.433 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 21.2 mt -59.86 -37.22 78.69 Favored 'General case' 0 CA--C 1.529 0.147 0 O-C-N 122.128 -0.357 . . . . 1.59 111.273 -177.275 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER 178.27 173.15 0.66 Allowed 'General case' 0 CA--C 1.533 0.294 0 C-N-CA 126.031 1.733 . . . . 1.74 107.171 -177.889 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 15.5 m -61.94 -35.08 77.38 Favored 'General case' 0 N--CA 1.455 -0.188 0 O-C-N 121.6 -0.687 . . . . 1.44 110.719 169.178 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 1.1 m-85 -69.31 -8.05 42.68 Favored 'General case' 0 N--CA 1.467 0.401 0 O-C-N 121.804 -0.56 . . . . 1.67 112.096 172.32 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -80.65 -18.39 70.77 Favored Glycine 0 N--CA 1.445 -0.72 0 N-CA-C 110.693 -0.963 . . . . 0.45 110.693 170.544 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -104.09 -16.34 15.3 Favored 'General case' 0 CA--C 1.518 -0.254 0 CA-C-N 118.719 1.259 . . . . 3.43 113.128 -176.132 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 41.6 p -64.43 -161.17 0.01 OUTLIER 'General case' 0 CA--C 1.539 0.535 0 N-CA-C 108.972 -0.751 . . . . 1.77 108.972 169.925 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 39.6 m-80 -51.47 145.53 8.57 Favored 'General case' 0 CA--C 1.53 0.21 0 O-C-N 120.369 -1.457 . . . . 2.74 111.011 -176.867 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 47.4 tt0 -60.21 -19.37 53.98 Favored 'General case' 0 CA--C 1.541 0.623 0 C-N-CA 124.223 1.009 . . . . 2.95 111.938 -177.703 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -61.24 -47.92 83.84 Favored 'General case' 0 N--CA 1.453 -0.315 0 C-N-CA 125.973 1.709 . . . . 1.61 112.022 168.688 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 5.2 mt-10 -70.39 -42.23 71.99 Favored 'General case' 0 CA--C 1.51 -0.587 0 O-C-N 121.548 -0.72 . . . . 1.7 111.036 177.935 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 63.6 t80 -45.89 -53.26 10.12 Favored 'General case' 0 N--CA 1.45 -0.45 0 C-N-CA 123.397 0.679 . . . . 0.46 110.896 172.385 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 82.0 t80 -64.35 -41.14 96.9 Favored 'General case' 0 CA--C 1.534 0.332 0 O-C-N 122.131 -0.356 . . . . 1.28 111.62 176.523 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -61.38 -50.56 72.4 Favored 'General case' 0 CA--C 1.537 0.462 0 O-C-N 121.022 -1.049 . . . . 1.56 111.262 -174.935 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 5.4 mm-40 -53.69 -43.71 69.17 Favored 'General case' 0 CA--C 1.521 -0.157 0 C-N-CA 124.653 1.181 . . . . 4.17 110.466 168.524 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -55.87 -39.93 72.22 Favored 'General case' 0 N--CA 1.453 -0.3 0 CA-C-N 118.487 0.585 . . . . 1.74 110.214 179.437 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 2.7 t80 -65.04 -51.59 60.64 Favored 'General case' 0 CA--C 1.53 0.2 0 CA-C-N 119.239 0.927 . . . . 3.34 110.921 175.247 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 12.5 ttt180 -43.72 -56.87 3.52 Favored 'General case' 0 N--CA 1.469 0.499 0 C-N-CA 123.849 0.86 . . . . 3.41 110.558 177.134 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -59.67 -52.91 63.5 Favored 'General case' 0 N--CA 1.452 -0.371 0 C-N-CA 125.664 1.585 . . . . 1.85 109.819 179.679 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 0.6 OUTLIER -58.26 -37.57 75.22 Favored 'General case' 0 CA--C 1.531 0.22 0 CA-C-N 118.94 0.791 . . . . 3.46 111.899 -171.667 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 2.6 p80 -85.49 -14.9 44.59 Favored 'General case' 0 N--CA 1.461 0.091 0 CA-C-O 118.356 -0.83 . . . . 1.6 111.735 -179.849 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 1.1 t -56.5 117.05 3.48 Favored 'General case' 0 N--CA 1.443 -0.809 0 N-CA-C 106.616 -1.624 . . . . 2.45 106.616 -174.65 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -53.39 -32.83 51.31 Favored 'General case' 0 C--N 1.319 -0.757 0 CA-C-N 115.351 -0.84 . . . . 3.72 110.997 -178.838 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 24.4 t0 -55.51 106.26 0.23 Allowed 'General case' 0 N--CA 1.447 -0.584 0 CA-C-O 122.73 1.252 . . . . 2.03 110.247 165.312 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 32.7 m80 -63.12 -29.31 70.7 Favored 'General case' 0 N--CA 1.449 -0.514 0 CA-C-N 115.151 -0.931 . . . . 6.82 110.189 178.985 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -59.81 -56.69 18.66 Favored 'General case' 0 N--CA 1.448 -0.557 0 CA-C-N 119.093 0.86 . . . . 1.63 109.714 177.323 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -43.47 -47.62 7.13 Favored 'General case' 0 C--O 1.232 0.15 0 C-N-CA 124.98 1.312 . . . . 2.78 110.778 179.13 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 35.8 mtp180 -63.83 -54.14 39.64 Favored 'General case' 0 N--CA 1.451 -0.407 0 CA-C-N 114.857 -1.065 . . . . 3.1 110.036 -177.721 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -63.35 -17.67 62.84 Favored 'General case' 0 N--CA 1.45 -0.46 0 CA-C-O 117.97 -1.014 . . . . 2.1 112.603 176.439 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 2.0 mptm? -66.39 -46.64 75.93 Favored 'General case' 0 CA--C 1.516 -0.329 0 CA-C-N 121.29 1.859 . . . . 2.2 107.731 169.066 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 56.4 t -56.36 -50.93 69.62 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.657 0 CA-C-O 117.607 -1.187 . . . . 2.12 109.822 174.7 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 1.9 mt-30 -59.12 -57.23 13.96 Favored 'General case' 0 N--CA 1.466 0.374 0 CA-C-N 121.475 1.943 . . . . 2.85 112.304 -178.684 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 11.4 tttm -57.25 -38.27 73.6 Favored 'General case' 0 C--N 1.329 -0.292 0 C-N-CA 123.41 0.684 . . . . 3.32 111.602 -175.116 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 17.0 m-80 -84.51 -20.88 30.92 Favored 'General case' 0 C--O 1.222 -0.372 0 CA-C-O 118.476 -0.774 . . . . 3.12 110.705 179.387 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -144.68 81.48 10.93 Favored Pre-proline 0 C--O 1.237 0.403 0 C-N-CA 125.417 1.487 . . . . 1.33 109.907 -174.152 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 84.5 Cg_endo -78.53 35.35 0.54 Allowed 'Trans proline' 0 CA--C 1.54 0.805 0 C-N-CA 123.509 2.806 . . . . 1.82 112.476 -175.205 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 91' ' ' LYS . . . . . 0.457 ' HE2' ' HA ' ' A' ' 47' ' ' ILE . 14.4 ptmt -149.87 -52.41 0.15 Allowed 'General case' 0 N--CA 1.454 -0.232 0 C-N-CA 125.72 1.608 . . . . 3.71 109.628 -179.655 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 3.3 m -50.36 -47.21 56.17 Favored 'General case' 0 N--CA 1.462 0.149 0 O-C-N 121.419 -0.801 . . . . 1.7 111.379 178.2 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 16.6 t80 -58.64 -49.28 78.12 Favored 'General case' 0 CA--C 1.508 -0.659 0 C-N-CA 120.277 -0.569 . . . . 3.03 112.095 -177.901 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 39.8 tt0 -53.02 -36.57 60.66 Favored 'General case' 0 N--CA 1.446 -0.647 0 CA-C-N 115.115 -0.948 . . . . 1.81 109.507 -179.88 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -60.61 -59.87 4.7 Favored 'General case' 0 N--CA 1.45 -0.43 0 C-N-CA 123.296 0.639 . . . . 1.47 109.424 -178.455 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 23.4 mm -47.98 -46.59 12.61 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.249 0 C-N-CA 124.01 0.924 . . . . 2.89 110.428 175.728 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 1.4 t30 -61.21 -35.29 76.81 Favored 'General case' 0 CA--C 1.53 0.186 0 C-N-CA 123.413 0.685 . . . . 2.0 111.175 -176.969 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 35.7 t0 -61.81 -62.22 1.95 Allowed 'General case' 0 CA--C 1.52 -0.2 0 C-N-CA 124.152 0.981 . . . . 2.14 108.855 174.919 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 20.8 pt20 -90.93 73.75 6.47 Favored 'General case' 0 N--CA 1.446 -0.659 0 C-N-CA 120.227 -0.589 . . . . 6.08 111.08 -171.055 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 25.9 pt -48.23 -44.43 12.63 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.352 0 C-N-CA 123.072 0.549 . . . . 5.08 111.437 -176.305 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 4.5 mmtm 59.41 154.64 0.02 OUTLIER 'General case' 0 C--O 1.224 -0.272 0 C-N-CA 126.952 2.101 . . . . 10.52 113.06 -176.375 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 102' ' ' PHE . . . . . . . . . . . . . 30.1 p90 -162.76 48.58 0.16 Allowed 'General case' 0 N--CA 1.453 -0.317 0 CA-C-N 115.0 -1.0 . . . . 9.01 108.589 -170.797 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 12.6 tt -51.63 -43.05 31.8 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.389 0 O-C-N 121.62 -0.675 . . . . 5.66 110.33 179.435 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 104' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -149.18 132.59 7.6 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.764 0 N-CA-C 105.326 -2.101 . . . . 6.43 105.326 171.97 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 4.0 t-20 69.47 175.71 0.28 Allowed 'General case' 0 CA--C 1.533 0.312 0 C-N-CA 124.722 1.209 . . . . 8.23 112.121 178.843 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 30.7 m . . . . . 0 C--O 1.251 1.156 0 C-N-CA 126.164 1.786 . . . . 11.75 108.177 175.294 . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.471 1.025 0 N-CA-C 110.2 -1.16 . . . . 19.6 110.2 . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -160.65 167.65 26.55 Favored 'General case' 0 CA--C 1.529 0.141 0 CA-C-N 118.703 1.252 . . . . 19.46 108.806 177.499 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 4.2 ptpt -168.13 159.81 11.3 Favored 'General case' 0 N--CA 1.464 0.243 0 C-N-CA 125.192 1.397 . . . . 25.55 107.741 175.397 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 138.0 -131.48 5.46 Favored Glycine 0 C--N 1.333 0.363 0 N-CA-C 109.736 -1.346 . . . . 17.71 109.736 175.985 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 27.7 m -72.46 -161.59 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.447 -0.612 0 C-N-CA 123.057 0.543 . . . . 16.91 109.577 172.423 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 11.2 pt-20 -80.31 121.96 26.31 Favored 'General case' 0 N--CA 1.449 -0.498 0 O-C-N 121.13 -0.981 . . . . 10.75 111.529 177.134 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 3.2 mt -122.35 34.52 5.13 Favored 'General case' 0 N--CA 1.452 -0.364 0 N-CA-C 107.875 -1.157 . . . . 12.16 107.875 -175.852 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 81.9 mtt180 65.07 44.29 3.43 Favored 'General case' 0 C--O 1.225 -0.199 0 C-N-CA 124.982 1.313 . . . . 10.63 111.679 -173.123 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 2.5 m-20 -47.82 -41.79 24.66 Favored 'General case' 0 CA--C 1.515 -0.388 0 C-N-CA 124.618 1.167 . . . . 3.77 113.752 178.526 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 29.5 t70 -57.32 -50.78 71.86 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 118.226 0.466 . . . . 2.45 110.201 178.684 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 74.4 m -63.1 -51.79 65.18 Favored 'General case' 0 N--CA 1.452 -0.352 0 C-N-CA 122.927 0.491 . . . . 2.49 111.288 178.828 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 11.0 mt-10 -59.37 -37.18 77.28 Favored 'General case' 0 N--CA 1.455 -0.197 0 C-N-CA 123.071 0.548 . . . . 3.85 110.507 -176.029 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -59.33 -58.99 11.49 Favored Glycine 0 CA--C 1.527 0.834 0 N-CA-C 110.256 -1.137 . . . . 0.8 110.256 171.623 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 25.5 t80 -55.38 -51.44 66.8 Favored 'General case' 0 N--CA 1.454 -0.239 0 C-N-CA 124.032 0.933 . . . . 3.43 111.487 -173.216 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 0.7 OUTLIER -66.02 -32.34 57.68 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.217 0 O-C-N 121.232 -0.918 . . . . 1.48 111.934 179.001 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 3.4 t60 -58.4 -52.28 66.29 Favored 'General case' 0 C--N 1.342 0.279 0 N-CA-C 106.993 -1.484 . . . . 0.72 106.993 176.064 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 44.7 mt-10 -57.47 -41.49 80.74 Favored 'General case' 0 N--CA 1.454 -0.258 0 CA-C-O 118.69 -0.671 . . . . 2.01 111.108 179.298 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -51.66 -47.29 63.84 Favored 'General case' 0 N--CA 1.464 0.269 0 CA-C-N 119.126 0.875 . . . . 4.32 111.72 175.396 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -48.0 -49.91 22.61 Favored Glycine 0 CA--C 1.528 0.895 0 N-CA-C 110.482 -1.047 . . . . 0.46 110.482 174.328 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 1.7 t-160 -62.11 -40.64 96.59 Favored 'General case' 0 N--CA 1.451 -0.408 0 O-C-N 122.033 -0.687 . . . . 2.67 111.817 178.701 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -60.5 -32.5 71.5 Favored 'General case' 0 N--CA 1.454 -0.244 0 O-C-N 121.002 -1.061 . . . . 1.57 109.971 179.452 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 58.0 t -70.67 -34.43 56.84 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.222 0 O-C-N 121.293 -0.879 . . . . 1.82 111.142 178.041 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 80.0 m-20 -59.86 -29.45 68.3 Favored 'General case' 0 N--CA 1.468 0.441 0 CA-C-N 118.744 0.702 . . . . 2.42 111.33 172.205 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 17.9 t70 -68.45 -48.05 65.56 Favored 'General case' 0 N--CA 1.452 -0.34 0 N-CA-C 108.643 -0.873 . . . . 1.99 108.643 -174.756 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 18.4 t80 -55.53 -46.75 77.02 Favored 'General case' 0 N--CA 1.453 -0.313 0 CA-C-N 115.658 -0.701 . . . . 3.73 110.298 173.325 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -58.93 -28.95 66.72 Favored 'General case' 0 C--O 1.22 -0.476 0 CA-C-O 118.585 -0.722 . . . . 2.13 112.439 176.879 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -71.77 -25.41 75.04 Favored Glycine 0 CA--C 1.525 0.687 0 CA-C-N 119.429 1.013 . . . . 1.7 112.497 179.217 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 1.0 OUTLIER -91.95 -43.82 9.24 Favored 'General case' 0 CA--C 1.53 0.209 0 O-C-N 121.92 -0.753 . . . . 2.86 111.175 -179.828 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -78.66 -38.37 39.66 Favored 'General case' 0 CA--C 1.512 -0.505 0 C-N-CA 124.227 1.011 . . . . 2.5 112.169 -176.666 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 7.9 mt -113.7 175.84 5.29 Favored 'General case' 0 N--CA 1.441 -0.892 0 N-CA-C 104.872 -2.27 . . . . 2.6 104.872 179.326 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 65.4 m-20 63.39 124.91 0.01 OUTLIER 'General case' 0 CA--C 1.536 0.422 0 CA-C-O 123.436 1.588 . . . . 4.96 112.113 -179.239 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 65.0 mttt -92.7 50.15 1.55 Allowed 'General case' 0 N--CA 1.464 0.249 0 O-C-N 119.047 -2.283 . . . . 8.52 110.541 -164.453 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 2.1 t30 -161.86 103.07 1.16 Allowed 'General case' 0 N--CA 1.451 -0.415 0 C-N-CA 125.409 1.484 . . . . 7.35 107.937 -179.349 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 10.7 mp0 -50.81 -41.93 57.85 Favored 'General case' 0 N--CA 1.466 0.326 0 CA-C-N 119.065 0.848 . . . . 13.48 112.752 -173.127 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 18.8 m -83.43 63.2 7.18 Favored 'General case' 0 N--CA 1.454 -0.265 0 O-C-N 121.717 -0.614 . . . . 10.04 110.224 -179.617 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 8.6 t0 -154.82 174.29 15.27 Favored 'General case' 0 CA--C 1.532 0.26 0 N-CA-C 108.445 -0.946 . . . . 6.13 108.445 173.934 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 3.7 mp -141.46 142.1 33.66 Favored 'General case' 0 C--O 1.234 0.266 0 N-CA-C 107.487 -1.301 . . . . 3.75 107.487 178.103 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 1.0 OUTLIER -62.91 114.63 1.7 Allowed 'Isoleucine or valine' 0 C--O 1.226 -0.17 0 N-CA-C 108.172 -1.047 . . . . 3.49 108.172 -176.537 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 9.7 p -139.46 3.22 2.1 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 121.36 0.6 . . . . 4.26 110.425 -178.894 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 9.5 m-80 -163.31 93.69 0.78 Allowed 'General case' 0 N--CA 1.453 -0.312 0 O-C-N 120.689 -1.257 . . . . 5.6 107.839 173.423 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 22.1 t -151.15 -175.26 5.09 Favored 'General case' 0 N--CA 1.452 -0.354 0 N-CA-C 108.57 -0.9 . . . . 4.11 108.57 173.427 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . 0.468 ' HE3' ' OD1' ' A' ' 98' ' ' ASP . 10.8 tmtt? 51.27 -79.49 0.01 OUTLIER 'General case' 0 N--CA 1.462 0.16 0 C-N-CA 127.68 2.392 . . . . 8.19 112.468 -176.479 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -72.82 -28.15 62.38 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-O 117.614 -1.184 . . . . 7.55 111.865 177.289 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 13.2 m-85 58.89 102.58 0.02 OUTLIER 'General case' 0 C--N 1.34 0.193 0 C-N-CA 127.023 2.129 . . . . 8.28 112.356 -173.071 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . 0.332 1.7 tt 43.92 -140.17 0.02 OUTLIER 'Isoleucine or valine' 0 CA--C 1.538 0.516 0 CA-C-O 116.511 -1.709 . . . . 4.77 109.812 -177.693 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 20.0 t70 64.28 -68.47 0.1 Allowed 'General case' 0 N--CA 1.479 0.98 0 C-N-CA 127.034 2.134 . . . . 3.03 112.517 -176.949 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 10.5 mm -38.05 -65.66 0.07 OUTLIER 'Isoleucine or valine' 0 N--CA 1.449 -0.521 0 C-N-CA 129.84 3.256 . . . . 1.71 109.912 173.453 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 24.2 t80 -64.74 -26.67 68.46 Favored 'General case' 0 N--CA 1.453 -0.3 0 O-C-N 120.98 -1.075 . . . . 0.52 112.363 179.775 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . 0.527 ' HA ' ' HE2' ' A' ' 49' ' ' LYS . 10.2 mmpt? -69.4 -47.79 63.1 Favored 'General case' 0 N--CA 1.452 -0.362 0 O-C-N 120.092 -1.63 . . . . 2.14 111.07 -176.195 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -89.31 -63.36 1.3 Allowed 'General case' 0 C--N 1.33 -0.274 0 N-CA-C 108.077 -1.082 . . . . 3.36 108.077 -177.721 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 7.8 mm-40 -67.16 -33.05 74.59 Favored 'General case' 0 CA--C 1.532 0.278 0 N-CA-C 109.193 -0.669 . . . . 2.2 109.193 -169.221 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -68.13 39.97 0.26 Allowed Glycine 0 CA--C 1.531 1.036 0 C-N-CA 125.836 1.684 . . . . 0.35 114.308 167.646 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 26.4 m -146.75 24.36 1.21 Allowed 'General case' 0 CA--C 1.533 0.29 0 O-C-N 120.771 -1.429 . . . . 3.02 110.66 154.026 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -131.14 -36.67 1.3 Allowed 'General case' 0 C--N 1.341 0.218 0 N-CA-C 113.283 0.845 . . . . 4.18 113.283 -170.81 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 32.7 mt -66.23 -35.47 80.52 Favored 'General case' 0 N--CA 1.465 0.281 0 CA-C-N 119.383 0.992 . . . . 1.99 110.876 -176.873 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 1.3 t 177.98 172.87 0.62 Allowed 'General case' 0 CA--C 1.531 0.246 0 C-N-CA 125.403 1.481 . . . . 1.71 107.837 -178.438 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 6.4 m -57.91 -34.98 70.41 Favored 'General case' 0 N--CA 1.452 -0.34 0 C-N-CA 123.364 0.666 . . . . 1.37 110.544 166.851 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -65.89 -16.54 63.94 Favored 'General case' 0 CA--C 1.534 0.349 0 N-CA-C 112.253 0.464 . . . . 1.56 112.253 175.312 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -85.29 -11.48 75.44 Favored Glycine 0 N--CA 1.444 -0.776 0 N-CA-C 110.786 -0.926 . . . . 0.41 110.786 175.334 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 4.5 tmt_? -105.81 -19.88 13.62 Favored 'General case' 0 C--O 1.228 -0.062 0 CA-C-N 119.025 1.412 . . . . 4.15 112.112 179.556 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 1.6 p -59.46 -164.12 0.01 OUTLIER 'General case' 0 CA--C 1.536 0.442 0 C-N-CA 124.998 1.319 . . . . 1.99 110.723 170.88 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 50.9 t30 -54.46 149.58 10.2 Favored 'General case' 0 CA--C 1.529 0.172 0 O-C-N 120.635 -1.29 . . . . 2.94 110.158 -176.429 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 14.8 tm-20 -56.85 -39.46 74.32 Favored 'General case' 0 C--O 1.222 -0.348 0 CA-C-O 120.995 0.426 . . . . 3.57 110.24 -173.492 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -56.83 -29.18 62.56 Favored 'General case' 0 C--N 1.328 -0.333 0 N-CA-C 113.421 0.897 . . . . 1.73 113.421 178.857 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 6.2 mt-10 -76.95 -42.87 37.39 Favored 'General case' 0 N--CA 1.452 -0.365 0 O-C-N 121.085 -1.009 . . . . 2.15 110.499 175.839 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 27.8 t80 -52.51 -49.63 64.4 Favored 'General case' 0 CA--C 1.532 0.261 0 C-N-CA 125.03 1.332 . . . . 0.34 111.299 172.585 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 47.8 t80 -64.65 -47.01 80.06 Favored 'General case' 0 CA--C 1.534 0.361 0 O-C-N 120.898 -1.126 . . . . 0.6 110.239 177.031 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -57.68 -56.14 25.73 Favored 'General case' 0 CA--C 1.536 0.412 0 O-C-N 121.243 -0.911 . . . . 1.48 111.927 -175.198 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -59.99 -34.0 72.74 Favored 'General case' 0 CA--C 1.53 0.208 0 C-N-CA 123.713 0.805 . . . . 3.7 111.7 174.384 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -56.27 -46.19 79.81 Favored 'General case' 0 C--O 1.221 -0.443 0 CA-C-N 119.155 0.889 . . . . 1.67 109.856 172.211 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 2.2 t80 -55.73 -49.02 74.18 Favored 'General case' 0 N--CA 1.463 0.202 0 CA-C-N 119.355 0.979 . . . . 4.35 111.371 179.539 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 32.6 ttt180 -47.93 -59.67 3.17 Favored 'General case' 0 N--CA 1.466 0.363 0 N-CA-C 109.419 -0.585 . . . . 2.96 109.419 174.04 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -63.1 -30.62 71.73 Favored 'General case' 0 C--N 1.33 -0.252 0 C-N-CA 124.594 1.158 . . . . 1.65 111.579 -175.043 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -62.92 -41.42 99.46 Favored 'General case' 0 C--N 1.328 -0.366 0 C-N-CA 124.416 1.086 . . . . 3.87 110.14 -175.282 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 7.9 p80 -95.81 -4.11 44.42 Favored 'General case' 0 N--CA 1.452 -0.342 0 CA-C-O 116.312 -1.804 . . . . 1.1 112.928 -179.19 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 3.2 m -37.73 125.74 1.15 Allowed 'General case' 0 CA--C 1.516 -0.336 0 CA-C-N 120.296 1.407 . . . . 1.66 111.645 -166.781 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -51.94 -40.57 61.02 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 113.418 -1.719 . . . . 1.91 109.38 178.987 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 14.6 t0 -72.19 110.44 6.64 Favored 'General case' 0 N--CA 1.446 -0.651 0 C-N-CA 119.357 -0.937 . . . . 1.82 109.448 163.793 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 1.8 p80 -47.44 -39.61 16.07 Favored 'General case' 0 N--CA 1.454 -0.246 0 CA-C-N 115.82 -0.627 . . . . 5.87 112.091 170.869 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -61.6 -48.3 81.56 Favored 'General case' 0 N--CA 1.452 -0.374 0 CA-C-N 118.127 0.422 . . . . 1.39 110.036 -174.873 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 32.1 mt-10 -48.17 -39.39 20.67 Favored 'General case' 0 N--CA 1.452 -0.368 0 C-N-CA 124.22 1.008 . . . . 2.75 111.644 176.588 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 4.8 mtp180 -65.64 -47.26 76.19 Favored 'General case' 0 C--N 1.326 -0.415 0 C-N-CA 119.604 -0.838 . . . . 3.59 108.878 179.545 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 1.5 mm? -61.79 -26.57 68.17 Favored 'General case' 0 N--CA 1.453 -0.285 0 CA-C-O 117.674 -1.155 . . . . 1.66 112.321 174.779 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -62.77 -42.05 99.51 Favored 'General case' 0 C--O 1.224 -0.257 0 CA-C-N 121.231 1.832 . . . . 2.04 108.329 172.773 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 56.0 t -63.41 -61.79 1.5 Allowed 'Isoleucine or valine' 0 C--O 1.22 -0.48 0 CA-C-O 117.425 -1.274 . . . . 1.5 111.148 173.273 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 3.9 mt-30 -49.33 -49.71 42.87 Favored 'General case' 0 N--CA 1.466 0.328 0 CA-C-N 121.024 1.738 . . . . 3.18 111.103 -175.258 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 37.1 tttt -56.85 -53.27 59.79 Favored 'General case' 0 N--CA 1.447 -0.606 0 C-N-CA 123.764 0.826 . . . . 2.58 111.192 178.243 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 56.1 m-20 -88.43 9.75 22.46 Favored 'General case' 0 C--N 1.332 -0.166 0 C-N-CA 122.696 0.398 . . . . 1.7 111.245 -172.986 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -164.82 68.91 1.39 Allowed Pre-proline 0 N--CA 1.446 -0.642 0 C-N-CA 124.52 1.128 . . . . 1.28 109.013 -177.385 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 93.0 Cg_endo -80.86 57.51 6.57 Favored 'Trans proline' 0 CA--C 1.535 0.535 0 C-N-CA 124.737 3.625 . . . . 2.09 111.939 -170.556 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 5.0 ptmt 174.72 -47.48 0.01 OUTLIER 'General case' 0 CA--C 1.533 0.315 0 C-N-CA 128.299 2.639 . . . . 3.09 109.847 -170.268 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 13.8 m -55.56 -45.81 77.25 Favored 'General case' 0 N--CA 1.465 0.321 0 O-C-N 121.093 -1.004 . . . . 1.7 111.067 176.627 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 29.4 t80 -55.16 -47.24 75.41 Favored 'General case' 0 CA--C 1.513 -0.462 0 CA-C-O 121.584 0.707 . . . . 3.25 110.595 176.684 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 4.3 mt-30 -57.49 -29.2 64.07 Favored 'General case' 0 N--CA 1.443 -0.783 0 CA-C-N 114.427 -1.26 . . . . 3.04 111.443 178.787 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 8.3 t80 -62.91 -55.29 27.37 Favored 'General case' 0 CA--C 1.528 0.119 0 CA-C-N 118.939 0.791 . . . . 1.52 110.093 -179.468 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 3.6 mp -61.2 -41.47 89.64 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.186 0 N-CA-C 108.34 -0.985 . . . . 2.23 108.34 177.121 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 7.0 t30 -58.93 -37.78 77.48 Favored 'General case' 0 CA--C 1.532 0.255 0 N-CA-C 111.884 0.327 . . . . 2.7 111.884 -178.125 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 98' ' ' ASP . . . . . 0.468 ' OD1' ' HE3' ' A' ' 42' ' ' LYS . 0.2 OUTLIER -61.5 -52.76 63.18 Favored 'General case' 0 C--N 1.333 -0.143 0 C-N-CA 125.729 1.611 . . . . 2.73 109.04 175.045 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 21.0 mm100 -77.89 77.64 4.4 Favored 'General case' 0 N--CA 1.454 -0.256 0 C-N-CA 122.91 0.484 . . . . 3.43 110.756 -177.553 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 2.0 pt -73.7 76.25 0.36 Allowed 'Isoleucine or valine' 0 CA--C 1.537 0.466 0 CA-C-O 123.324 1.535 . . . . 7.0 110.11 172.339 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -138.03 157.61 46.0 Favored 'General case' 0 N--CA 1.448 -0.537 0 N-CA-C 107.251 -1.388 . . . . 9.19 107.251 179.833 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 102' ' ' PHE . . . . . . . . . . . . . 28.5 p90 -153.17 171.47 18.43 Favored 'General case' 0 N--CA 1.442 -0.83 0 N-CA-C 105.994 -1.854 . . . . 7.73 105.994 -175.879 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -135.05 139.97 46.16 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.5 0 N-CA-C 104.85 -2.278 . . . . 6.09 104.85 176.001 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 104' ' ' ILE . . . . . . . . . . . . . 3.0 pt -127.49 150.93 33.74 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.294 0 N-CA-C 108.035 -1.098 . . . . 6.05 108.035 -178.425 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 35.7 t30 71.73 101.87 0.07 Allowed 'General case' 0 CA--C 1.53 0.209 0 C-N-CA 125.454 1.501 . . . . 10.87 109.956 -179.753 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 10.8 p . . . . . 0 C--O 1.247 0.957 0 CA-C-O 116.811 -1.566 . . . . 12.66 109.284 -175.005 . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.469 0.858 0 N-CA-C 109.927 -1.269 . . . . 13.96 109.927 . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 14.7 m -62.54 -82.6 0.02 OUTLIER 'General case' 0 C--O 1.226 -0.133 0 CA-C-N 118.475 1.138 . . . . 17.75 112.679 -177.784 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 29.4 ttpt -156.6 137.34 13.3 Favored 'General case' 0 N--CA 1.45 -0.427 0 N-CA-C 107.522 -1.288 . . . . 22.04 107.522 179.768 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 171.05 -176.75 44.31 Favored Glycine 0 CA--C 1.519 0.322 0 N-CA-C 109.073 -1.611 . . . . 15.77 109.073 -174.726 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 18.5 m -78.09 -160.97 0.05 OUTLIER 'Isoleucine or valine' 0 N--CA 1.45 -0.453 0 C-N-CA 122.769 0.428 . . . . 16.0 110.282 -178.405 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -78.25 110.84 13.62 Favored 'General case' 0 N--CA 1.445 -0.685 0 CA-C-O 123.049 1.404 . . . . 11.37 112.021 170.24 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -140.78 42.77 1.84 Allowed 'General case' 0 N--CA 1.447 -0.584 0 C-N-CA 125.887 1.675 . . . . 10.27 107.698 172.542 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 30.8 mtp85 69.24 36.59 2.31 Favored 'General case' 0 C--O 1.224 -0.282 0 C-N-CA 125.161 1.384 . . . . 8.07 113.088 179.016 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 37.3 m-20 -46.45 -43.55 16.67 Favored 'General case' 0 N--CA 1.468 0.436 0 N-CA-C 113.903 1.075 . . . . 3.91 113.903 -177.712 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 31.2 t70 -67.13 -44.33 80.14 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 118.011 0.369 . . . . 2.29 111.398 -178.775 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 4.2 m -64.28 -55.54 20.72 Favored 'General case' 0 CA--C 1.531 0.221 0 O-C-N 121.45 -0.781 . . . . 1.87 111.059 178.133 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 5.4 pt-20 -61.56 -37.83 85.27 Favored 'General case' 0 CA--C 1.527 0.088 0 N-CA-C 108.902 -0.777 . . . . 4.25 108.902 -176.61 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -54.73 -58.84 11.66 Favored Glycine 0 C--N 1.337 0.589 0 N-CA-C 109.281 -1.527 . . . . 1.1 109.281 173.105 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 8.5 t80 -54.96 -52.88 61.65 Favored 'General case' 0 N--CA 1.452 -0.345 0 C-N-CA 123.837 0.855 . . . . 3.82 111.122 -171.934 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 0.5 OUTLIER -67.47 -33.69 63.92 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.314 0 O-C-N 121.538 -0.726 . . . . 1.59 112.205 -179.597 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 8.2 t60 -62.21 -55.89 24.06 Favored 'General case' 0 CA--C 1.53 0.183 0 N-CA-C 107.351 -1.351 . . . . 0.71 107.351 179.558 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 41.6 mt-10 -55.03 -39.33 69.03 Favored 'General case' 0 N--CA 1.449 -0.493 0 C-N-CA 126.051 1.74 . . . . 2.32 110.823 178.222 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 36.4 t80 -56.69 -52.41 65.03 Favored 'General case' 0 C--N 1.333 -0.144 0 CA-C-N 119.222 0.919 . . . . 4.16 109.813 175.828 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -48.15 -45.61 27.17 Favored Glycine 0 CA--C 1.526 0.756 0 N-CA-C 111.498 -0.641 . . . . 0.6 111.498 172.375 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 3.0 t60 -61.67 -49.96 74.42 Favored 'General case' 0 N--CA 1.448 -0.56 0 O-C-N 121.631 -0.923 . . . . 2.7 111.456 -179.68 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -59.83 -31.7 69.97 Favored 'General case' 0 N--CA 1.449 -0.479 0 C-N-CA 123.825 0.85 . . . . 1.68 109.643 -176.592 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 93.3 t -62.88 -51.9 66.19 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.24 0 C-N-CA 120.309 -0.556 . . . . 1.77 109.844 177.409 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -65.79 -17.89 64.95 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.361 -0.381 . . . . 3.15 111.376 179.072 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 4.5 t70 -75.42 -51.0 14.1 Favored 'General case' 0 N--CA 1.451 -0.404 0 N-CA-C 107.928 -1.138 . . . . 3.49 107.928 -174.169 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -53.41 -48.86 68.34 Favored 'General case' 0 N--CA 1.453 -0.293 0 CA-C-N 114.44 -1.254 . . . . 5.31 109.369 173.32 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -54.14 -40.86 67.81 Favored 'General case' 0 N--CA 1.453 -0.276 0 C-N-CA 122.836 0.454 . . . . 1.91 111.74 178.273 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -58.03 -56.42 25.27 Favored Glycine 0 CA--C 1.522 0.483 0 N-CA-C 110.313 -1.115 . . . . 1.09 110.313 179.268 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 1.8 t80 -58.03 -40.88 81.98 Favored 'General case' 0 CA--C 1.532 0.266 0 O-C-N 122.069 -0.665 . . . . 3.06 111.386 -174.888 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 1.9 mm? -74.23 -24.93 59.39 Favored 'General case' 0 N--CA 1.447 -0.586 0 N-CA-C 113.956 1.095 . . . . 2.56 113.956 -176.919 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 26.5 mt -118.64 -155.38 0.6 Allowed 'General case' 0 CA--C 1.535 0.376 0 N-CA-C 108.379 -0.971 . . . . 3.07 108.379 -168.506 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 13.6 t0 -72.16 151.22 43.11 Favored 'General case' 0 C--O 1.231 0.117 0 N-CA-C 107.193 -1.41 . . . . 4.92 107.193 161.426 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . 0.478 ' HA ' ' HE2' ' A' ' 32' ' ' LYS . 11.7 mmpt? 93.75 83.2 0.01 OUTLIER 'General case' 0 CA--C 1.521 -0.136 0 C-N-CA 128.331 2.652 . . . . 12.07 108.586 174.328 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 48.4 t30 -137.68 151.3 48.11 Favored 'General case' 0 N--CA 1.452 -0.369 0 N-CA-C 107.453 -1.314 . . . . 10.94 107.453 179.856 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER 40.34 37.48 0.44 Allowed 'General case' 0 CA--C 1.537 0.476 0 C-N-CA 127.258 2.223 . . . . 9.58 113.746 -177.289 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 4.2 m -163.45 -56.23 0.04 OUTLIER 'General case' 0 C--O 1.226 -0.162 0 N-CA-C 108.301 -1.0 . . . . 6.61 108.301 178.366 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 4.2 m-20 -138.56 176.6 8.56 Favored 'General case' 0 N--CA 1.456 -0.174 0 C-N-CA 125.49 1.516 . . . . 7.69 107.149 -175.814 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 2.0 mm? -113.61 178.17 4.37 Favored 'General case' 0 CA--C 1.531 0.224 0 C-N-CA 124.862 1.265 . . . . 3.56 108.299 173.684 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 9.5 p -57.02 -29.19 30.76 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.541 0 CA-C-O 118.958 -0.544 . . . . 2.26 111.968 -174.805 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 8.9 t -70.34 63.43 0.25 Allowed 'General case' 0 CA--C 1.538 0.516 0 C-N-CA 124.555 1.142 . . . . 4.16 112.206 172.291 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 23.1 t-20 -158.31 -72.69 0.09 Allowed 'General case' 0 CA--C 1.533 0.317 0 O-C-N 121.079 -1.013 . . . . 6.45 108.616 176.552 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 41' ' ' SER . . . . . 0.523 ' O ' ' HE2' ' A' ' 42' ' ' LYS . 48.0 m -75.09 77.46 2.26 Favored 'General case' 0 N--CA 1.462 0.171 0 O-C-N 121.603 -0.686 . . . . 5.46 110.115 175.25 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . 0.523 ' HE2' ' O ' ' A' ' 41' ' ' SER . 8.7 mmpt? -132.29 -70.0 0.57 Allowed 'General case' 0 CA--C 1.515 -0.381 0 N-CA-C 109.03 -0.73 . . . . 8.31 109.03 -177.97 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 36.7 mttp -140.18 98.95 3.55 Favored 'General case' 0 N--CA 1.447 -0.585 0 N-CA-C 102.99 -2.967 . . . . 7.56 102.99 169.022 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 1.9 t80 -2.61 70.14 0.0 OUTLIER 'General case' 0 CA--C 1.537 0.48 0 C-N-CA 130.259 3.424 . . . . 7.61 113.614 -177.32 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 22.4 pt 28.62 73.24 0.02 OUTLIER 'Isoleucine or valine' 0 CA--C 1.541 0.603 0 C-N-CA 125.42 1.488 . . . . 3.52 113.514 -167.258 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 6.8 m-20 -97.13 -64.65 1.02 Allowed 'General case' 0 N--CA 1.464 0.267 0 N-CA-C 108.374 -0.973 . . . . 3.25 108.374 177.585 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 11.9 mm -48.18 -52.97 6.64 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.243 0 C-N-CA 125.298 1.439 . . . . 1.65 109.292 -177.743 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 33.1 t80 -64.42 -33.98 77.14 Favored 'General case' 0 N--CA 1.449 -0.487 0 N-CA-C 112.821 0.674 . . . . 0.52 112.821 179.407 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . 0.518 ' HA ' ' HE2' ' A' ' 49' ' ' LYS . 9.4 mmpt? -67.85 -46.28 72.19 Favored 'General case' 0 C--N 1.331 -0.228 0 O-C-N 119.938 -1.726 . . . . 2.36 110.669 -177.994 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 11.8 mm-40 -82.27 -65.97 0.95 Allowed 'General case' 0 N--CA 1.452 -0.359 0 N-CA-C 108.429 -0.952 . . . . 3.93 108.429 -175.887 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 3.7 mm-40 -68.44 -35.37 77.51 Favored 'General case' 0 N--CA 1.451 -0.405 0 C-N-CA 123.935 0.894 . . . . 2.95 109.432 -169.567 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -67.29 38.23 0.21 Allowed Glycine 0 CA--C 1.532 1.136 0 C-N-CA 126.286 1.898 . . . . 0.47 114.035 170.231 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 60.6 p -146.62 22.43 1.29 Allowed 'General case' 0 N--CA 1.449 -0.503 0 O-C-N 120.342 -1.681 . . . . 2.85 112.07 159.747 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -127.29 -46.17 1.5 Allowed 'General case' 0 CA--C 1.518 -0.267 0 CA-C-O 118.936 -0.554 . . . . 4.24 111.62 -176.558 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 29.2 mt -57.13 -35.97 70.11 Favored 'General case' 0 N--CA 1.467 0.395 0 CA-C-N 118.802 0.728 . . . . 1.66 110.896 -169.187 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER 179.53 175.72 0.7 Allowed 'General case' 0 C--O 1.233 0.221 0 C-N-CA 125.508 1.523 . . . . 1.54 107.203 175.233 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 7.9 m -55.86 -32.66 63.84 Favored 'General case' 0 N--CA 1.452 -0.326 0 O-C-N 121.597 -0.689 . . . . 1.59 110.582 165.15 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -63.28 -26.77 68.93 Favored 'General case' 0 C--N 1.342 0.271 0 CA-C-O 121.142 0.496 . . . . 1.59 111.828 175.304 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -75.32 -8.83 84.09 Favored Glycine 0 N--CA 1.442 -0.958 0 CA-C-O 118.24 -1.311 . . . . 0.54 111.465 176.704 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 10.9 ttt-85 -113.06 -17.21 12.48 Favored 'General case' 0 CA--C 1.522 -0.097 0 CA-C-N 119.564 1.682 . . . . 3.64 112.579 -177.493 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -61.27 -168.14 0.01 OUTLIER 'General case' 0 CA--C 1.534 0.358 0 C-N-CA 123.537 0.735 . . . . 2.17 110.115 163.503 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -47.51 148.78 1.3 Allowed 'General case' 0 N--CA 1.464 0.244 0 O-C-N 121.561 -0.712 . . . . 2.89 111.665 -174.311 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 5.0 mt-10 -55.56 -30.26 60.46 Favored 'General case' 0 CA--C 1.534 0.361 0 CA-C-O 121.285 0.564 . . . . 4.68 110.759 -179.862 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -66.18 -35.08 79.53 Favored 'General case' 0 N--CA 1.453 -0.281 0 C-N-CA 124.044 0.938 . . . . 1.78 113.056 176.484 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 6.4 mt-10 -76.27 -41.37 49.14 Favored 'General case' 0 CA--C 1.516 -0.331 0 O-C-N 121.48 -0.763 . . . . 1.89 110.626 176.943 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 50.4 t80 -50.41 -51.85 42.71 Favored 'General case' 0 N--CA 1.451 -0.395 0 C-N-CA 124.441 1.097 . . . . 0.59 110.68 170.024 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 58.0 t80 -65.79 -46.63 77.98 Favored 'General case' 0 CA--C 1.537 0.457 0 O-C-N 121.34 -0.85 . . . . 0.73 110.824 -179.472 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -61.27 -48.97 78.96 Favored 'General case' 0 CA--C 1.535 0.392 0 O-C-N 121.195 -0.94 . . . . 1.73 112.045 -175.345 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -61.96 -37.54 85.14 Favored 'General case' 0 N--CA 1.454 -0.245 0 O-C-N 121.346 -0.846 . . . . 3.58 110.58 173.487 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -55.26 -42.79 73.97 Favored 'General case' 0 C--O 1.22 -0.472 0 CA-C-N 119.009 0.822 . . . . 1.55 109.979 175.329 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -55.8 -51.11 68.57 Favored 'General case' 0 N--CA 1.466 0.339 0 CA-C-N 119.263 0.938 . . . . 5.22 112.147 172.464 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 23.3 ttt180 -50.88 -57.14 9.23 Favored 'General case' 0 CA--C 1.535 0.374 0 N-CA-C 109.409 -0.589 . . . . 3.01 109.409 179.007 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -66.37 -28.42 68.64 Favored 'General case' 0 C--N 1.326 -0.423 0 C-N-CA 125.128 1.371 . . . . 1.77 111.686 -177.197 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 2.1 ttp -64.66 -36.45 84.32 Favored 'General case' 0 N--CA 1.452 -0.372 0 O-C-N 121.98 -0.45 . . . . 3.9 109.971 -178.832 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 26.2 p80 -88.04 -39.85 14.31 Favored 'General case' 0 N--CA 1.452 -0.369 0 CA-C-O 115.827 -2.035 . . . . 1.31 110.591 -178.977 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 21.9 m -5.51 113.37 0.01 OUTLIER 'General case' 0 C--N 1.346 0.443 0 C-N-CA 128.254 2.621 . . . . 1.72 114.361 -171.403 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 3.0 p -47.07 -44.61 21.09 Favored 'General case' 0 N--CA 1.451 -0.401 0 C-N-CA 124.975 1.31 . . . . 2.11 110.27 179.692 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 9.9 t0 -65.86 106.58 1.58 Allowed 'General case' 0 N--CA 1.449 -0.482 0 CA-C-O 121.827 0.822 . . . . 1.91 109.141 166.105 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 54.8 m170 -57.11 -33.04 66.93 Favored 'General case' 0 N--CA 1.454 -0.27 0 CA-C-O 118.974 -0.536 . . . . 6.81 111.04 177.667 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -59.65 -46.74 88.1 Favored 'General case' 0 N--CA 1.45 -0.451 0 CA-C-N 118.713 0.688 . . . . 1.54 110.397 -179.743 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 5.7 mt-10 -48.71 -41.64 32.47 Favored 'General case' 0 C--O 1.232 0.148 0 C-N-CA 123.901 0.88 . . . . 2.68 111.008 176.952 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -64.37 -47.52 78.97 Favored 'General case' 0 C--N 1.329 -0.31 0 N-CA-C 108.518 -0.919 . . . . 4.14 108.518 179.123 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 1.3 mm? -64.99 -18.9 65.69 Favored 'General case' 0 N--CA 1.453 -0.285 0 CA-C-O 117.119 -1.419 . . . . 1.74 113.087 175.573 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -63.69 -49.83 71.61 Favored 'General case' 0 CA--C 1.519 -0.24 0 CA-C-N 122.077 2.217 . . . . 2.48 107.034 167.516 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 58.9 t -55.07 -41.33 58.75 Favored 'Isoleucine or valine' 0 C--O 1.214 -0.776 0 CA-C-O 118.486 -0.768 . . . . 1.74 110.846 175.747 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 2.2 tm0? -77.94 -47.61 18.2 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 120.434 1.47 . . . . 3.76 111.844 -171.027 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 20.8 ttmt -54.58 -49.29 70.75 Favored 'General case' 0 C--O 1.226 -0.137 0 O-C-N 121.6 -0.688 . . . . 3.26 109.905 175.721 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 17.2 m120 -72.73 -41.3 65.32 Favored 'General case' 0 C--O 1.225 -0.213 0 CA-C-O 119.703 -0.189 . . . . 3.37 111.159 -177.728 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -129.56 75.62 79.64 Favored Pre-proline 0 C--O 1.238 0.478 0 C-N-CA 125.832 1.653 . . . . 1.65 110.236 -173.509 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 27.2 Cg_endo -59.58 -33.28 96.92 Favored 'Trans proline' 0 N--CA 1.446 -1.284 0 C-N-CA 121.341 1.361 . . . . 2.02 110.288 -177.244 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 9.1 tttp -80.44 -51.6 8.63 Favored 'General case' 0 N--CA 1.45 -0.47 0 C-N-CA 125.177 1.391 . . . . 5.97 111.13 -173.524 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 5.7 m -54.19 -42.77 70.09 Favored 'General case' 0 N--CA 1.469 0.523 0 CA-C-N 119.378 0.99 . . . . 1.57 110.801 -179.53 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 21.0 t80 -57.52 -47.14 82.78 Favored 'General case' 0 CA--C 1.509 -0.626 0 CA-C-O 121.19 0.519 . . . . 3.22 111.644 179.32 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 21.0 tt0 -56.03 -36.18 67.71 Favored 'General case' 0 N--CA 1.443 -0.798 0 CA-C-N 115.02 -0.991 . . . . 2.27 109.929 178.993 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 9.1 t80 -66.45 -53.59 33.74 Favored 'General case' 0 N--CA 1.455 -0.187 0 C-N-CA 124.158 0.983 . . . . 1.28 110.275 -176.175 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 44.3 mm -59.4 -42.19 86.79 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.209 0 O-C-N 121.828 -0.545 . . . . 2.91 109.78 179.083 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 9.2 m-20 -58.36 -36.19 73.09 Favored 'General case' 0 CA--C 1.528 0.127 0 O-C-N 122.128 -0.357 . . . . 3.09 111.306 177.96 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 1.6 t0 -57.91 -54.75 43.34 Favored 'General case' 0 CA--C 1.53 0.188 0 CA-C-O 121.963 0.887 . . . . 2.01 109.327 177.466 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 25.6 mm100 -86.37 93.52 9.13 Favored 'General case' 0 N--CA 1.452 -0.325 0 O-C-N 121.601 -0.687 . . . . 3.5 110.393 -175.96 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 4.7 pt -53.51 151.37 1.3 Allowed 'Isoleucine or valine' 0 CA--C 1.534 0.353 0 CA-C-O 122.467 1.127 . . . . 5.88 112.938 -178.191 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 20.5 pttp -87.99 103.63 15.88 Favored 'General case' 0 N--CA 1.453 -0.279 0 O-C-N 121.661 -0.649 . . . . 12.0 110.286 -179.822 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 102' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -152.47 117.1 5.04 Favored 'General case' 0 N--CA 1.454 -0.23 0 N-CA-C 106.947 -1.501 . . . . 8.12 106.947 168.153 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 2.9 tp -152.31 150.51 12.86 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.516 0 N-CA-C 107.386 -1.339 . . . . 4.5 107.386 176.356 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 104' ' ' ILE . . . . . . . . . . . . . 2.4 pp -70.91 164.39 3.25 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.203 0 N-CA-C 109.87 -0.419 . . . . 8.84 109.87 178.848 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -131.79 164.7 25.45 Favored 'General case' 0 C--N 1.332 -0.153 0 N-CA-C 108.305 -0.998 . . . . 9.15 108.305 179.972 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 11.1 t . . . . . 0 C--O 1.251 1.183 0 CA-C-O 115.05 -2.405 . . . . 13.64 110.87 -171.461 . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.471 0.971 0 CA-C-O 119.867 -0.407 . . . . 15.6 112.308 . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 63.7 m -148.85 -66.76 0.23 Allowed 'General case' 0 CA--C 1.522 -0.12 0 CA-C-N 118.983 1.391 . . . . 17.96 108.007 172.452 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -170.51 -90.42 0.01 OUTLIER 'General case' 0 N--CA 1.452 -0.358 0 N-CA-C 106.675 -1.602 . . . . 17.78 106.675 171.84 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 81.28 -176.43 54.45 Favored Glycine 0 CA--C 1.521 0.42 0 N-CA-C 109.318 -1.513 . . . . 17.49 109.318 -167.444 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -75.38 -172.84 0.13 Allowed 'Isoleucine or valine' 0 CA--C 1.533 0.314 0 C-N-CA 123.385 0.674 . . . . 18.38 111.026 178.304 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -94.48 111.64 23.39 Favored 'General case' 0 N--CA 1.445 -0.678 0 CA-C-O 123.342 1.544 . . . . 12.97 111.968 179.962 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -147.87 62.13 1.13 Allowed 'General case' 0 N--CA 1.441 -0.902 0 C-N-CA 126.081 1.752 . . . . 12.35 106.395 171.07 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER 57.78 46.68 16.69 Favored 'General case' 0 C--O 1.226 -0.145 0 CA-C-N 114.963 -1.017 . . . . 7.86 111.183 179.559 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -51.09 -34.34 29.98 Favored 'General case' 0 C--O 1.217 -0.613 0 C-N-CA 123.235 0.614 . . . . 5.2 111.9 179.441 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 2.1 t70 -59.78 -55.88 28.72 Favored 'General case' 0 N--CA 1.447 -0.577 0 C-N-CA 124.062 0.945 . . . . 2.54 111.869 174.307 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 9.2 t -72.09 -48.16 46.02 Favored 'General case' 0 C--N 1.33 -0.245 0 O-C-N 121.849 -0.532 . . . . 2.71 109.843 -170.434 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -69.05 -31.18 69.77 Favored 'General case' 0 C--O 1.221 -0.426 0 N-CA-C 107.306 -1.368 . . . . 5.72 107.306 178.176 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -60.78 -50.55 66.32 Favored Glycine 0 C--O 1.22 -0.725 0 N-CA-C 110.473 -1.051 . . . . 1.35 110.473 178.961 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -51.86 -57.86 8.15 Favored 'General case' 0 C--N 1.333 -0.118 0 CA-C-N 118.565 1.183 . . . . 4.42 110.884 -177.683 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER -67.09 -33.46 63.35 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.434 0 O-C-N 121.99 -0.443 . . . . 1.72 111.314 -176.733 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 3.7 t-160 -62.63 -52.95 61.35 Favored 'General case' 0 N--CA 1.45 -0.472 0 N-CA-C 107.584 -1.265 . . . . 1.52 107.584 -178.765 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 20.2 mt-10 -60.51 -34.51 74.19 Favored 'General case' 0 N--CA 1.45 -0.456 0 C-N-CA 124.244 1.018 . . . . 2.83 110.566 179.132 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -52.3 -54.03 36.61 Favored 'General case' 0 CA--C 1.517 -0.29 0 CA-C-N 119.288 0.949 . . . . 3.53 110.512 171.429 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -47.63 -50.29 19.63 Favored Glycine 0 C--N 1.336 0.535 0 N-CA-C 110.277 -1.129 . . . . 0.76 110.277 172.459 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 1.8 t-160 -62.26 -35.96 80.57 Favored 'General case' 0 N--CA 1.452 -0.341 0 O-C-N 121.918 -0.754 . . . . 2.88 112.676 -177.555 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -65.68 -32.2 73.64 Favored 'General case' 0 N--CA 1.45 -0.475 0 CA-C-N 119.068 0.849 . . . . 2.37 109.194 178.291 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 17.6 t -66.08 -38.64 82.46 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.239 0 C-N-CA 118.14 -1.424 . . . . 2.5 111.417 173.975 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 11.7 t70 -57.15 -32.62 66.58 Favored 'General case' 0 N--CA 1.464 0.267 0 CA-C-O 121.863 0.84 . . . . 2.54 110.647 173.689 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 36.8 t0 -70.78 -50.21 38.3 Favored 'General case' 0 N--CA 1.448 -0.556 0 N-CA-C 107.93 -1.137 . . . . 2.13 107.93 -172.634 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 71.1 t80 -56.89 -50.81 71.39 Favored 'General case' 0 CA--C 1.52 -0.207 0 O-C-N 122.184 -0.322 . . . . 5.45 110.576 178.23 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -55.26 -39.38 69.73 Favored 'General case' 0 N--CA 1.449 -0.479 0 C-N-CA 120.645 -0.422 . . . . 2.44 110.874 -178.045 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -68.85 -50.63 34.23 Favored Glycine 0 C--N 1.334 0.468 0 N-CA-C 110.93 -0.868 . . . . 1.14 110.93 179.597 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -47.34 -46.51 25.61 Favored 'General case' 0 N--CA 1.454 -0.232 0 C-N-CA 124.933 1.293 . . . . 2.92 110.738 -178.607 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -75.58 -38.84 58.86 Favored 'General case' 0 N--CA 1.447 -0.588 0 C-N-CA 124.653 1.181 . . . . 2.88 112.567 178.648 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 13.8 mt -110.0 57.62 0.61 Allowed 'General case' 0 N--CA 1.448 -0.542 0 N-CA-C 106.783 -1.562 . . . . 3.5 106.783 -172.43 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -61.22 152.68 28.22 Favored 'General case' 0 C--O 1.235 0.327 0 CA-C-O 121.856 0.836 . . . . 6.82 110.893 -165.328 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -141.47 76.46 1.55 Allowed 'General case' 0 N--CA 1.446 -0.638 0 C-N-CA 119.896 -0.722 . . . . 8.03 109.356 172.289 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 40.8 t30 36.35 77.14 0.04 OUTLIER 'General case' 0 N--CA 1.464 0.234 0 C-N-CA 125.928 1.691 . . . . 8.15 112.646 171.191 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 3.7 tm0? 95.12 -19.21 0.07 Allowed 'General case' 0 N--CA 1.467 0.384 0 C-N-CA 127.511 2.324 . . . . 9.32 111.183 179.2 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 40.4 m -71.24 98.4 1.72 Allowed 'General case' 0 N--CA 1.456 -0.166 0 O-C-N 121.523 -0.735 . . . . 5.52 109.887 173.974 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 27.3 m-20 -66.46 -38.47 87.42 Favored 'General case' 0 N--CA 1.464 0.238 0 C-N-CA 123.902 0.881 . . . . 7.37 111.116 174.87 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 3.0 mp -111.53 159.52 18.04 Favored 'General case' 0 C--N 1.339 0.114 0 C-N-CA 124.056 0.942 . . . . 3.33 108.643 -174.549 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 8.0 p -77.33 17.74 0.15 Allowed 'Isoleucine or valine' 0 N--CA 1.468 0.47 0 CA-C-N 118.651 0.66 . . . . 3.19 112.254 -179.44 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 9.5 t -66.53 162.57 20.51 Favored 'General case' 0 N--CA 1.444 -0.75 0 O-C-N 121.171 -0.955 . . . . 4.86 109.996 174.281 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 41.8 t-20 63.2 -79.46 0.03 OUTLIER 'General case' 0 CA--C 1.533 0.324 0 C-N-CA 125.837 1.655 . . . . 8.6 111.628 175.245 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 69.2 m -72.27 81.94 1.02 Allowed 'General case' 0 N--CA 1.452 -0.343 0 C-N-CA 123.504 0.722 . . . . 7.76 111.187 177.054 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 7.8 tmtt? -134.66 -66.44 0.6 Allowed 'General case' 0 C--O 1.226 -0.169 0 N-CA-C 108.671 -0.862 . . . . 6.62 108.671 166.935 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . 0.45 ' O ' ' HE2' ' A' ' 43' ' ' LYS . 0.2 OUTLIER -152.74 61.84 0.8 Allowed 'General case' 0 C--O 1.223 -0.293 0 N-CA-C 108.608 -0.886 . . . . 7.29 108.608 179.841 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 34.3 m-85 41.42 41.86 1.69 Allowed 'General case' 0 N--CA 1.468 0.464 0 C-N-CA 124.08 0.952 . . . . 6.99 111.951 -172.407 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER 37.12 42.89 0.23 Allowed 'Isoleucine or valine' 0 CA--C 1.546 0.793 0 C-N-CA 125.067 1.347 . . . . 5.33 112.709 -177.99 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 5.0 t70 -57.56 -46.65 83.69 Favored 'General case' 0 N--CA 1.464 0.271 0 C-N-CA 127.653 2.381 . . . . 2.31 111.445 -176.248 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 6.1 mm -58.6 -54.42 33.57 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.402 0 CA-C-N 115.046 -0.979 . . . . 1.96 108.547 179.14 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 28.8 t80 -60.9 -28.95 69.28 Favored 'General case' 0 C--O 1.226 -0.182 0 C-N-CA 124.967 1.307 . . . . 0.62 111.86 176.758 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . 0.417 ' CA ' ' HE2' ' A' ' 49' ' ' LYS . 0.1 OUTLIER -66.48 -46.86 74.88 Favored 'General case' 0 N--CA 1.453 -0.324 0 O-C-N 120.854 -1.154 . . . . 2.26 110.191 -172.643 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 6.4 tp10 -84.0 -57.72 3.08 Favored 'General case' 0 N--CA 1.451 -0.412 0 CA-C-O 121.903 0.859 . . . . 2.31 108.984 -179.712 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 20.6 mm-40 -82.62 -20.83 35.62 Favored 'General case' 0 C--O 1.234 0.279 0 O-C-N 121.631 -0.668 . . . . 2.65 111.385 -165.132 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -73.13 41.97 0.93 Allowed Glycine 0 CA--C 1.529 0.953 0 C-N-CA 124.729 1.157 . . . . 0.42 113.365 172.116 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 27.9 m -152.69 33.93 0.49 Allowed 'General case' 0 N--CA 1.453 -0.318 0 C-N-CA 126.57 1.948 . . . . 2.81 107.789 160.508 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 9.7 t-20 -144.73 -38.72 0.27 Allowed 'General case' 0 C--N 1.341 0.213 0 N-CA-C 113.242 0.83 . . . . 3.11 113.242 -161.928 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 16.2 mt -72.01 -38.59 69.58 Favored 'General case' 0 C--N 1.33 -0.257 0 O-C-N 122.236 -0.29 . . . . 1.78 110.947 179.167 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 4.4 t 171.03 172.72 0.07 Allowed 'General case' 0 N--CA 1.467 0.377 0 C-N-CA 125.579 1.551 . . . . 1.68 108.709 -171.412 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 7.6 m -61.56 -36.49 80.78 Favored 'General case' 0 N--CA 1.455 -0.224 0 C-N-CA 124.228 1.011 . . . . 1.81 111.037 172.587 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -65.86 -17.8 64.9 Favored 'General case' 0 CA--C 1.535 0.377 0 CA-C-N 118.107 0.412 . . . . 2.06 111.456 173.818 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -78.8 -12.81 83.79 Favored Glycine 0 N--CA 1.443 -0.85 0 CA-C-O 118.938 -0.923 . . . . 0.55 111.31 174.512 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 4.2 tmt_? -110.08 -15.6 13.99 Favored 'General case' 0 CA--C 1.523 -0.092 0 CA-C-N 119.149 1.475 . . . . 3.32 112.661 -176.946 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 1.3 p -61.8 -168.38 0.01 OUTLIER 'General case' 0 CA--C 1.537 0.447 0 C-N-CA 123.397 0.679 . . . . 1.74 109.798 162.332 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 9.7 m-20 -48.17 145.75 3.03 Favored 'General case' 0 N--CA 1.463 0.222 0 O-C-N 121.359 -0.838 . . . . 2.19 110.882 -177.95 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -50.51 -31.99 16.99 Favored 'General case' 0 CA--C 1.534 0.349 0 C-N-CA 123.99 0.916 . . . . 5.56 111.884 175.177 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -61.11 -42.06 97.83 Favored 'General case' 0 N--CA 1.451 -0.418 0 C-N-CA 124.263 1.025 . . . . 1.55 110.438 178.311 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 7.9 mt-10 -69.82 -45.26 68.24 Favored 'General case' 0 N--CA 1.448 -0.528 0 CA-C-O 117.921 -1.038 . . . . 1.89 110.477 177.073 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 35.7 t80 -51.45 -45.01 62.53 Favored 'General case' 0 CA--C 1.533 0.315 0 C-N-CA 126.041 1.737 . . . . 0.42 112.005 175.303 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 90.4 t80 -69.23 -45.81 68.87 Favored 'General case' 0 C--N 1.328 -0.349 0 O-C-N 120.859 -1.151 . . . . 0.58 109.847 178.267 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -65.02 -39.4 93.36 Favored 'General case' 0 CA--C 1.542 0.65 0 O-C-N 121.495 -0.753 . . . . 1.73 112.058 -174.806 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -72.15 -33.78 68.01 Favored 'General case' 0 C--N 1.333 -0.135 0 O-C-N 121.092 -1.005 . . . . 3.8 110.266 175.233 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -54.01 -42.42 69.06 Favored 'General case' 0 C--O 1.223 -0.313 0 CA-C-N 119.114 0.87 . . . . 1.5 110.419 171.706 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 47.4 t80 -56.65 -49.94 73.55 Favored 'General case' 0 N--CA 1.466 0.357 0 CA-C-N 119.954 1.252 . . . . 5.81 111.315 171.667 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -49.45 -58.77 4.55 Favored 'General case' 0 C--N 1.34 0.157 0 CA-C-N 118.649 0.659 . . . . 4.94 109.791 -179.98 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -63.78 -27.89 69.5 Favored 'General case' 0 N--CA 1.45 -0.454 0 C-N-CA 124.888 1.275 . . . . 1.6 110.997 -175.429 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 1.5 tmt? -68.64 -36.03 78.06 Favored 'General case' 0 N--CA 1.448 -0.558 0 C-N-CA 122.695 0.398 . . . . 3.43 111.725 -178.988 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 10.8 p80 -93.94 -10.6 33.23 Favored 'General case' 0 C--O 1.231 0.08 0 CA-C-O 117.384 -1.293 . . . . 1.41 113.169 -179.535 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 60.1 m -39.01 126.9 1.63 Allowed 'General case' 0 N--CA 1.449 -0.505 0 CA-C-O 123.028 1.394 . . . . 1.66 112.554 -169.488 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 4.1 p -53.53 -44.48 69.22 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 113.254 -1.793 . . . . 2.36 108.588 176.404 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 12.3 t0 -65.8 107.23 1.74 Allowed 'General case' 0 N--CA 1.447 -0.612 0 N-CA-C 108.717 -0.846 . . . . 2.37 108.717 167.151 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -55.9 -33.19 64.42 Favored 'General case' 0 N--CA 1.454 -0.267 0 CA-C-N 116.028 -0.533 . . . . 6.59 110.626 176.304 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -61.06 -49.51 77.06 Favored 'General case' 0 N--CA 1.447 -0.615 0 CA-C-O 118.205 -0.902 . . . . 1.61 110.323 -179.831 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 1.2 mt-10 -46.58 -42.56 16.2 Favored 'General case' 0 C--N 1.34 0.185 0 CA-C-N 119.263 0.938 . . . . 2.74 110.061 179.371 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 2.2 mtp180 -64.87 -54.0 37.89 Favored 'General case' 0 CA--C 1.517 -0.314 0 CA-C-N 115.714 -0.675 . . . . 4.03 109.556 -179.268 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 1.4 mm? -65.68 -17.33 64.52 Favored 'General case' 0 N--CA 1.452 -0.344 0 CA-C-O 117.774 -1.108 . . . . 1.72 112.774 179.89 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 2.5 mptm? -67.54 -48.12 67.9 Favored 'General case' 0 CA--C 1.517 -0.297 0 CA-C-N 121.175 1.807 . . . . 2.42 107.407 168.49 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 93.0 t -57.37 -45.62 85.38 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.692 0 C-N-CA 120.452 -0.499 . . . . 1.71 110.689 175.942 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -71.18 -48.76 49.78 Favored 'General case' 0 N--CA 1.45 -0.447 0 CA-C-N 119.667 1.122 . . . . 2.32 110.857 -172.487 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 51.2 tttt -55.41 -51.81 65.63 Favored 'General case' 0 N--CA 1.451 -0.384 0 C-N-CA 124.34 1.056 . . . . 3.45 110.506 177.92 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 12.2 m-20 -64.64 -40.42 95.42 Favored 'General case' 0 N--CA 1.454 -0.262 0 C-N-CA 123.174 0.59 . . . . 1.54 109.967 -179.813 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -137.83 74.21 45.23 Favored Pre-proline 0 C--O 1.238 0.498 0 C-N-CA 125.961 1.705 . . . . 1.79 111.173 -165.136 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 40.5 Cg_endo -64.24 -16.79 56.95 Favored 'Trans proline' 0 N--CA 1.453 -0.908 0 C-N-CA 122.315 2.01 . . . . 1.98 111.934 -175.547 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 22.5 pttt -95.48 -40.28 9.55 Favored 'General case' 0 CA--C 1.531 0.231 0 C-N-CA 123.203 0.601 . . . . 4.22 112.352 -179.125 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 3.3 m -62.46 -45.3 93.69 Favored 'General case' 0 CA--C 1.521 -0.135 0 O-C-N 120.739 -1.225 . . . . 1.6 110.628 -179.522 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 10.3 t80 -61.22 -45.37 94.86 Favored 'General case' 0 CA--C 1.508 -0.659 0 C-N-CA 119.965 -0.694 . . . . 2.96 110.946 -179.906 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 36.7 tt0 -53.88 -37.56 63.84 Favored 'General case' 0 N--CA 1.44 -0.938 0 CA-C-N 114.995 -1.002 . . . . 1.89 110.097 177.212 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 4.9 t80 -60.69 -56.99 14.67 Favored 'General case' 0 N--CA 1.453 -0.276 0 N-CA-C 109.135 -0.691 . . . . 1.44 109.135 -177.74 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 33.9 mm -53.4 -44.07 53.88 Favored 'Isoleucine or valine' 0 C--O 1.227 -0.118 0 O-C-N 121.992 -0.443 . . . . 2.98 110.201 178.05 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 14.7 t30 -62.36 -30.81 71.45 Favored 'General case' 0 CA--C 1.531 0.225 0 C-N-CA 122.886 0.474 . . . . 2.11 111.999 -178.075 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 26.9 t70 -69.8 -43.31 72.36 Favored 'General case' 0 C--O 1.231 0.095 0 C-N-CA 123.124 0.57 . . . . 2.64 110.273 174.989 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 92.7 mm-40 -70.16 -56.03 7.88 Favored 'General case' 0 N--CA 1.45 -0.427 0 CA-C-N 115.862 -0.608 . . . . 3.58 110.886 -172.235 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 1.5 pp -70.35 108.67 2.45 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.268 0 CA-C-O 121.489 0.662 . . . . 7.1 109.232 -174.379 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 38.9 ttmt -145.83 -70.54 0.26 Allowed 'General case' 0 C--O 1.224 -0.238 0 N-CA-C 108.623 -0.881 . . . . 10.32 108.623 -177.663 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 102' ' ' PHE . . . . . . . . . . . . . 3.8 m-85 -142.5 107.68 4.98 Favored 'General case' 0 N--CA 1.451 -0.423 0 N-CA-C 106.053 -1.832 . . . . 7.82 106.053 173.16 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 7.0 tp -149.61 149.07 15.02 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.717 0 N-CA-C 108.494 -0.928 . . . . 5.78 108.494 173.566 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 104' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -152.32 138.15 11.6 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.343 0 N-CA-C 105.516 -2.031 . . . . 6.31 105.516 175.828 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 64.9 t30 -151.06 160.5 43.87 Favored 'General case' 0 C--O 1.234 0.237 0 N-CA-C 107.959 -1.126 . . . . 12.44 107.959 172.607 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 71.5 m . . . . . 0 C--O 1.247 0.939 0 CA-C-O 116.617 -1.659 . . . . 11.86 108.606 176.199 . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . 0.437 ' N ' ' OE2' ' A' ' 17' ' ' GLU . . . . . . . . 0 CA--C 1.531 1.093 0 CA-C-O 115.658 -2.745 . . . . 12.7 115.549 . . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 37.0 m 23.54 91.86 0.01 OUTLIER 'General case' 0 N--CA 1.47 0.527 0 C-N-CA 128.332 2.653 . . . . 12.92 115.55 -176.815 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 14.3 ptpt -151.07 53.26 0.86 Allowed 'General case' 0 C--O 1.226 -0.162 0 C-N-CA 122.548 0.339 . . . . 17.54 111.104 -177.45 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 170.06 -169.0 41.88 Favored Glycine 0 C--N 1.333 0.405 0 N-CA-C 110.627 -0.989 . . . . 12.66 110.627 177.872 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 33.3 m -82.84 -159.83 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.447 -0.581 0 N-CA-C 108.916 -0.772 . . . . 13.22 108.916 171.292 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 9.8 pt-20 -76.36 119.39 20.17 Favored 'General case' 0 N--CA 1.451 -0.392 0 CA-C-O 122.017 0.913 . . . . 9.68 110.869 171.048 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -157.26 42.52 0.33 Allowed 'General case' 0 N--CA 1.449 -0.518 0 C-N-CA 124.252 1.021 . . . . 9.11 110.288 178.628 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 14.0 mmm-85 78.95 -63.43 0.28 Allowed 'General case' 0 N--CA 1.472 0.63 0 C-N-CA 125.49 1.516 . . . . 9.01 109.934 176.675 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 2.8 m120 -50.33 -29.65 10.35 Favored 'General case' 0 CA--C 1.514 -0.421 0 C-N-CA 124.925 1.29 . . . . 3.64 113.129 175.52 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 1.2 t70 -63.97 -53.45 49.89 Favored 'General case' 0 C--N 1.322 -0.61 0 C-N-CA 122.767 0.427 . . . . 2.59 110.653 172.893 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 8.2 m -60.52 -52.91 63.19 Favored 'General case' 0 N--CA 1.453 -0.311 0 CA-C-N 118.615 0.643 . . . . 2.42 110.799 -176.853 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 6.7 pt-20 -71.64 -25.15 62.02 Favored 'General case' 0 CA--C 1.531 0.224 0 O-C-N 121.766 -0.584 . . . . 3.41 110.967 179.313 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -60.31 -46.3 94.54 Favored Glycine 0 CA--C 1.523 0.556 0 N-CA-C 110.416 -1.074 . . . . 0.82 110.416 172.105 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -59.87 -56.71 18.35 Favored 'General case' 0 C--N 1.331 -0.233 0 C-N-CA 125.189 1.396 . . . . 4.37 109.319 -172.603 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . 0.42 HG13 ' CG ' ' A' ' 72' ' ' ARG . 0.7 OUTLIER -64.56 -32.28 57.15 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.302 0 O-C-N 121.334 -0.854 . . . . 1.68 111.768 177.807 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 5.0 t60 -59.96 -47.68 84.82 Favored 'General case' 0 CA--C 1.532 0.268 0 N-CA-C 107.828 -1.175 . . . . 0.76 107.828 176.353 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . 0.437 ' OE2' ' N ' ' A' ' 1' ' ' GLY . 20.3 mt-10 -60.8 -38.55 85.72 Favored 'General case' 0 N--CA 1.454 -0.248 0 C-N-CA 124.321 1.048 . . . . 2.59 110.157 179.527 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 1.3 t80 -53.07 -45.99 68.36 Favored 'General case' 0 C--N 1.332 -0.169 0 C-N-CA 123.155 0.582 . . . . 3.44 110.028 172.856 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -48.57 -50.3 25.16 Favored Glycine 0 CA--C 1.529 0.94 0 N-CA-C 111.473 -0.651 . . . . 0.57 111.473 171.923 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 40.6 m-70 -58.84 -50.49 73.78 Favored 'General case' 0 C--O 1.224 -0.247 0 O-C-N 121.148 -1.207 . . . . 4.73 112.205 176.931 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -59.78 -27.92 66.97 Favored 'General case' 0 N--CA 1.453 -0.286 0 CA-C-N 118.227 0.467 . . . . 1.72 110.854 -176.938 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 53.9 t -69.11 -45.18 80.26 Favored 'Isoleucine or valine' 0 C--O 1.232 0.153 0 O-C-N 121.208 -0.933 . . . . 1.77 109.935 174.042 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 1.9 t0 -60.87 -19.7 60.61 Favored 'General case' 0 C--N 1.327 -0.38 0 C-N-CA 124.453 1.101 . . . . 1.86 111.78 178.0 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 9.8 t70 -72.33 -51.79 19.08 Favored 'General case' 0 N--CA 1.455 -0.177 0 C-N-CA 124.806 1.242 . . . . 1.89 109.556 -173.488 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -57.1 -48.37 78.77 Favored 'General case' 0 N--CA 1.457 -0.095 0 CA-C-N 115.544 -0.753 . . . . 4.26 109.418 -178.791 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -64.19 -24.67 67.76 Favored 'General case' 0 N--CA 1.453 -0.299 0 N-CA-C 112.441 0.534 . . . . 2.06 112.441 176.63 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -66.48 -30.75 77.05 Favored Glycine 0 CA--C 1.524 0.655 0 CA-C-N 118.964 0.802 . . . . 1.67 111.49 174.461 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -89.94 -44.82 9.63 Favored 'General case' 0 CA--C 1.529 0.165 0 CA-C-N 118.014 0.907 . . . . 3.22 110.973 -177.817 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 3.2 mm? -77.85 -37.68 47.81 Favored 'General case' 0 N--CA 1.452 -0.337 0 C-N-CA 124.201 1.0 . . . . 2.56 112.432 -175.559 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 13.0 mt -108.4 -143.2 0.38 Allowed 'General case' 0 N--CA 1.447 -0.585 0 N-CA-C 106.317 -1.734 . . . . 2.5 106.317 -174.465 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER 6.15 94.34 0.0 OUTLIER 'General case' 0 N--CA 1.469 0.52 0 C-N-CA 128.502 2.721 . . . . 6.12 115.339 178.061 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -62.91 157.36 21.83 Favored 'General case' 0 C--O 1.225 -0.221 0 O-C-N 121.651 -0.656 . . . . 7.24 110.415 -169.601 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -46.35 88.26 0.0 OUTLIER 'General case' 0 CA--C 1.533 0.31 0 C-N-CA 126.081 1.752 . . . . 7.57 112.673 -170.244 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 6.3 tp-100 -153.53 -53.26 0.1 Allowed 'General case' 0 N--CA 1.454 -0.268 0 C-N-CA 124.89 1.276 . . . . 10.04 107.673 -172.339 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 22.8 t -123.1 145.47 48.54 Favored 'General case' 0 N--CA 1.449 -0.523 0 N-CA-C 106.208 -1.775 . . . . 6.38 106.208 165.348 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 2.8 t70 -84.53 141.97 30.35 Favored 'General case' 0 N--CA 1.449 -0.523 0 N-CA-C 107.019 -1.475 . . . . 5.87 107.019 173.639 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 4.5 mp 63.81 150.99 0.04 OUTLIER 'General case' 0 CA--C 1.544 0.724 0 C-N-CA 126.506 1.922 . . . . 3.31 111.938 -171.17 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 11.6 p -79.73 77.83 0.9 Allowed 'Isoleucine or valine' 0 CA--C 1.539 0.533 0 O-C-N 120.311 -1.493 . . . . 2.7 110.648 -175.757 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 57.5 p -48.58 -48.37 39.02 Favored 'General case' 0 C--N 1.331 -0.237 0 O-C-N 120.242 -1.536 . . . . 3.96 114.4 -166.436 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 18.9 m-80 -159.49 -53.77 0.06 Allowed 'General case' 0 C--N 1.329 -0.32 0 N-CA-C 105.9 -1.889 . . . . 7.8 105.9 170.519 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER 57.33 -161.13 0.22 Allowed 'General case' 0 N--CA 1.452 -0.375 0 CA-C-N 115.462 -0.79 . . . . 3.12 109.895 -170.584 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 8.9 mttm 46.51 -90.22 0.01 OUTLIER 'General case' 0 N--CA 1.47 0.548 0 C-N-CA 124.706 1.202 . . . . 6.39 111.727 -175.855 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -75.19 78.45 2.32 Favored 'General case' 0 N--CA 1.45 -0.441 0 N-CA-C 107.274 -1.38 . . . . 7.38 107.274 173.076 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 1.7 m-85 -52.51 109.34 0.39 Allowed 'General case' 0 N--CA 1.456 -0.17 0 C-N-CA 123.657 0.783 . . . . 6.24 108.995 178.623 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . 0.284 1.5 mp 54.27 67.95 0.14 Allowed 'Isoleucine or valine' 0 CA--C 1.551 1.007 0 CA-C-O 122.886 1.326 . . . . 4.53 110.833 174.151 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 4.5 t0 -137.69 -64.19 0.56 Allowed 'General case' 0 N--CA 1.473 0.714 0 O-C-N 120.637 -1.289 . . . . 2.74 109.048 174.166 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 5.8 mm -53.75 -56.07 10.71 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.331 0 N-CA-C 108.108 -1.071 . . . . 1.52 108.108 -174.801 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 48' ' ' PHE . . . . . 0.437 ' CD2' ' HG2' ' A' ' 63' ' ' GLU . 29.2 t80 -57.73 -34.36 69.42 Favored 'General case' 0 N--CA 1.452 -0.364 0 N-CA-C 113.068 0.766 . . . . 0.45 113.068 174.21 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . 0.492 ' HA ' ' HE2' ' A' ' 49' ' ' LYS . 9.3 mmpt? -62.88 -48.33 79.46 Favored 'General case' 0 N--CA 1.454 -0.234 0 O-C-N 120.531 -1.355 . . . . 2.27 111.575 -172.465 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -88.32 -62.95 1.37 Allowed 'General case' 0 C--N 1.329 -0.316 0 N-CA-C 107.226 -1.398 . . . . 4.04 107.226 -177.806 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 13.9 mm-40 -66.21 -34.56 78.3 Favored 'General case' 0 C--O 1.235 0.31 0 CA-C-O 121.369 0.604 . . . . 2.48 109.869 -167.954 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -69.37 34.47 0.33 Allowed Glycine 0 CA--C 1.531 1.071 0 C-N-CA 125.447 1.498 . . . . 0.49 113.328 169.463 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 60.8 p -146.57 27.93 1.09 Allowed 'General case' 0 N--CA 1.451 -0.383 0 O-C-N 120.195 -1.768 . . . . 2.34 110.585 157.152 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 52.5 t-20 -134.48 -47.06 0.75 Allowed 'General case' 0 N--CA 1.453 -0.284 0 CA-C-O 120.725 0.298 . . . . 2.3 111.149 -165.83 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 14.5 mt -63.42 -35.06 79.18 Favored 'General case' 0 C--N 1.333 -0.142 0 O-C-N 121.865 -0.522 . . . . 1.81 111.125 -176.666 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 1.5 t 175.19 167.88 0.31 Allowed 'General case' 0 CA--C 1.531 0.237 0 C-N-CA 125.488 1.515 . . . . 1.61 108.148 -178.272 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 9.7 m -59.53 -33.63 71.63 Favored 'General case' 0 N--CA 1.453 -0.281 0 C-N-CA 123.44 0.696 . . . . 1.41 110.827 168.835 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -66.83 -14.23 62.46 Favored 'General case' 0 CA--C 1.535 0.377 0 C-N-CA 122.775 0.43 . . . . 2.95 111.672 175.842 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -90.26 -11.59 62.63 Favored Glycine 0 N--CA 1.445 -0.733 0 C-N-CA 124.415 1.007 . . . . 0.66 111.105 175.239 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -104.41 -13.93 15.91 Favored 'General case' 0 CA--C 1.521 -0.166 0 CA-C-N 118.711 1.255 . . . . 4.15 112.314 179.177 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 1.3 p -59.83 -173.1 0.02 OUTLIER 'General case' 0 CA--C 1.541 0.607 0 C-N-CA 123.205 0.602 . . . . 2.03 110.006 161.834 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 98.1 m-20 -49.59 153.05 1.24 Allowed 'General case' 0 N--CA 1.467 0.409 0 O-C-N 121.347 -0.846 . . . . 1.91 111.793 -172.8 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . 0.437 ' HG2' ' CD2' ' A' ' 48' ' ' PHE . 42.0 mt-10 -54.32 -34.24 60.59 Favored 'General case' 0 CA--C 1.533 0.321 0 O-C-N 122.299 -0.251 . . . . 3.13 111.34 -179.684 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -56.12 -39.36 72.11 Favored 'General case' 0 C--N 1.334 -0.078 0 O-C-N 121.552 -0.718 . . . . 1.72 112.558 176.058 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 1.8 mm-40 -80.19 -34.92 37.08 Favored 'General case' 0 CA--C 1.508 -0.65 0 CA-C-O 118.664 -0.684 . . . . 2.98 110.592 -178.203 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 62.7 t80 -55.15 -48.9 73.07 Favored 'General case' 0 N--CA 1.449 -0.51 0 C-N-CA 123.928 0.891 . . . . 0.63 111.13 170.929 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 82.5 t80 -63.13 -44.7 94.84 Favored 'General case' 0 CA--C 1.535 0.371 0 O-C-N 121.028 -1.045 . . . . 0.81 110.398 175.648 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -60.94 -52.53 64.65 Favored 'General case' 0 CA--C 1.539 0.543 0 O-C-N 121.077 -1.015 . . . . 1.71 112.58 -175.213 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 1.9 pp20? -63.41 -33.29 75.22 Favored 'General case' 0 C--N 1.331 -0.196 0 C-N-CA 124.426 1.09 . . . . 3.73 111.213 174.915 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -53.09 -58.74 5.99 Favored 'General case' 0 C--O 1.222 -0.37 0 CA-C-O 118.075 -0.964 . . . . 1.69 108.741 170.331 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 44.5 t80 -48.5 -48.01 38.33 Favored 'General case' 0 N--CA 1.468 0.445 0 CA-C-N 119.654 1.115 . . . . 3.33 112.01 179.454 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 72' ' ' ARG . . . . . 0.42 ' CG ' HG13 ' A' ' 15' ' ' ILE . 2.4 tmm_? -48.34 -51.46 26.11 Favored 'General case' 0 CA--C 1.539 0.522 0 C-N-CA 122.544 0.338 . . . . 4.38 110.238 176.331 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -75.7 -27.35 58.2 Favored 'General case' 0 C--O 1.225 -0.186 0 C-N-CA 124.5 1.12 . . . . 1.73 111.924 -176.711 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 34.0 mmt -58.52 -40.82 83.98 Favored 'General case' 0 CA--C 1.516 -0.349 0 CA-C-N 118.931 0.787 . . . . 6.77 109.627 -179.941 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 22.9 p80 -90.2 -39.6 12.71 Favored 'General case' 0 N--CA 1.449 -0.483 0 CA-C-O 115.815 -2.04 . . . . 1.1 110.758 -176.975 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 3.6 m -3.18 112.46 0.01 OUTLIER 'General case' 0 C--N 1.349 0.569 0 C-N-CA 128.156 2.582 . . . . 1.6 114.445 -172.636 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 2.6 p -46.64 -43.91 17.96 Favored 'General case' 0 N--CA 1.451 -0.396 0 C-N-CA 125.366 1.466 . . . . 1.81 110.836 178.713 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 61.9 t0 -72.35 108.1 5.29 Favored 'General case' 0 N--CA 1.453 -0.313 0 C-N-CA 119.055 -1.058 . . . . 1.91 108.629 167.708 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 92.8 m-70 -50.39 -34.08 22.99 Favored 'General case' 0 N--CA 1.453 -0.292 0 C-N-CA 123.478 0.711 . . . . 6.77 110.93 175.14 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -53.57 -48.94 68.71 Favored 'General case' 0 N--CA 1.45 -0.435 0 CA-C-O 119.205 -0.426 . . . . 1.47 111.039 176.659 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -56.17 -38.52 71.03 Favored 'General case' 0 CA--C 1.52 -0.188 0 CA-C-N 118.363 0.529 . . . . 3.74 110.641 -178.847 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -64.86 -50.32 67.08 Favored 'General case' 0 N--CA 1.452 -0.335 0 N-CA-C 109.068 -0.716 . . . . 4.26 109.068 179.111 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 1.2 mm? -65.11 -21.75 66.85 Favored 'General case' 0 N--CA 1.451 -0.378 0 CA-C-O 118.166 -0.921 . . . . 1.63 112.548 178.241 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 30.6 mttt -66.98 -46.62 74.05 Favored 'General case' 0 C--O 1.222 -0.387 0 N-CA-C 107.083 -1.451 . . . . 2.57 107.083 171.889 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 86.8 t -59.87 -43.32 91.76 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.688 0 C-N-CA 119.541 -0.864 . . . . 1.62 112.183 173.965 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 86' ' ' GLN . . . . . 0.42 ' HG2' ' CG ' ' A' ' 93' ' ' PHE . 1.4 mm-40 -67.76 -53.13 29.75 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 120.554 1.525 . . . . 2.79 110.735 -174.994 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 18.6 tttm -52.82 -50.47 63.62 Favored 'General case' 0 N--CA 1.453 -0.279 0 C-N-CA 125.148 1.379 . . . . 2.8 110.431 177.606 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 5.8 m-20 -67.27 -36.03 80.74 Favored 'General case' 0 N--CA 1.452 -0.327 0 CA-C-O 118.894 -0.574 . . . . 1.55 110.501 -179.034 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -141.06 80.8 16.65 Favored Pre-proline 0 C--O 1.238 0.491 0 C-N-CA 126.266 1.826 . . . . 1.31 110.968 -168.686 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 92.6 Cg_endo -80.26 37.97 0.71 Allowed 'Trans proline' 0 CA--C 1.541 0.837 0 C-N-CA 123.525 2.817 . . . . 1.53 111.974 -176.498 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 2.0 ptmt -155.51 -47.88 0.08 Allowed 'General case' 0 CA--C 1.531 0.225 0 C-N-CA 125.431 1.492 . . . . 3.48 110.079 -175.34 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 3.6 m -53.94 -45.21 71.19 Favored 'General case' 0 N--CA 1.463 0.187 0 O-C-N 121.041 -1.037 . . . . 1.66 110.323 171.957 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 93' ' ' PHE . . . . . 0.42 ' CG ' ' HG2' ' A' ' 86' ' ' GLN . 7.8 t80 -56.82 -47.92 79.16 Favored 'General case' 0 CA--C 1.505 -0.755 0 C-N-CA 120.281 -0.568 . . . . 3.8 111.396 178.582 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 56.3 tt0 -51.27 -35.67 38.47 Favored 'General case' 0 N--CA 1.447 -0.624 0 CA-C-N 115.533 -0.758 . . . . 2.64 110.655 179.934 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 9.0 t80 -55.68 -59.6 4.63 Favored 'General case' 0 CA--C 1.532 0.252 0 CA-C-N 118.534 0.606 . . . . 1.9 110.83 -176.907 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 3.8 mp -69.43 -32.86 54.77 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.202 0 O-C-N 121.624 -0.673 . . . . 2.06 109.297 -178.846 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 47.2 t30 -60.37 -31.78 70.66 Favored 'General case' 0 N--CA 1.453 -0.284 0 O-C-N 121.807 -0.558 . . . . 2.78 110.606 -179.243 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -68.22 -59.81 2.94 Favored 'General case' 0 N--CA 1.456 -0.126 0 C-N-CA 124.688 1.195 . . . . 2.18 108.67 171.15 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 38.6 mm-40 -85.8 77.28 9.78 Favored 'General case' 0 N--CA 1.45 -0.456 0 CA-C-O 121.426 0.631 . . . . 3.91 110.574 -176.307 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 6.7 tp -42.45 -50.98 0.97 Allowed 'Isoleucine or valine' 0 CA--C 1.534 0.361 0 C-N-CA 126.178 1.791 . . . . 5.11 112.321 -178.181 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 34.5 pttt -172.98 162.77 4.71 Favored 'General case' 0 N--CA 1.46 0.055 0 C-N-CA 125.25 1.42 . . . . 9.35 107.909 175.271 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 102' ' ' PHE . . . . . . . . . . . . . 4.1 t80 -144.05 -49.19 0.29 Allowed 'General case' 0 C--O 1.225 -0.233 0 N-CA-C 109.949 -0.389 . . . . 13.01 109.949 -179.451 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -52.79 -35.99 22.49 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.466 0 C-N-CA 123.937 0.895 . . . . 5.58 111.427 175.051 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 104' ' ' ILE . . . . . . . . . . . . . 43.0 mm -74.05 81.46 0.47 Allowed 'Isoleucine or valine' 0 CA--C 1.532 0.25 0 N-CA-C 108.165 -1.05 . . . . 7.14 108.165 176.255 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 4.9 t30 -87.0 143.92 27.13 Favored 'General case' 0 N--CA 1.449 -0.478 0 N-CA-C 107.288 -1.375 . . . . 10.56 107.288 168.671 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 27.2 m . . . . . 0 C--O 1.251 1.17 0 CA-C-O 116.592 -1.671 . . . . 12.45 108.316 175.656 . . . . . . . . 0 0 . 1 . 021 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.468 0.796 0 N-CA-C 108.439 -1.864 . . . . 11.29 108.439 . . . . . . . . . 0 0 . 1 . 021 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 24.7 m -151.24 108.11 3.54 Favored 'General case' 0 N--CA 1.454 -0.25 0 CA-C-N 118.043 0.921 . . . . 12.17 108.97 171.539 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 2.3 ptpp? -159.28 126.13 4.63 Favored 'General case' 0 C--O 1.224 -0.283 0 CA-C-N 119.248 0.931 . . . . 14.73 110.182 167.866 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 68.45 -154.32 53.17 Favored Glycine 0 C--N 1.334 0.458 0 N-CA-C 111.695 -0.562 . . . . 12.72 111.695 176.03 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 33.7 m -81.38 -169.14 0.1 Allowed 'Isoleucine or valine' 0 N--CA 1.446 -0.641 0 N-CA-C 108.786 -0.82 . . . . 12.9 108.786 169.955 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 14.5 pt-20 -79.1 120.37 23.55 Favored 'General case' 0 N--CA 1.445 -0.68 0 O-C-N 121.028 -1.045 . . . . 9.11 111.923 176.757 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -108.18 32.17 4.99 Favored 'General case' 0 N--CA 1.453 -0.275 0 N-CA-C 109.208 -0.664 . . . . 8.63 109.208 178.546 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER 73.9 -58.32 0.59 Allowed 'General case' 0 N--CA 1.465 0.288 0 C-N-CA 125.123 1.369 . . . . 10.99 110.938 -166.558 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 3.9 m120 -59.65 -33.48 71.59 Favored 'General case' 0 CA--C 1.514 -0.439 0 C-N-CA 124.195 0.998 . . . . 2.83 111.96 -177.74 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 5.1 t70 -72.18 -39.57 68.56 Favored 'General case' 0 N--CA 1.449 -0.51 0 C-N-CA 119.528 -0.869 . . . . 3.07 110.36 -176.576 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 60.6 m -68.14 -55.31 12.85 Favored 'General case' 0 C--O 1.231 0.128 0 C-N-CA 123.448 0.699 . . . . 2.08 111.216 177.097 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -67.34 -30.8 70.71 Favored 'General case' 0 CA--C 1.539 0.557 0 CA-C-O 121.741 0.782 . . . . 4.46 109.262 -176.033 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -70.61 -40.47 66.55 Favored Glycine 0 CA--C 1.528 0.852 0 O-C-N 121.606 -0.684 . . . . 0.9 111.53 173.54 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 28.2 t80 -58.21 -56.2 25.14 Favored 'General case' 0 C--O 1.226 -0.172 0 CA-C-N 118.725 1.263 . . . . 4.72 108.813 -178.942 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 0.5 OUTLIER -64.19 -32.51 57.72 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.229 0 CA-C-O 118.832 -0.604 . . . . 1.76 112.456 178.705 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 1.6 t-160 -55.47 -57.91 9.95 Favored 'General case' 0 C--N 1.342 0.261 0 N-CA-C 106.78 -1.563 . . . . 0.64 106.78 176.23 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 6.5 mt-10 -58.84 -36.35 74.41 Favored 'General case' 0 C--O 1.223 -0.307 0 C-N-CA 124.078 0.951 . . . . 3.06 110.624 -178.619 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 1.8 t80 -56.81 -51.33 69.38 Favored 'General case' 0 CA--C 1.521 -0.158 0 C-N-CA 124.075 0.95 . . . . 3.12 110.386 176.907 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -51.79 -45.15 55.49 Favored Glycine 0 CA--C 1.526 0.746 0 N-CA-C 110.309 -1.116 . . . . 0.72 110.309 175.681 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 2.7 t60 -62.35 -42.91 99.78 Favored 'General case' 0 N--CA 1.451 -0.384 0 O-C-N 122.075 -0.662 . . . . 2.56 111.401 179.445 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -65.42 -30.0 70.75 Favored 'General case' 0 N--CA 1.452 -0.339 0 O-C-N 121.242 -0.911 . . . . 1.85 110.02 179.175 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 71.2 t -71.92 -34.73 51.99 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.175 0 O-C-N 121.067 -1.021 . . . . 2.31 110.278 177.121 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 18.0 t70 -58.26 -26.26 62.73 Favored 'General case' 0 C--O 1.233 0.203 0 CA-C-O 120.952 0.406 . . . . 1.84 111.581 172.787 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 12.8 t70 -65.26 -54.11 34.18 Favored 'General case' 0 CA--C 1.518 -0.266 0 N-CA-C 108.818 -0.808 . . . . 2.0 108.818 -177.369 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -50.43 -49.89 53.6 Favored 'General case' 0 CA--C 1.521 -0.172 0 C-N-CA 125.082 1.353 . . . . 5.15 110.13 178.855 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -55.92 -43.13 77.07 Favored 'General case' 0 N--CA 1.447 -0.581 0 CA-C-O 119.123 -0.465 . . . . 1.91 110.74 179.531 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -62.57 -51.21 57.74 Favored Glycine 0 C--N 1.333 0.396 0 CA-C-N 118.745 0.702 . . . . 1.28 111.656 179.45 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -52.75 -39.91 62.62 Favored 'General case' 0 N--CA 1.453 -0.299 0 C-N-CA 124.917 1.287 . . . . 3.27 110.563 -175.331 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 3.0 mm? -88.8 -24.57 22.57 Favored 'General case' 0 N--CA 1.446 -0.669 0 C-N-CA 124.683 1.193 . . . . 2.16 113.511 179.255 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 16.3 mt -131.14 81.59 2.0 Allowed 'General case' 0 N--CA 1.451 -0.38 0 N-CA-C 108.441 -0.948 . . . . 2.64 108.441 -169.041 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -43.54 -44.85 6.31 Favored 'General case' 0 N--CA 1.467 0.408 0 C-N-CA 126.017 1.727 . . . . 6.76 113.081 -166.884 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 12.5 mmtm 28.09 54.99 0.08 Allowed 'General case' 0 N--CA 1.468 0.463 0 C-N-CA 129.02 2.928 . . . . 9.4 113.615 177.187 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 6.1 t-20 38.53 52.59 1.79 Allowed 'General case' 0 CA--C 1.528 0.107 0 C-N-CA 126.218 1.807 . . . . 7.98 111.819 178.936 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 21.4 tp60 -139.65 -46.66 0.45 Allowed 'General case' 0 N--CA 1.446 -0.66 0 CA-C-N 114.124 -1.398 . . . . 10.78 108.006 -179.423 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 3.0 t 77.34 -41.4 0.37 Allowed 'General case' 0 N--CA 1.462 0.143 0 C-N-CA 126.052 1.741 . . . . 8.03 112.348 179.283 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 33.0 t70 -128.61 118.8 23.57 Favored 'General case' 0 N--CA 1.449 -0.518 0 N-CA-C 105.977 -1.86 . . . . 6.53 105.977 -177.059 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER 63.72 167.42 0.15 Allowed 'General case' 0 CA--C 1.539 0.528 0 C-N-CA 125.53 1.532 . . . . 4.12 111.831 -168.922 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 4.5 p -104.21 -44.25 8.85 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.47 0 O-C-N 121.163 -0.961 . . . . 2.88 110.296 176.927 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER 55.31 -175.2 0.04 OUTLIER 'General case' 0 CA--C 1.541 0.633 0 C-N-CA 125.379 1.472 . . . . 3.61 110.887 -175.076 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 9.6 t30 -73.62 95.79 2.37 Favored 'General case' 0 N--CA 1.453 -0.319 0 O-C-N 119.601 -1.937 . . . . 7.52 109.32 169.031 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 68.3 m -131.76 42.71 3.14 Favored 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 108.311 -0.996 . . . . 5.28 108.311 170.479 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 24.3 mmtp -73.49 -44.49 57.74 Favored 'General case' 0 N--CA 1.467 0.401 0 O-C-N 121.69 -0.632 . . . . 6.82 110.517 175.223 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 52.8 mttm -134.07 -72.0 0.49 Allowed 'General case' 0 CA--C 1.518 -0.252 0 N-CA-C 108.483 -0.932 . . . . 8.06 108.483 -178.602 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -150.69 171.17 17.57 Favored 'General case' 0 N--CA 1.453 -0.299 0 N-CA-C 107.046 -1.465 . . . . 6.98 107.046 171.338 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 7.0 pt -59.33 111.99 0.59 Allowed 'Isoleucine or valine' 0 CA--C 1.538 0.506 0 N-CA-C 108.946 -0.761 . . . . 3.35 108.946 170.199 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 26.6 p-10 -145.63 -59.35 0.33 Allowed 'General case' 0 CA--C 1.533 0.322 0 O-C-N 121.587 -0.696 . . . . 3.94 110.584 -169.824 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 4.6 mm -55.7 -49.97 70.68 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.416 0 C-N-CA 127.316 2.246 . . . . 1.83 107.504 176.138 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 26.5 t80 -60.58 -36.63 79.0 Favored 'General case' 0 N--CA 1.449 -0.498 0 C-N-CA 123.874 0.87 . . . . 0.59 112.866 174.155 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . 0.483 ' HA ' ' HE2' ' A' ' 49' ' ' LYS . 10.2 mmpt? -62.61 -46.8 86.62 Favored 'General case' 0 CA--C 1.519 -0.248 0 C-N-CA 118.576 -1.25 . . . . 2.09 110.542 -173.41 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 4.6 tp10 -85.05 -64.76 1.1 Allowed 'General case' 0 N--CA 1.449 -0.479 0 CA-C-O 121.916 0.865 . . . . 2.43 108.669 -177.825 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 14.2 mm-40 -72.52 -29.58 63.72 Favored 'General case' 0 CA--C 1.533 0.324 0 O-C-N 121.609 -0.682 . . . . 2.54 110.331 -167.835 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -70.57 37.8 0.47 Allowed Glycine 0 CA--C 1.528 0.902 0 C-N-CA 125.844 1.688 . . . . 0.39 113.869 169.487 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 63.8 p -142.41 23.89 1.96 Allowed 'General case' 0 N--CA 1.447 -0.624 0 O-C-N 121.085 -1.244 . . . . 2.45 110.152 157.497 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -134.26 -39.45 0.83 Allowed 'General case' 0 C--N 1.341 0.209 0 N-CA-C 112.842 0.682 . . . . 2.56 112.842 -164.541 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 25.7 mt -65.91 -36.6 83.83 Favored 'General case' 0 N--CA 1.463 0.175 0 C-N-CA 120.118 -0.633 . . . . 1.61 110.495 -177.988 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER 178.23 169.65 0.77 Allowed 'General case' 0 CA--C 1.533 0.32 0 C-N-CA 125.622 1.569 . . . . 1.66 107.908 -178.762 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 16.4 m -59.19 -37.88 78.5 Favored 'General case' 0 CA--C 1.529 0.15 0 C-N-CA 124.026 0.93 . . . . 1.44 110.994 171.628 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -60.13 -32.92 71.46 Favored 'General case' 0 C--O 1.223 -0.34 0 C-N-CA 123.784 0.834 . . . . 1.73 109.175 172.53 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -64.06 -6.16 18.05 Favored Glycine 0 CA--C 1.524 0.594 0 O-C-N 121.196 -0.94 . . . . 0.49 112.442 176.46 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -121.57 0.88 10.0 Favored 'General case' 0 N--CA 1.454 -0.27 0 CA-C-N 119.01 1.405 . . . . 5.63 112.491 -177.49 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 58.9 p -73.92 -127.58 0.01 OUTLIER 'General case' 0 CA--C 1.534 0.359 0 N-CA-C 108.881 -0.785 . . . . 1.76 108.881 174.834 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 1.7 m120 -74.63 150.91 39.43 Favored 'General case' 0 CA--C 1.531 0.23 0 O-C-N 120.072 -1.642 . . . . 2.45 108.822 176.484 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 31.0 tt0 -62.41 -24.23 67.28 Favored 'General case' 0 CA--C 1.539 0.523 0 O-C-N 121.596 -0.69 . . . . 3.34 111.191 179.615 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -67.33 -33.89 76.19 Favored 'General case' 0 N--CA 1.454 -0.241 0 C-N-CA 124.15 0.98 . . . . 1.81 112.132 173.364 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 3.3 mt-10 -75.97 -49.61 17.22 Favored 'General case' 0 C--O 1.219 -0.525 0 N-CA-C 108.23 -1.026 . . . . 2.07 108.23 177.778 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 59.8 t80 -40.06 -51.31 2.59 Favored 'General case' 0 CA--C 1.537 0.464 0 C-N-CA 123.885 0.874 . . . . 0.45 111.874 170.932 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 62.9 t80 -60.82 -43.89 97.61 Favored 'General case' 0 CA--C 1.539 0.54 0 O-C-N 121.705 -0.622 . . . . 0.56 111.887 174.927 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -62.11 -52.07 65.34 Favored 'General case' 0 CA--C 1.535 0.368 0 C-N-CA 124.647 1.179 . . . . 1.58 112.352 -177.951 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 4.5 mp0 -57.29 -43.69 83.38 Favored 'General case' 0 CA--C 1.515 -0.402 0 O-C-N 121.075 -1.015 . . . . 4.46 109.89 172.56 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -57.49 -34.57 69.19 Favored 'General case' 0 N--CA 1.451 -0.396 0 CA-C-N 118.286 0.494 . . . . 1.61 110.421 -179.544 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -60.51 -55.67 30.58 Favored 'General case' 0 CA--C 1.534 0.363 0 C-N-CA 124.057 0.943 . . . . 4.2 111.385 169.917 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -48.92 -53.8 18.1 Favored 'General case' 0 CA--C 1.536 0.408 0 O-C-N 121.513 -0.742 . . . . 5.1 110.407 178.61 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -68.69 -49.16 61.14 Favored 'General case' 0 N--CA 1.449 -0.521 0 C-N-CA 126.465 1.906 . . . . 1.48 109.586 -171.509 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -63.16 -26.5 68.84 Favored 'General case' 0 CA--C 1.529 0.158 0 O-C-N 120.719 -1.238 . . . . 3.69 111.895 -178.506 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -91.23 -13.97 31.8 Favored 'General case' 0 C--N 1.338 0.106 0 CA-C-O 117.627 -1.177 . . . . 1.16 111.736 175.974 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 73.5 p -46.61 123.72 5.27 Favored 'General case' 0 N--CA 1.447 -0.585 0 CA-C-O 122.819 1.295 . . . . 2.91 108.611 -168.666 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -52.82 -39.75 62.7 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 113.604 -1.635 . . . . 2.24 109.206 -179.254 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 17.3 t0 -68.1 104.45 1.79 Allowed 'General case' 0 N--CA 1.444 -0.759 0 CA-C-O 122.411 1.1 . . . . 2.03 110.466 167.816 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 9.0 p-80 -39.46 -40.9 0.9 Allowed 'General case' 0 N--CA 1.453 -0.299 0 CA-C-N 114.904 -1.044 . . . . 5.75 113.362 168.609 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -65.15 -48.23 74.26 Favored 'General case' 0 N--CA 1.45 -0.469 0 CA-C-N 119.159 0.891 . . . . 1.43 110.273 -176.001 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 3.6 mt-10 -50.28 -38.14 39.65 Favored 'General case' 0 N--CA 1.454 -0.256 0 CA-C-N 118.884 0.766 . . . . 2.88 110.949 175.631 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 2.6 mtp180 -63.97 -52.51 59.32 Favored 'General case' 0 CA--C 1.516 -0.33 0 C-N-CA 119.156 -1.018 . . . . 3.3 109.733 177.8 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 1.3 mm? -60.19 -23.68 64.18 Favored 'General case' 0 N--CA 1.452 -0.356 0 CA-C-O 117.819 -1.086 . . . . 1.79 112.267 178.778 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 2.7 mptm? -61.46 -43.9 98.05 Favored 'General case' 0 C--O 1.224 -0.283 0 CA-C-N 120.811 1.641 . . . . 2.07 108.791 172.061 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 61.7 t -62.22 -61.83 1.44 Allowed 'Isoleucine or valine' 0 C--O 1.221 -0.431 0 CA-C-N 118.898 0.772 . . . . 1.72 109.745 171.321 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -55.12 -30.55 59.98 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 119.046 0.839 . . . . 3.65 113.073 -168.274 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 43.1 tttt -75.98 -60.17 2.44 Favored 'General case' 0 N--CA 1.451 -0.402 0 C-N-CA 125.526 1.531 . . . . 3.45 109.932 173.117 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 10.0 m-20 -76.79 6.51 5.96 Favored 'General case' 0 CA--C 1.533 0.303 0 C-N-CA 123.776 0.83 . . . . 1.47 111.917 -172.798 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -162.21 73.66 2.26 Favored Pre-proline 0 N--CA 1.445 -0.724 0 C-N-CA 125.657 1.583 . . . . 1.3 108.625 -176.85 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 68.7 Cg_endo -81.82 49.85 3.3 Favored 'Trans proline' 0 CA--C 1.539 0.749 0 C-N-CA 124.041 3.161 . . . . 2.04 111.513 -172.726 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 1.2 ptmt -175.01 -49.99 0.01 OUTLIER 'General case' 0 C--O 1.225 -0.229 0 C-N-CA 126.972 2.109 . . . . 3.16 109.407 -173.783 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 3.2 m -53.2 -41.97 65.83 Favored 'General case' 0 N--CA 1.462 0.163 0 O-C-N 121.293 -0.879 . . . . 1.54 111.448 176.694 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 34.2 t80 -57.88 -52.46 65.4 Favored 'General case' 0 CA--C 1.503 -0.854 0 C-N-CA 120.127 -0.629 . . . . 3.52 110.971 177.251 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 32.2 tt0 -53.22 -34.11 55.67 Favored 'General case' 0 N--CA 1.444 -0.764 0 CA-C-N 115.148 -0.933 . . . . 1.97 110.043 178.152 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 6.0 t80 -61.7 -58.13 9.23 Favored 'General case' 0 N--CA 1.451 -0.408 0 C-N-CA 123.138 0.575 . . . . 1.26 110.393 -176.711 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 4.2 mp -63.21 -33.87 63.58 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.195 0 O-C-N 120.912 -1.117 . . . . 1.91 109.695 176.912 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -60.89 -33.06 72.54 Favored 'General case' 0 CA--C 1.535 0.382 0 CA-C-N 118.814 0.734 . . . . 2.54 110.839 -178.592 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 28.0 t70 -59.59 -41.57 90.59 Favored 'General case' 0 N--CA 1.464 0.257 0 C-N-CA 124.542 1.137 . . . . 2.98 110.009 172.794 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 78.5 mm-40 -83.89 -42.44 16.35 Favored 'General case' 0 N--CA 1.447 -0.584 0 CA-C-N 115.857 -0.611 . . . . 3.7 112.415 -167.644 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 17.8 tt -80.04 75.05 0.76 Allowed 'Isoleucine or valine' 0 CA--C 1.533 0.326 0 CA-C-O 122.057 0.932 . . . . 6.83 110.445 -171.048 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -137.57 80.53 1.81 Allowed 'General case' 0 C--O 1.226 -0.166 0 O-C-N 121.235 -0.915 . . . . 9.65 109.366 -172.212 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 102' ' ' PHE . . . . . . . . . . . . . 46.0 m-85 43.05 79.81 0.04 OUTLIER 'General case' 0 CA--C 1.53 0.207 0 C-N-CA 124.819 1.248 . . . . 8.74 111.93 -172.314 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 10.8 tp -121.44 72.25 0.41 Allowed 'Isoleucine or valine' 0 N--CA 1.454 -0.239 0 N-CA-C 107.982 -1.118 . . . . 7.87 107.982 178.257 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 104' ' ' ILE . . . . . . . . . . . . . 11.4 pt -129.97 175.29 11.13 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.21 0 C-N-CA 124.256 1.022 . . . . 8.58 108.493 179.487 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 7.8 p30 -147.86 175.9 10.57 Favored 'General case' 0 C--N 1.33 -0.279 0 C-N-CA 124.843 1.257 . . . . 8.86 107.682 177.79 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 2.5 p . . . . . 0 C--O 1.249 1.067 0 CA-C-O 116.486 -1.721 . . . . 12.21 108.53 -173.975 . . . . . . . . 0 0 . 1 . 022 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.474 1.18 0 N-CA-C 109.154 -1.578 . . . . 12.74 109.154 . . . . . . . . . 0 0 . 1 . 022 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 26.5 t -155.38 177.0 11.85 Favored 'General case' 0 C--O 1.232 0.166 0 CA-C-N 118.339 1.069 . . . . 12.64 108.593 -175.416 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 37.9 ttpt -155.01 133.64 12.01 Favored 'General case' 0 N--CA 1.451 -0.388 0 N-CA-C 108.602 -0.888 . . . . 17.46 108.602 176.567 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 159.68 -166.41 34.9 Favored Glycine 0 N--CA 1.449 -0.443 0 N-CA-C 108.408 -1.877 . . . . 13.21 108.408 -179.469 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 31.6 m -90.25 -157.22 0.07 OUTLIER 'Isoleucine or valine' 0 N--CA 1.442 -0.845 0 N-CA-C 107.07 -1.455 . . . . 13.65 107.07 157.172 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 7.9 pt-20 -99.18 119.66 38.24 Favored 'General case' 0 N--CA 1.444 -0.757 0 CA-C-O 121.803 0.811 . . . . 9.6 110.862 174.981 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 1.8 mm? -109.51 32.57 4.92 Favored 'General case' 0 N--CA 1.453 -0.296 0 C-N-CA 123.854 0.862 . . . . 9.33 109.66 -178.818 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 21.5 mtp180 68.71 -67.37 0.21 Allowed 'General case' 0 N--CA 1.465 0.322 0 C-N-CA 125.704 1.602 . . . . 7.64 110.861 -172.165 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 14.0 m-20 -51.94 -35.67 46.68 Favored 'General case' 0 CA--C 1.513 -0.455 0 C-N-CA 123.952 0.901 . . . . 3.41 112.101 174.174 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 19.3 t70 -68.15 -43.44 78.27 Favored 'General case' 0 C--O 1.22 -0.482 0 C-N-CA 118.615 -1.234 . . . . 3.62 110.479 178.957 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 74.6 m -58.28 -59.08 5.87 Favored 'General case' 0 CA--C 1.531 0.217 0 CA-C-N 119.08 0.854 . . . . 1.78 111.601 177.189 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . 0.431 ' HA ' ' CD1' ' A' ' 15' ' ' ILE . 27.8 mt-10 -68.33 -27.6 66.41 Favored 'General case' 0 CA--C 1.53 0.204 0 CA-C-O 121.369 0.604 . . . . 3.85 110.575 -177.414 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -62.81 -41.08 99.92 Favored Glycine 0 CA--C 1.526 0.763 0 N-CA-C 111.047 -0.821 . . . . 0.65 111.047 170.949 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 1.1 t80 -67.78 -52.2 40.04 Favored 'General case' 0 N--CA 1.455 -0.176 0 CA-C-N 118.476 1.138 . . . . 3.81 109.139 -171.464 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . 0.431 ' CD1' ' HA ' ' A' ' 12' ' ' GLU . 1.1 pt -62.11 -36.37 73.9 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.301 0 CA-C-O 119.12 -0.467 . . . . 1.65 112.057 175.625 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 3.5 t60 -58.25 -54.52 46.05 Favored 'General case' 0 CA--C 1.534 0.363 0 N-CA-C 107.286 -1.376 . . . . 0.6 107.286 176.99 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 5.6 mt-10 -50.14 -49.05 53.28 Favored 'General case' 0 C--O 1.224 -0.255 0 C-N-CA 124.755 1.222 . . . . 3.03 109.38 176.673 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -53.72 -47.98 70.05 Favored 'General case' 0 CA--C 1.518 -0.265 0 C-N-CA 124.829 1.252 . . . . 3.43 110.933 -178.931 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -49.06 -49.65 29.48 Favored Glycine 0 CA--C 1.524 0.617 0 N-CA-C 110.393 -1.083 . . . . 0.48 110.393 173.614 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 2.1 t-160 -61.33 -43.25 99.19 Favored 'General case' 0 N--CA 1.452 -0.331 0 O-C-N 121.901 -0.764 . . . . 2.75 111.413 178.041 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -61.94 -29.6 70.34 Favored 'General case' 0 N--CA 1.45 -0.464 0 O-C-N 120.909 -1.12 . . . . 1.57 110.396 -179.474 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 90.2 t -68.01 -41.11 84.25 Favored 'Isoleucine or valine' 0 CA--C 1.52 -0.201 0 O-C-N 121.332 -0.855 . . . . 1.91 110.07 174.594 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 17.0 t0 -55.65 -31.54 62.43 Favored 'General case' 0 C--O 1.234 0.263 0 CA-C-O 121.779 0.8 . . . . 2.1 111.087 173.9 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 14.3 t70 -77.42 -47.6 19.34 Favored 'General case' 0 N--CA 1.45 -0.472 0 C-N-CA 124.419 1.088 . . . . 2.01 109.372 -173.54 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 29.0 t80 -62.05 -52.24 64.74 Favored 'General case' 0 N--CA 1.452 -0.351 0 N-CA-C 109.264 -0.643 . . . . 3.37 109.264 179.338 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -54.43 -38.69 66.59 Favored 'General case' 0 N--CA 1.448 -0.541 0 CA-C-O 119.26 -0.4 . . . . 2.2 111.142 176.739 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -62.0 -53.54 42.06 Favored Glycine 0 CA--C 1.523 0.576 0 N-CA-C 110.669 -0.972 . . . . 1.39 110.669 177.398 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -59.03 -43.27 91.59 Favored 'General case' 0 N--CA 1.455 -0.198 0 C-N-CA 124.003 0.921 . . . . 2.28 110.517 -173.451 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -79.79 -33.3 40.63 Favored 'General case' 0 N--CA 1.449 -0.498 0 C-N-CA 124.112 0.965 . . . . 3.17 112.927 -177.155 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 14.4 mt -120.51 56.65 0.98 Allowed 'General case' 0 CA--C 1.521 -0.158 0 CA-C-N 119.037 0.835 . . . . 3.43 109.276 -165.659 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 63.2 t0 -64.27 120.79 12.83 Favored 'General case' 0 CA--C 1.533 0.297 0 N-CA-C 109.093 -0.706 . . . . 6.54 109.093 177.575 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 19.6 ptmt -171.11 -39.58 0.02 OUTLIER 'General case' 0 N--CA 1.465 0.283 0 C-N-CA 124.586 1.154 . . . . 11.29 110.887 179.279 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 50.8 t-20 -63.61 142.7 58.3 Favored 'General case' 0 C--O 1.225 -0.185 0 N-CA-C 107.804 -1.184 . . . . 10.53 107.804 174.474 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 6.2 tt0 -85.57 41.97 0.93 Allowed 'General case' 0 CA--C 1.535 0.395 0 CA-C-N 118.979 0.809 . . . . 11.23 109.569 176.631 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -150.36 159.66 44.29 Favored 'General case' 0 N--CA 1.45 -0.45 0 N-CA-C 107.284 -1.376 . . . . 7.45 107.284 -179.283 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 17.5 t0 -75.69 149.22 38.16 Favored 'General case' 0 N--CA 1.453 -0.278 0 N-CA-C 109.256 -0.646 . . . . 5.03 109.256 179.483 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 7.8 mp 61.56 164.05 0.08 Allowed 'General case' 0 CA--C 1.539 0.55 0 C-N-CA 126.531 1.933 . . . . 2.81 111.529 -173.402 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 9.7 p -65.12 -47.73 86.56 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.385 0 O-C-N 119.841 -1.787 . . . . 2.48 109.037 -178.88 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 71.4 p 51.49 -163.37 0.07 Allowed 'General case' 0 C--O 1.236 0.342 0 C-N-CA 128.414 2.685 . . . . 4.24 112.758 177.756 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 35.0 t30 -73.13 79.58 1.25 Allowed 'General case' 0 N--CA 1.452 -0.354 0 O-C-N 121.321 -0.862 . . . . 8.08 110.434 178.232 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 47.9 t -76.07 -62.49 1.58 Allowed 'General case' 0 CA--C 1.535 0.378 0 C-N-CA 124.348 1.059 . . . . 3.59 111.229 179.734 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 12.2 mttt -54.19 125.98 21.18 Favored 'General case' 0 N--CA 1.467 0.383 0 O-C-N 121.219 -0.926 . . . . 7.22 109.25 -179.069 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 80.67 -44.74 0.24 Allowed 'General case' 0 CA--C 1.533 0.326 0 C-N-CA 124.971 1.308 . . . . 7.79 110.136 177.973 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER 77.18 124.68 0.04 OUTLIER 'General case' 0 CA--C 1.529 0.137 0 C-N-CA 126.692 1.997 . . . . 6.7 109.468 171.146 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER 38.55 65.79 0.1 Allowed 'Isoleucine or valine' 0 CA--C 1.539 0.527 0 C-N-CA 126.271 1.828 . . . . 3.6 112.497 173.879 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 2.9 t70 -148.01 -66.08 0.25 Allowed 'General case' 0 C--O 1.225 -0.203 0 C-N-CA 123.934 0.894 . . . . 2.31 109.319 -168.624 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 7.9 mm -44.78 -57.19 0.75 Allowed 'Isoleucine or valine' 0 CA--C 1.539 0.53 0 C-N-CA 125.53 1.532 . . . . 1.92 109.075 169.799 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 18.0 t80 -60.2 -32.44 71.1 Favored 'General case' 0 C--O 1.222 -0.36 0 O-C-N 120.219 -1.551 . . . . 0.48 112.778 176.253 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . 0.488 ' HA ' ' HE2' ' A' ' 49' ' ' LYS . 7.0 mmpt? -66.17 -48.57 70.29 Favored 'General case' 0 C--N 1.327 -0.401 0 O-C-N 119.964 -1.71 . . . . 2.18 111.227 -177.259 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 6.2 tp10 -86.96 -62.96 1.39 Allowed 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 108.117 -1.068 . . . . 2.41 108.117 -175.162 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 29.8 mp0 -68.45 -30.3 69.13 Favored 'General case' 0 C--O 1.235 0.338 0 O-C-N 121.701 -0.624 . . . . 2.38 111.041 -173.361 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . 0.41 ' HA2' ' CD1' ' A' ' 66' ' ' PHE . . . -70.37 44.67 0.59 Allowed Glycine 0 CA--C 1.529 0.948 0 C-N-CA 125.154 1.359 . . . . 0.4 113.927 169.123 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 52.3 p -150.72 31.77 0.63 Allowed 'General case' 0 N--CA 1.448 -0.563 0 O-C-N 120.879 -1.365 . . . . 2.42 109.942 159.962 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 3.4 t-20 -143.85 -44.28 0.27 Allowed 'General case' 0 N--CA 1.454 -0.269 0 N-CA-C 112.4 0.519 . . . . 2.47 112.4 -166.151 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 15.4 mt -59.96 -35.62 75.36 Favored 'General case' 0 N--CA 1.464 0.235 0 O-C-N 122.324 -0.235 . . . . 1.59 111.124 -176.714 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER 178.15 171.61 0.7 Allowed 'General case' 0 CA--C 1.532 0.257 0 C-N-CA 126.148 1.779 . . . . 1.63 106.886 179.961 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 13.2 m -61.24 -35.15 76.47 Favored 'General case' 0 N--CA 1.455 -0.214 0 O-C-N 121.599 -0.688 . . . . 1.46 110.442 168.391 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -69.3 -4.06 16.51 Favored 'General case' 0 CA--C 1.535 0.383 0 N-CA-C 112.315 0.487 . . . . 1.75 112.315 173.182 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -93.73 -6.97 61.86 Favored Glycine 0 N--CA 1.446 -0.681 0 CA-C-O 118.771 -1.016 . . . . 0.54 111.084 173.131 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 54.1 ttt180 -111.15 -17.52 13.2 Favored 'General case' 0 C--O 1.23 0.076 0 CA-C-N 119.14 1.47 . . . . 4.23 111.832 179.555 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 21.7 p -61.56 -163.95 0.01 OUTLIER 'General case' 0 CA--C 1.54 0.57 0 C-N-CA 123.532 0.733 . . . . 1.98 109.73 167.976 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 2.8 m-20 -46.37 144.2 2.2 Favored 'General case' 0 CA--C 1.53 0.189 0 O-C-N 120.682 -1.262 . . . . 1.71 111.455 -176.951 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -55.38 -32.1 62.33 Favored 'General case' 0 CA--C 1.532 0.267 0 CA-C-O 121.811 0.815 . . . . 2.83 110.493 -179.604 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -59.1 -39.68 82.95 Favored 'General case' 0 N--CA 1.448 -0.572 0 C-N-CA 123.74 0.816 . . . . 1.89 112.382 176.538 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 9.3 mt-10 -71.81 -43.02 66.35 Favored 'General case' 0 C--O 1.223 -0.315 0 O-C-N 121.306 -0.871 . . . . 2.21 110.618 175.67 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 66' ' ' PHE . . . . . 0.41 ' CD1' ' HA2' ' A' ' 52' ' ' GLY . 53.3 t80 -50.01 -50.36 47.57 Favored 'General case' 0 CA--C 1.531 0.215 0 C-N-CA 123.524 0.73 . . . . 0.52 110.764 175.125 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 72.2 t80 -62.91 -45.05 94.33 Favored 'General case' 0 N--CA 1.451 -0.418 0 C-N-CA 123.738 0.815 . . . . 0.52 110.928 177.298 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -61.31 -48.89 79.29 Favored 'General case' 0 CA--C 1.537 0.455 0 O-C-N 121.078 -1.013 . . . . 1.54 111.464 -176.051 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 6.4 mm-40 -56.02 -44.12 78.41 Favored 'General case' 0 CA--C 1.515 -0.381 0 C-N-CA 124.244 1.018 . . . . 4.01 110.732 170.394 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -54.37 -43.71 71.59 Favored 'General case' 0 N--CA 1.451 -0.408 0 CA-C-O 118.662 -0.685 . . . . 1.46 109.423 -178.423 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 14.9 t80 -58.02 -52.28 66.19 Favored 'General case' 0 N--CA 1.463 0.188 0 C-N-CA 123.756 0.823 . . . . 3.22 111.995 171.849 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 4.0 tmm_? -47.14 -52.57 15.11 Favored 'General case' 0 N--CA 1.465 0.321 0 C-N-CA 123.592 0.757 . . . . 3.84 110.191 179.917 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -66.44 -37.96 86.34 Favored 'General case' 0 C--N 1.329 -0.298 0 C-N-CA 126.55 1.94 . . . . 1.74 111.003 178.297 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER -58.7 -37.57 76.38 Favored 'General case' 0 C--O 1.233 0.193 0 C-N-CA 123.385 0.674 . . . . 3.2 111.506 -172.093 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 10.0 p80 -95.43 -7.81 37.28 Favored 'General case' 0 CA--C 1.529 0.145 0 CA-C-O 116.395 -1.764 . . . . 1.25 113.503 -179.979 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 7.6 m -38.53 125.01 1.36 Allowed 'General case' 0 C--N 1.342 0.277 0 CA-C-N 120.413 1.461 . . . . 1.58 111.861 -167.006 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 2.7 p -51.94 -43.4 63.45 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 113.491 -1.686 . . . . 1.95 109.045 176.7 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 10.6 t0 -66.84 106.15 1.8 Allowed 'General case' 0 N--CA 1.448 -0.531 0 N-CA-C 108.565 -0.902 . . . . 1.97 108.565 164.132 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 5.0 t-80 -62.36 -25.47 67.93 Favored 'General case' 0 N--CA 1.454 -0.264 0 O-C-N 121.373 -0.829 . . . . 7.65 111.213 179.491 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -64.24 -43.76 93.94 Favored 'General case' 0 N--CA 1.452 -0.33 0 CA-C-N 118.988 0.813 . . . . 1.54 110.529 176.87 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 81' ' ' GLU . . . . . 0.493 ' HA ' ' HE3' ' A' ' 84' ' ' LYS . 7.5 mt-10 -49.77 -39.06 36.66 Favored 'General case' 0 CA--C 1.513 -0.451 0 C-N-CA 124.094 0.958 . . . . 2.6 111.521 176.738 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 8.4 mtp180 -62.61 -47.68 82.71 Favored 'General case' 0 C--N 1.325 -0.482 0 N-CA-C 108.707 -0.849 . . . . 3.43 108.707 177.765 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 1.6 mm? -64.81 -21.09 66.71 Favored 'General case' 0 N--CA 1.453 -0.316 0 CA-C-O 117.163 -1.398 . . . . 1.82 113.671 173.887 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 84' ' ' LYS . . . . . 0.493 ' HE3' ' HA ' ' A' ' 81' ' ' GLU . 0.0 OUTLIER -64.61 -43.52 93.48 Favored 'General case' 0 N--CA 1.463 0.202 0 CA-C-N 122.234 2.288 . . . . 3.67 107.594 170.053 . . . . . . . . 3 3 . 1 . 022 nuclear orig full ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 68.3 t -63.18 -59.23 4.69 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.603 0 CA-C-O 117.267 -1.349 . . . . 1.53 110.792 173.786 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 15.5 mt-30 -53.84 -44.15 70.05 Favored 'General case' 0 N--CA 1.465 0.286 0 CA-C-N 122.14 2.246 . . . . 2.28 112.29 -176.415 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 34.2 tttm -57.33 -48.24 79.48 Favored 'General case' 0 N--CA 1.449 -0.493 0 O-C-N 121.306 -0.871 . . . . 2.95 110.903 178.139 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 6.3 m-20 -90.12 -0.37 57.57 Favored 'General case' 0 C--N 1.328 -0.327 0 C-N-CA 122.584 0.353 . . . . 1.48 111.037 -174.635 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -168.48 57.62 0.35 Allowed Pre-proline 0 CA--C 1.536 0.418 0 C-N-CA 124.876 1.27 . . . . 1.76 109.764 -163.789 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 34.3 Cg_endo -61.12 -36.33 81.87 Favored 'Trans proline' 0 N--CA 1.455 -0.744 0 C-N-CA 121.87 1.713 . . . . 2.32 109.501 -174.302 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 2.6 ptpt -75.82 -44.85 39.07 Favored 'General case' 0 N--CA 1.449 -0.489 0 C-N-CA 124.498 1.119 . . . . 3.35 112.342 177.706 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 3.6 m -58.64 -45.13 89.95 Favored 'General case' 0 N--CA 1.463 0.178 0 CA-C-N 120.355 1.434 . . . . 1.52 110.675 -176.424 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 17.2 t80 -59.46 -49.53 77.44 Favored 'General case' 0 CA--C 1.508 -0.657 0 CA-C-O 120.99 0.424 . . . . 3.67 110.083 178.267 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 26.1 tt0 -57.79 -28.72 64.26 Favored 'General case' 0 N--CA 1.445 -0.713 0 CA-C-N 115.283 -0.871 . . . . 1.77 110.449 -178.64 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 8.7 t80 -64.37 -57.79 8.33 Favored 'General case' 0 N--CA 1.452 -0.348 0 C-N-CA 123.683 0.793 . . . . 1.62 110.445 -176.579 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 3.7 mp -58.05 -39.45 72.5 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.187 0 N-CA-C 108.894 -0.78 . . . . 1.99 108.894 174.79 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 14.4 t30 -62.6 -30.83 71.63 Favored 'General case' 0 CA--C 1.536 0.412 0 O-C-N 121.55 -0.719 . . . . 2.15 111.601 -178.869 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 2.1 t0 -67.25 -55.21 14.93 Favored 'General case' 0 C--O 1.23 0.079 0 C-N-CA 125.306 1.442 . . . . 2.23 108.544 174.899 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 29.1 mm-40 -84.58 84.28 7.72 Favored 'General case' 0 N--CA 1.448 -0.547 0 CA-C-O 121.694 0.759 . . . . 4.05 109.932 -178.108 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 8.5 pt -47.38 135.68 3.64 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.388 0 CA-C-N 115.225 -0.898 . . . . 7.09 110.799 175.363 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 22.2 pttt -47.97 -31.56 5.44 Favored 'General case' 0 N--CA 1.464 0.248 0 N-CA-C 114.873 1.434 . . . . 10.5 114.873 -172.587 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 102' ' ' PHE . . . . . . . . . . . . . 71.7 t80 28.92 74.11 0.04 OUTLIER 'General case' 0 CA--C 1.536 0.42 0 C-N-CA 127.048 2.139 . . . . 10.57 113.294 171.707 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 14.5 tt -130.98 44.24 0.59 Allowed 'Isoleucine or valine' 0 CA--C 1.533 0.292 0 CA-C-O 121.494 0.664 . . . . 5.56 109.359 -174.276 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 104' ' ' ILE . . . . . . . . . . . . . 48.9 mm 68.45 154.76 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.536 0.412 0 C-N-CA 125.965 1.706 . . . . 8.74 110.577 -171.325 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 3.4 t-20 72.07 158.34 0.2 Allowed 'General case' 0 CA--C 1.537 0.458 0 C-N-CA 125.992 1.717 . . . . 8.32 110.465 -174.513 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 13.1 p . . . . . 0 C--O 1.252 1.208 0 CA-C-O 114.831 -2.509 . . . . 13.17 107.739 -174.478 . . . . . . . . 0 0 . 1 . 023 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.471 1.014 0 N-CA-C 108.823 -1.711 . . . . 16.47 108.823 . . . . . . . . . 0 0 . 1 . 023 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 7.1 m -107.19 -62.81 1.36 Allowed 'General case' 0 C--O 1.226 -0.176 0 CA-C-N 118.106 0.953 . . . . 18.43 111.267 -169.269 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -151.21 148.25 28.0 Favored 'General case' 0 N--CA 1.454 -0.235 0 N-CA-C 105.579 -2.008 . . . . 21.2 105.579 172.456 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 43.18 75.95 0.13 Allowed Glycine 0 C--N 1.336 0.564 0 C-N-CA 124.806 1.193 . . . . 15.42 114.008 176.142 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 21.5 m -76.01 -173.48 0.15 Allowed 'Isoleucine or valine' 0 N--CA 1.443 -0.776 0 C-N-CA 119.715 -0.794 . . . . 15.15 110.629 171.578 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 31.8 mt-10 -107.33 106.57 17.07 Favored 'General case' 0 N--CA 1.448 -0.561 0 O-C-N 121.843 -0.536 . . . . 11.84 110.925 -167.773 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -84.1 33.36 0.49 Allowed 'General case' 0 CA--C 1.536 0.433 0 C-N-CA 123.198 0.599 . . . . 12.34 110.582 -173.235 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 6.3 mmm180 -143.56 -72.79 0.28 Allowed 'General case' 0 N--CA 1.45 -0.459 0 C-N-CA 127.803 2.441 . . . . 7.26 106.835 -179.693 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 23.5 m-20 -54.93 -34.67 63.41 Favored 'General case' 0 CA--C 1.516 -0.333 0 C-N-CA 123.302 0.641 . . . . 4.38 112.442 178.337 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 20.4 t70 -66.87 -36.11 81.55 Favored 'General case' 0 C--O 1.222 -0.394 0 CA-C-N 119.176 0.898 . . . . 3.54 110.897 178.829 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 9.0 m -70.89 -51.5 25.84 Favored 'General case' 0 CA--C 1.534 0.335 0 O-C-N 121.18 -0.95 . . . . 3.26 111.713 178.162 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 2.4 mt-10 -68.57 -28.13 66.68 Favored 'General case' 0 N--CA 1.464 0.26 0 O-C-N 121.13 -0.981 . . . . 5.79 110.853 -179.62 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -69.25 -45.71 60.24 Favored Glycine 0 CA--C 1.525 0.704 0 N-CA-C 110.585 -1.006 . . . . 1.25 110.585 171.854 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 36.1 t80 -50.75 -51.62 48.48 Favored 'General case' 0 CA--C 1.515 -0.4 0 C-N-CA 125.191 1.396 . . . . 5.61 109.689 -173.521 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER -62.6 -36.22 74.07 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.32 0 O-C-N 122.064 -0.398 . . . . 1.59 111.815 -178.084 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 9.6 t60 -59.94 -55.49 33.43 Favored 'General case' 0 C--N 1.343 0.305 0 N-CA-C 107.168 -1.419 . . . . 0.65 107.168 176.715 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 43.6 mt-10 -58.7 -32.45 69.18 Favored 'General case' 0 N--CA 1.456 -0.173 0 C-N-CA 123.463 0.705 . . . . 1.96 112.251 -179.626 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 24.8 t80 -59.94 -40.75 90.03 Favored 'General case' 0 CA--C 1.517 -0.292 0 CA-C-N 118.797 0.726 . . . . 5.4 109.2 177.213 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -52.04 -46.98 55.5 Favored Glycine 0 CA--C 1.53 0.981 0 C-N-CA 120.622 -0.799 . . . . 0.67 111.452 170.583 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 42.3 m-70 -58.18 -47.11 84.44 Favored 'General case' 0 N--CA 1.464 0.262 0 CA-C-N 119.119 1.46 . . . . 5.14 111.384 176.121 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -59.43 -30.54 68.55 Favored 'General case' 0 N--CA 1.454 -0.267 0 O-C-N 122.105 -0.372 . . . . 1.96 110.943 -178.619 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 77.1 t -72.21 -42.33 66.51 Favored 'Isoleucine or valine' 0 C--O 1.232 0.146 0 O-C-N 121.205 -0.934 . . . . 2.12 110.5 177.581 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -53.57 -30.99 44.88 Favored 'General case' 0 C--N 1.329 -0.298 0 C-N-CA 123.195 0.598 . . . . 2.21 110.893 172.011 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 8.5 t70 -65.17 -51.22 62.46 Favored 'General case' 0 N--CA 1.455 -0.189 0 N-CA-C 108.522 -0.918 . . . . 2.49 108.522 -174.003 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -52.28 -47.33 65.93 Favored 'General case' 0 CA--C 1.523 -0.092 0 C-N-CA 123.52 0.728 . . . . 3.96 110.404 176.38 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -57.84 -39.38 77.58 Favored 'General case' 0 N--CA 1.45 -0.452 0 CA-C-O 119.312 -0.375 . . . . 2.28 111.223 179.134 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -85.53 -10.3 77.12 Favored Glycine 0 CA--C 1.526 0.764 0 CA-C-N 118.969 0.804 . . . . 1.66 112.952 -178.725 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -80.59 -45.61 17.06 Favored 'General case' 0 N--CA 1.452 -0.354 0 CA-C-N 118.216 1.008 . . . . 3.54 108.346 175.595 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -82.92 -35.21 26.28 Favored 'General case' 0 N--CA 1.449 -0.504 0 C-N-CA 124.925 1.29 . . . . 2.52 112.35 -178.17 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 4.0 mt -119.79 176.57 5.33 Favored 'General case' 0 CA--C 1.535 0.395 0 N-CA-C 107.662 -1.236 . . . . 3.1 107.662 -172.311 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 70.4 m-20 52.45 -132.97 1.88 Allowed 'General case' 0 CA--C 1.534 0.346 0 C-N-CA 124.094 0.957 . . . . 5.2 112.076 177.68 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . 0.454 ' HE3' ' CA ' ' A' ' 32' ' ' LYS . 0.0 OUTLIER -113.54 117.31 31.3 Favored 'General case' 0 C--N 1.341 0.235 0 CA-C-N 120.595 1.543 . . . . 8.54 108.127 178.775 . . . . . . . . 3 3 . 1 . 023 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 39.8 t30 -74.52 78.0 1.95 Allowed 'General case' 0 N--CA 1.454 -0.251 0 O-C-N 121.834 -0.542 . . . . 13.96 110.938 177.509 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 20.7 tt0 -162.38 56.25 0.23 Allowed 'General case' 0 CA--C 1.533 0.315 0 N-CA-C 109.63 -0.507 . . . . 10.91 109.63 168.714 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 1.5 t 66.04 63.67 0.56 Allowed 'General case' 0 CA--C 1.533 0.315 0 CA-C-O 121.95 0.881 . . . . 9.99 110.798 -179.662 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 50.6 t0 -121.94 -52.5 1.99 Allowed 'General case' 0 C--O 1.234 0.254 0 C-N-CA 125.181 1.392 . . . . 6.09 108.77 -174.507 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 4.8 mp 68.3 166.37 0.25 Allowed 'General case' 0 CA--C 1.536 0.406 0 C-N-CA 126.453 1.901 . . . . 2.8 108.674 179.394 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 10.9 p -84.7 39.89 0.05 OUTLIER 'Isoleucine or valine' 0 N--CA 1.471 0.598 0 O-C-N 120.342 -1.474 . . . . 2.76 110.592 -174.195 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 33.0 p -90.64 -61.75 1.61 Allowed 'General case' 0 N--CA 1.448 -0.57 0 CA-C-O 123.224 1.487 . . . . 4.41 109.215 -162.09 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 10.6 p30 -83.51 -10.26 58.44 Favored 'General case' 0 N--CA 1.449 -0.491 0 C-N-CA 124.863 1.265 . . . . 8.35 111.88 -174.748 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 45.4 m -132.09 80.13 1.9 Allowed 'General case' 0 C--O 1.224 -0.285 0 C-N-CA 123.655 0.782 . . . . 6.3 110.103 -174.641 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 11.3 tmtt? -144.84 -63.4 0.35 Allowed 'General case' 0 CA--C 1.519 -0.215 0 O-C-N 121.328 -0.857 . . . . 6.38 109.692 173.585 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 29.3 tttt -141.0 67.92 1.35 Allowed 'General case' 0 C--O 1.222 -0.371 0 N-CA-C 108.179 -1.045 . . . . 6.55 108.179 175.178 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER 37.5 46.0 0.63 Allowed 'General case' 0 CA--C 1.541 0.614 0 C-N-CA 125.346 1.458 . . . . 6.62 113.202 176.605 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER 34.28 57.22 0.15 Allowed 'Isoleucine or valine' 0 CA--C 1.541 0.614 0 C-N-CA 126.29 1.836 . . . . 3.94 113.27 -172.501 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 9.1 t70 -76.36 -63.27 1.37 Allowed 'General case' 0 CA--C 1.529 0.147 0 C-N-CA 125.611 1.564 . . . . 2.52 110.057 177.547 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 3.6 mm -51.1 -59.65 1.19 Allowed 'Isoleucine or valine' 0 CA--C 1.535 0.396 0 C-N-CA 125.81 1.644 . . . . 1.67 109.321 -174.067 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 24.8 t80 -54.94 -34.67 63.44 Favored 'General case' 0 C--N 1.329 -0.316 0 O-C-N 121.365 -0.835 . . . . 0.56 112.558 177.878 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . 0.504 ' HA ' ' HE2' ' A' ' 49' ' ' LYS . 0.1 OUTLIER -65.59 -40.54 92.81 Favored 'General case' 0 N--CA 1.452 -0.356 0 O-C-N 120.365 -1.459 . . . . 2.09 111.581 -176.127 . . . . . . . . 3 3 . 1 . 023 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 4.9 tp10 -89.68 -65.78 0.98 Allowed 'General case' 0 N--CA 1.452 -0.362 0 N-CA-C 108.834 -0.802 . . . . 2.12 108.834 -178.719 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . 0.453 ' OE1' ' HE2' ' A' ' 91' ' ' LYS . 9.9 mp0 -68.49 -27.71 66.37 Favored 'General case' 0 C--O 1.234 0.285 0 O-C-N 121.478 -0.764 . . . . 3.09 111.109 -171.795 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . 0.422 ' HA2' ' CD1' ' A' ' 66' ' ' PHE . . . -67.99 37.29 0.24 Allowed Glycine 0 CA--C 1.53 1.01 0 C-N-CA 125.254 1.407 . . . . 0.36 114.018 169.81 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 59.6 p -146.62 20.77 1.32 Allowed 'General case' 0 N--CA 1.448 -0.559 0 O-C-N 120.695 -1.473 . . . . 2.71 111.485 159.996 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 46.8 t30 -130.93 -38.34 1.26 Allowed 'General case' 0 C--N 1.342 0.245 0 N-CA-C 112.954 0.724 . . . . 2.74 112.954 -165.227 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 22.9 mt -68.36 -36.23 78.91 Favored 'General case' 0 N--CA 1.463 0.198 0 O-C-N 121.434 -0.791 . . . . 1.76 110.615 -178.36 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 1.4 t 176.93 169.95 0.52 Allowed 'General case' 0 CA--C 1.53 0.189 0 C-N-CA 125.313 1.445 . . . . 1.64 108.043 -175.155 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 8.2 m -61.24 -31.3 71.09 Favored 'General case' 0 N--CA 1.453 -0.285 0 C-N-CA 123.466 0.707 . . . . 1.28 110.909 170.296 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -64.63 -23.13 67.16 Favored 'General case' 0 N--CA 1.464 0.237 0 CA-C-O 121.089 0.471 . . . . 1.59 111.253 173.269 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -74.51 -12.77 82.23 Favored Glycine 0 N--CA 1.443 -0.89 0 CA-C-O 118.722 -1.044 . . . . 0.53 111.313 175.156 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 60.0 ttt-85 -110.02 -16.01 13.92 Favored 'General case' 0 C--O 1.23 0.075 0 CA-C-N 119.177 1.489 . . . . 3.17 112.76 -177.623 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 1.5 p -60.71 -169.21 0.01 OUTLIER 'General case' 0 CA--C 1.536 0.436 0 C-N-CA 122.487 0.315 . . . . 2.12 110.281 166.645 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 5.3 m120 -45.92 147.29 1.02 Allowed 'General case' 0 C--N 1.341 0.211 0 O-C-N 121.346 -0.846 . . . . 2.43 111.065 179.606 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 14.1 tm-20 -61.44 -28.89 69.59 Favored 'General case' 0 CA--C 1.533 0.321 0 CA-C-O 120.649 0.261 . . . . 3.38 111.017 -173.999 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -52.36 -37.15 55.49 Favored 'General case' 0 CA--C 1.52 -0.203 0 N-CA-C 113.414 0.894 . . . . 1.67 113.414 171.854 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 2.3 mm-40 -84.89 -35.96 21.83 Favored 'General case' 0 C--N 1.322 -0.613 0 C-N-CA 124.468 1.107 . . . . 2.59 110.039 -173.84 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 66' ' ' PHE . . . . . 0.422 ' CD1' ' HA2' ' A' ' 52' ' ' GLY . 67.9 t80 -53.02 -50.47 64.2 Favored 'General case' 0 N--CA 1.453 -0.284 0 C-N-CA 124.403 1.081 . . . . 0.35 111.219 166.555 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 77.5 t80 -63.03 -48.14 80.03 Favored 'General case' 0 CA--C 1.535 0.375 0 O-C-N 121.237 -0.915 . . . . 0.45 110.432 178.424 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -61.66 -53.47 55.67 Favored 'General case' 0 CA--C 1.536 0.426 0 N-CA-C 114.106 1.151 . . . . 1.51 114.106 -176.524 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -58.81 -40.23 83.48 Favored 'General case' 0 C--N 1.329 -0.29 0 O-C-N 121.019 -1.051 . . . . 3.69 110.821 174.094 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -55.93 -42.04 75.51 Favored 'General case' 0 C--O 1.222 -0.35 0 CA-C-N 118.52 0.6 . . . . 1.93 110.326 174.258 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -54.56 -51.44 65.23 Favored 'General case' 0 N--CA 1.464 0.229 0 C-N-CA 123.943 0.897 . . . . 4.4 111.375 172.45 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 52.2 ttt-85 -51.96 -50.13 61.83 Favored 'General case' 0 N--CA 1.462 0.148 0 CA-C-N 117.918 0.326 . . . . 3.2 110.206 179.363 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -68.7 -30.81 69.55 Favored 'General case' 0 C--N 1.328 -0.351 0 C-N-CA 124.389 1.075 . . . . 1.96 110.938 -178.388 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 2.4 ttp -63.73 -34.54 78.1 Favored 'General case' 0 N--CA 1.454 -0.244 0 C-N-CA 123.267 0.627 . . . . 3.55 111.059 -174.614 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 10.0 p80 -99.21 1.46 44.85 Favored 'General case' 0 CA--C 1.531 0.227 0 CA-C-O 116.663 -1.637 . . . . 1.46 113.724 178.679 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 6.7 m -42.31 120.37 1.62 Allowed 'General case' 0 C--N 1.343 0.304 0 CA-C-N 120.573 1.533 . . . . 2.01 110.473 -171.843 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 2.7 p -48.34 -43.88 33.79 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 113.744 -1.571 . . . . 2.35 109.064 178.449 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 11.7 t0 -69.72 105.91 2.9 Favored 'General case' 0 N--CA 1.446 -0.652 0 CA-C-O 122.006 0.908 . . . . 1.99 109.291 163.942 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 49.4 p-80 -49.38 -38.4 28.46 Favored 'General case' 0 N--CA 1.453 -0.285 0 CA-C-N 115.476 -0.784 . . . . 5.48 111.98 173.605 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -61.52 -42.41 98.77 Favored 'General case' 0 C--N 1.331 -0.209 0 O-C-N 121.689 -0.632 . . . . 1.89 110.778 -177.741 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 18.7 mm-40 -53.77 -36.87 62.86 Favored 'General case' 0 N--CA 1.451 -0.424 0 C-N-CA 123.183 0.593 . . . . 4.41 111.964 175.429 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 14.6 mtp180 -65.06 -46.26 81.93 Favored 'General case' 0 C--N 1.325 -0.471 0 C-N-CA 119.022 -1.071 . . . . 3.17 108.683 176.861 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 1.6 mm? -62.29 -23.17 66.58 Favored 'General case' 0 N--CA 1.455 -0.195 0 CA-C-O 117.724 -1.132 . . . . 1.49 112.909 175.88 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 2.4 mptm? -60.98 -46.15 91.93 Favored 'General case' 0 CA--C 1.516 -0.329 0 CA-C-N 120.922 1.692 . . . . 2.46 108.18 169.891 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 90.3 t -62.12 -61.08 1.79 Allowed 'Isoleucine or valine' 0 N--CA 1.45 -0.463 0 CA-C-O 118.141 -0.933 . . . . 1.81 109.951 176.448 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 2.5 mt-30 -50.03 -49.67 50.16 Favored 'General case' 0 CA--C 1.53 0.183 0 CA-C-N 119.842 1.201 . . . . 2.44 111.88 -173.058 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 13.2 ptpt -65.99 -40.37 91.12 Favored 'General case' 0 N--CA 1.456 -0.157 0 O-C-N 121.896 -0.503 . . . . 5.27 111.055 -176.227 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 52.1 m-20 -79.43 -10.78 59.88 Favored 'General case' 0 N--CA 1.461 0.105 0 N-CA-C 112.051 0.389 . . . . 2.5 112.051 -179.694 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -155.7 71.48 5.38 Favored Pre-proline 0 N--CA 1.446 -0.64 0 C-N-CA 124.409 1.084 . . . . 1.64 109.413 -170.568 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 76.5 Cg_endo -81.13 60.49 7.85 Favored 'Trans proline' 0 N--CA 1.459 -0.552 0 C-N-CA 124.506 3.471 . . . . 1.7 110.822 -173.769 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 91' ' ' LYS . . . . . 0.453 ' HE2' ' OE1' ' A' ' 51' ' ' GLU . 5.4 ptmt 175.03 -51.52 0.01 OUTLIER 'General case' 0 C--O 1.224 -0.287 0 C-N-CA 126.986 2.114 . . . . 2.79 109.716 -170.202 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 2.9 m -57.34 -44.93 84.67 Favored 'General case' 0 CA--C 1.522 -0.116 0 CA-C-N 119.286 0.948 . . . . 1.58 110.245 176.946 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 8.0 t80 -59.25 -47.46 85.27 Favored 'General case' 0 CA--C 1.506 -0.716 0 C-N-CA 120.309 -0.557 . . . . 3.07 110.391 177.709 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 54.4 tt0 -57.34 -33.83 68.16 Favored 'General case' 0 N--CA 1.44 -0.946 0 CA-C-N 115.173 -0.921 . . . . 2.16 110.594 178.085 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 6.2 t80 -62.63 -54.49 38.69 Favored 'General case' 0 C--N 1.333 -0.117 0 N-CA-C 108.645 -0.872 . . . . 1.39 108.645 -175.016 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 3.0 mp -60.34 -42.05 89.39 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.37 0 N-CA-C 108.475 -0.935 . . . . 2.01 108.475 176.677 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 3.2 t30 -62.32 -25.99 68.18 Favored 'General case' 0 CA--C 1.535 0.377 0 CA-C-N 118.413 0.551 . . . . 2.21 111.857 -177.305 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 7.8 t70 -74.79 -43.15 56.31 Favored 'General case' 0 C--O 1.228 -0.07 0 C-N-CA 124.627 1.171 . . . . 2.17 109.202 176.609 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 45.0 mm-40 -68.71 -54.61 15.1 Favored 'General case' 0 N--CA 1.451 -0.421 0 CA-C-N 115.591 -0.731 . . . . 3.02 111.007 -175.95 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 9.0 tp -71.3 113.37 7.65 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.44 0 N-CA-C 108.581 -0.896 . . . . 6.87 108.581 -174.316 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 23.5 tttt -146.6 -55.39 0.26 Allowed 'General case' 0 N--CA 1.453 -0.289 0 N-CA-C 108.626 -0.879 . . . . 10.02 108.626 -179.721 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 102' ' ' PHE . . . . . . . . . . . . . 7.9 p90 -145.99 121.81 10.59 Favored 'General case' 0 N--CA 1.45 -0.45 0 N-CA-C 106.604 -1.628 . . . . 9.78 106.604 174.699 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -152.84 129.15 1.83 Allowed 'Isoleucine or valine' 0 N--CA 1.448 -0.536 0 N-CA-C 105.356 -2.09 . . . . 4.53 105.356 174.345 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 104' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER 29.63 78.19 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.539 0.528 0 C-N-CA 127.487 2.315 . . . . 6.2 112.711 -178.646 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 3.2 m120 -53.68 128.32 29.02 Favored 'General case' 0 C--O 1.232 0.135 0 CA-C-N 116.065 -0.516 . . . . 10.53 109.887 176.779 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 27.4 t . . . . . 0 C--O 1.252 1.212 0 C-N-CA 125.312 1.445 . . . . 9.56 107.225 177.532 . . . . . . . . 0 0 . 1 . 024 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.472 1.063 0 N-CA-C 110.232 -1.147 . . . . 13.89 110.232 . . . . . . . . . 0 0 . 1 . 024 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 4.2 m -159.13 -30.88 0.07 Allowed 'General case' 0 N--CA 1.468 0.445 0 CA-C-N 118.274 1.037 . . . . 15.2 112.729 178.203 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -145.84 163.12 36.04 Favored 'General case' 0 N--CA 1.45 -0.429 0 N-CA-C 106.879 -1.526 . . . . 17.7 106.879 176.388 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 150.23 179.62 26.18 Favored Glycine 0 N--CA 1.45 -0.374 0 N-CA-C 108.605 -1.798 . . . . 15.64 108.605 -178.936 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -72.45 -176.68 0.21 Allowed 'Isoleucine or valine' 0 N--CA 1.449 -0.505 0 CA-C-O 121.584 0.707 . . . . 16.47 111.097 173.067 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 9.9 pt-20 -89.91 111.01 21.93 Favored 'General case' 0 N--CA 1.442 -0.83 0 CA-C-O 122.999 1.381 . . . . 11.82 110.878 179.389 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -151.04 47.58 0.84 Allowed 'General case' 0 N--CA 1.447 -0.59 0 C-N-CA 126.414 1.886 . . . . 10.74 107.306 178.205 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 9.6 mtp85 59.36 37.62 23.28 Favored 'General case' 0 CA--C 1.532 0.276 0 C-N-CA 123.59 0.756 . . . . 7.64 111.814 -176.381 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -49.65 -37.17 27.25 Favored 'General case' 0 N--CA 1.468 0.475 0 C-N-CA 124.628 1.171 . . . . 4.12 111.568 175.99 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 4.2 t70 -59.71 -53.04 62.64 Favored 'General case' 0 N--CA 1.446 -0.648 0 C-N-CA 123.466 0.706 . . . . 2.46 111.163 175.79 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 5.1 t -66.79 -52.15 47.4 Favored 'General case' 0 N--CA 1.452 -0.364 0 CA-C-O 121.365 0.602 . . . . 2.09 109.911 -173.226 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 9.7 pt-20 -70.39 -30.98 68.02 Favored 'General case' 0 C--O 1.227 -0.09 0 O-C-N 121.817 -0.552 . . . . 4.42 109.593 -178.835 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -60.73 -42.21 99.32 Favored Glycine 0 N--CA 1.448 -0.537 0 N-CA-C 110.385 -1.086 . . . . 1.18 110.385 174.443 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -58.23 -57.47 12.74 Favored 'General case' 0 N--CA 1.455 -0.193 0 CA-C-O 122.071 0.939 . . . . 4.01 109.17 -176.532 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER -71.4 -29.3 34.86 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.453 0 CA-C-N 115.867 -0.606 . . . . 1.9 111.641 -176.249 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 3.9 t60 -59.96 -53.37 58.69 Favored 'General case' 0 N--CA 1.453 -0.303 0 N-CA-C 106.749 -1.575 . . . . 1.12 106.749 176.759 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 13.0 mm-40 -63.37 -30.72 71.8 Favored 'General case' 0 N--CA 1.449 -0.501 0 CA-C-O 117.943 -1.027 . . . . 4.6 111.672 -177.13 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 1.0 OUTLIER -53.37 -54.55 35.01 Favored 'General case' 0 N--CA 1.464 0.24 0 CA-C-N 119.975 1.261 . . . . 3.58 111.085 168.042 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -48.81 -47.19 31.3 Favored Glycine 0 CA--C 1.524 0.594 0 N-CA-C 109.808 -1.317 . . . . 0.98 109.808 174.997 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 1.8 t-160 -63.28 -41.65 99.03 Favored 'General case' 0 N--CA 1.447 -0.577 0 N-CA-C 113.295 0.85 . . . . 2.65 113.295 -176.565 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -65.93 -30.98 71.65 Favored 'General case' 0 N--CA 1.449 -0.506 0 C-N-CA 123.734 0.814 . . . . 2.22 109.238 -178.759 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 93.5 t -68.52 -37.1 77.25 Favored 'Isoleucine or valine' 0 C--O 1.233 0.222 0 C-N-CA 118.57 -1.252 . . . . 2.48 110.27 173.589 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 1.7 t70 -61.99 -24.92 67.32 Favored 'General case' 0 C--N 1.331 -0.217 0 N-CA-C 111.968 0.359 . . . . 2.05 111.968 173.291 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 24.8 t70 -67.98 -51.79 43.26 Favored 'General case' 0 C--O 1.221 -0.413 0 N-CA-C 108.6 -0.889 . . . . 2.19 108.6 -176.396 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 35.6 t80 -50.43 -55.01 17.7 Favored 'General case' 0 CA--C 1.522 -0.129 0 C-N-CA 123.485 0.714 . . . . 5.56 110.332 172.892 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -54.72 -40.84 69.64 Favored 'General case' 0 N--CA 1.451 -0.388 0 C-N-CA 119.963 -0.695 . . . . 2.67 111.353 -177.916 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -65.92 -54.11 26.73 Favored Glycine 0 C--N 1.336 0.547 0 CA-C-N 119.318 0.963 . . . . 1.74 111.593 178.416 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -44.71 -42.35 7.55 Favored 'General case' 0 N--CA 1.456 -0.171 0 C-N-CA 126.223 1.809 . . . . 3.64 111.13 -179.29 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 3.3 mm? -90.94 -25.43 19.77 Favored 'General case' 0 N--CA 1.446 -0.631 0 CA-C-O 118.637 -0.697 . . . . 3.79 112.482 -177.82 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 14.5 mt -130.49 72.2 1.49 Allowed 'General case' 0 CA--C 1.534 0.334 0 CA-C-N 118.953 0.797 . . . . 4.78 110.187 -168.899 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 5.5 t0 -136.32 156.42 48.67 Favored 'General case' 0 N--CA 1.462 0.153 0 N-CA-C 108.129 -1.063 . . . . 6.37 108.129 171.003 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -137.08 23.75 3.03 Favored 'General case' 0 CA--C 1.536 0.422 0 C-N-CA 124.545 1.138 . . . . 10.69 109.264 -178.769 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 8.9 t-20 -139.75 -178.9 5.63 Favored 'General case' 0 CA--C 1.536 0.423 0 C-N-CA 125.09 1.356 . . . . 8.06 108.62 -175.933 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -82.44 -6.88 59.57 Favored 'General case' 0 CA--C 1.535 0.402 0 CA-C-N 118.817 0.735 . . . . 10.16 111.098 173.095 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 3.5 t -66.92 -174.72 0.35 Allowed 'General case' 0 CA--C 1.535 0.385 0 CA-C-N 118.338 0.517 . . . . 6.12 110.702 173.389 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 9.2 t0 -150.12 165.41 32.89 Favored 'General case' 0 CA--C 1.534 0.334 0 N-CA-C 107.932 -1.136 . . . . 6.88 107.932 175.381 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 1.1 mt 70.24 141.19 0.05 OUTLIER 'General case' 0 N--CA 1.465 0.293 0 C-N-CA 127.755 2.422 . . . . 4.01 110.47 -172.076 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 7.5 p -71.27 7.65 0.42 Allowed 'Isoleucine or valine' 0 CA--C 1.544 0.72 0 O-C-N 120.698 -1.251 . . . . 3.72 112.576 -176.404 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 14.2 t -53.72 -19.73 4.55 Favored 'General case' 0 CA--C 1.533 0.321 0 C-N-CA 125.44 1.496 . . . . 4.77 113.038 176.662 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 49.8 p30 -91.97 17.81 8.78 Favored 'General case' 0 CA--C 1.533 0.32 0 C-N-CA 123.785 0.834 . . . . 10.1 112.079 -179.268 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 4.8 t -158.6 -63.31 0.08 Allowed 'General case' 0 N--CA 1.456 -0.148 0 O-C-N 121.666 -0.646 . . . . 4.52 109.663 -175.496 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . 0.407 ' HE3' ' HA ' ' A' ' 42' ' ' LYS . 0.1 OUTLIER 42.72 43.98 3.57 Favored 'General case' 0 N--CA 1.454 -0.229 0 C-N-CA 126.205 1.802 . . . . 12.1 111.749 -172.257 . . . . . . . . 3 3 . 1 . 024 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 73.31 -65.84 0.34 Allowed 'General case' 0 N--CA 1.468 0.461 0 C-N-CA 124.299 1.04 . . . . 12.25 109.566 178.133 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 16.5 m-85 -140.28 131.3 26.24 Favored 'General case' 0 N--CA 1.453 -0.304 0 CA-C-N 119.158 0.89 . . . . 9.45 109.123 169.602 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 0.6 OUTLIER -81.78 69.39 0.56 Allowed 'Isoleucine or valine' 0 CA--C 1.542 0.65 0 CA-C-O 121.751 0.786 . . . . 3.83 108.912 176.548 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 5.0 t70 -127.67 -54.75 1.33 Allowed 'General case' 0 N--CA 1.47 0.553 0 C-N-CA 126.154 1.782 . . . . 2.54 108.557 -179.397 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 47' ' ' ILE . . . . . 0.414 HD13 ' HE2' ' A' ' 91' ' ' LYS . 5.1 mm -49.17 -56.15 3.03 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.478 0 C-N-CA 125.976 1.71 . . . . 1.84 108.229 176.903 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 26.4 t80 -63.38 -30.35 71.5 Favored 'General case' 0 C--N 1.328 -0.351 0 O-C-N 120.51 -1.369 . . . . 1.03 113.052 175.803 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . 0.435 ' HA ' ' HE2' ' A' ' 49' ' ' LYS . 0.4 OUTLIER -63.67 -50.72 68.13 Favored 'General case' 0 C--N 1.33 -0.252 0 O-C-N 120.138 -1.601 . . . . 2.69 110.76 -178.898 . . . . . . . . 3 3 . 1 . 024 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 17.3 tt0 -90.63 -53.41 4.43 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.957 0.408 . . . . 3.78 110.024 -171.823 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 10.0 mp0 -74.07 -29.66 61.99 Favored 'General case' 0 C--O 1.235 0.303 0 O-C-N 121.249 -0.907 . . . . 2.78 110.6 -176.978 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . 0.438 ' HA2' ' CD1' ' A' ' 66' ' ' PHE . . . -71.16 33.69 0.53 Allowed Glycine 0 CA--C 1.528 0.878 0 C-N-CA 124.613 1.101 . . . . 0.62 114.306 173.462 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 44.7 t -149.15 43.19 0.95 Allowed 'General case' 0 N--CA 1.447 -0.595 0 N-CA-C 107.678 -1.231 . . . . 2.31 107.678 158.592 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -145.4 -44.41 0.22 Allowed 'General case' 0 CA--C 1.518 -0.286 0 N-CA-C 113.226 0.824 . . . . 3.0 113.226 -176.436 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 19.3 mt -55.72 -40.63 72.7 Favored 'General case' 0 N--CA 1.462 0.16 0 CA-C-O 121.118 0.485 . . . . 1.64 111.445 -174.879 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -179.79 162.1 1.03 Allowed 'General case' 0 C--N 1.329 -0.309 0 N-CA-C 106.855 -1.535 . . . . 1.59 106.855 -178.254 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 74.3 m -59.11 -33.47 70.88 Favored 'General case' 0 N--CA 1.456 -0.151 0 O-C-N 122.155 -0.341 . . . . 1.83 110.235 171.779 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -61.71 -39.51 91.74 Favored 'General case' 0 C--O 1.226 -0.161 0 O-C-N 121.786 -0.571 . . . . 1.61 110.255 177.149 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -74.44 -2.02 62.44 Favored Glycine 0 CA--C 1.526 0.737 0 C-N-CA 123.613 0.625 . . . . 1.09 112.313 -179.956 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 59.9 ttt180 -97.33 -7.13 32.71 Favored 'General case' 0 N--CA 1.452 -0.361 0 CA-C-N 117.965 0.883 . . . . 5.22 111.561 174.46 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 1.6 t -63.53 -167.24 0.02 OUTLIER 'General case' 0 CA--C 1.53 0.18 0 CA-C-O 121.574 0.702 . . . . 4.71 110.233 166.908 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 2.3 m120 -46.71 150.56 0.69 Allowed 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 121.279 0.561 . . . . 3.41 111.166 170.344 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 12.6 tm-20 -53.87 -24.38 15.7 Favored 'General case' 0 CA--C 1.537 0.451 0 C-N-CA 124.098 0.959 . . . . 4.28 111.667 -177.877 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -47.11 -57.46 5.06 Favored 'General case' 0 N--CA 1.45 -0.465 0 C-N-CA 125.215 1.406 . . . . 2.23 113.738 169.763 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 3.3 mt-10 -85.55 -19.49 31.04 Favored 'General case' 0 CA--C 1.514 -0.434 0 C-N-CA 118.01 -1.476 . . . . 3.17 110.798 -175.824 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 66' ' ' PHE . . . . . 0.438 ' CD1' ' HA2' ' A' ' 52' ' ' GLY . 68.3 t80 -55.35 -51.56 66.39 Favored 'General case' 0 N--CA 1.449 -0.497 0 CA-C-N 118.277 0.49 . . . . 0.64 110.117 166.883 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 87.7 t80 -69.24 -47.17 65.49 Favored 'General case' 0 N--CA 1.445 -0.692 0 C-N-CA 123.58 0.752 . . . . 0.7 110.188 -176.981 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -65.18 -45.93 82.85 Favored 'General case' 0 CA--C 1.538 0.493 0 O-C-N 121.757 -0.589 . . . . 1.66 111.575 -175.747 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 9.4 mm-40 -61.37 -42.21 98.34 Favored 'General case' 0 N--CA 1.462 0.151 0 O-C-N 121.175 -0.953 . . . . 4.76 110.541 171.442 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -57.36 -41.16 79.59 Favored 'General case' 0 C--O 1.224 -0.285 0 O-C-N 121.25 -0.906 . . . . 1.49 110.23 -179.715 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 51.1 t80 -59.66 -50.13 75.06 Favored 'General case' 0 C--O 1.231 0.083 0 CA-C-N 118.777 0.717 . . . . 5.18 111.0 174.769 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 34.4 ttt180 -47.63 -58.23 4.52 Favored 'General case' 0 N--CA 1.465 0.292 0 O-C-N 121.755 -0.59 . . . . 3.05 109.902 176.281 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -64.23 -27.45 69.06 Favored 'General case' 0 C--N 1.329 -0.325 0 C-N-CA 125.376 1.471 . . . . 1.84 110.923 -177.101 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 1.7 ttp -58.99 -42.97 91.31 Favored 'General case' 0 N--CA 1.452 -0.365 0 C-N-CA 123.12 0.568 . . . . 3.21 110.772 -178.358 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 17.0 p80 -93.55 -37.56 11.84 Favored 'General case' 0 C--O 1.225 -0.23 0 CA-C-O 115.576 -2.154 . . . . 2.23 112.34 179.792 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 2.6 m 4.19 112.22 0.0 OUTLIER 'General case' 0 N--CA 1.471 0.579 0 C-N-CA 128.285 2.634 . . . . 1.85 115.099 -176.238 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 2.0 p -43.65 -44.32 6.3 Favored 'General case' 0 N--CA 1.452 -0.354 0 C-N-CA 125.628 1.571 . . . . 2.39 111.571 177.576 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 56.9 t0 -73.98 105.36 5.19 Favored 'General case' 0 N--CA 1.454 -0.264 0 C-N-CA 117.495 -1.682 . . . . 2.33 108.827 166.639 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 4.1 p-80 -39.91 -39.12 0.78 Allowed 'General case' 0 CA--C 1.531 0.231 0 C-N-CA 124.355 1.062 . . . . 6.55 112.665 170.616 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -60.86 -44.61 96.8 Favored 'General case' 0 N--CA 1.449 -0.497 0 CA-C-O 118.983 -0.532 . . . . 2.18 110.752 -177.582 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -52.44 -38.83 60.12 Favored 'General case' 0 CA--C 1.518 -0.251 0 CA-C-O 121.222 0.534 . . . . 3.89 110.522 177.83 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -64.82 -48.52 74.07 Favored 'General case' 0 N--CA 1.451 -0.381 0 N-CA-C 108.595 -0.891 . . . . 4.41 108.595 179.799 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 1.6 mm? -62.69 -25.72 68.3 Favored 'General case' 0 N--CA 1.454 -0.233 0 CA-C-O 118.132 -0.937 . . . . 2.26 112.724 175.99 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 14.8 mttt -65.18 -44.09 89.58 Favored 'General case' 0 CA--C 1.518 -0.261 0 CA-C-N 120.528 1.513 . . . . 2.29 108.084 174.256 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 96.6 t -63.19 -60.18 3.18 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.544 0 CA-C-O 117.295 -1.336 . . . . 1.82 111.191 173.605 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 24.1 mt-30 -49.91 -51.11 43.32 Favored 'General case' 0 N--CA 1.463 0.189 0 CA-C-N 121.425 1.921 . . . . 2.94 111.827 -177.277 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.92 -37.65 88.36 Favored 'General case' 0 CA--C 1.531 0.234 0 O-C-N 121.545 -0.722 . . . . 3.89 110.933 -175.656 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 83.0 m-20 -85.45 -5.78 59.26 Favored 'General case' 0 CA--C 1.531 0.237 0 CA-C-N 118.091 0.405 . . . . 1.47 111.134 179.869 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -159.93 74.34 3.07 Favored Pre-proline 0 N--CA 1.446 -0.629 0 C-N-CA 125.016 1.326 . . . . 1.3 109.482 -173.903 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 85.3 Cg_endo -82.05 50.78 3.57 Favored 'Trans proline' 0 CA--C 1.536 0.582 0 C-N-CA 124.294 3.329 . . . . 1.65 110.96 -175.479 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 91' ' ' LYS . . . . . 0.414 ' HE2' HD13 ' A' ' 47' ' ' ILE . 0.1 OUTLIER -169.1 -57.57 0.02 OUTLIER 'General case' 0 N--CA 1.451 -0.393 0 C-N-CA 126.777 2.031 . . . . 3.09 108.28 -174.189 . . . . . . . . 3 3 . 1 . 024 nuclear orig full ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 3.9 m -50.15 -45.5 53.27 Favored 'General case' 0 N--CA 1.464 0.226 0 C-N-CA 123.835 0.854 . . . . 1.53 112.276 178.02 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 16.6 t80 -57.31 -50.75 71.94 Favored 'General case' 0 CA--C 1.512 -0.507 0 CA-C-O 121.843 0.83 . . . . 4.08 110.712 179.03 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 23.2 tt0 -60.19 -28.33 67.88 Favored 'General case' 0 N--CA 1.441 -0.908 0 CA-C-N 114.221 -1.354 . . . . 3.43 110.007 -179.083 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 4.5 t80 -65.73 -55.75 15.69 Favored 'General case' 0 N--CA 1.452 -0.354 0 C-N-CA 124.364 1.065 . . . . 1.4 110.205 -177.754 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 2.8 mp -56.67 -45.1 82.54 Favored 'Isoleucine or valine' 0 C--O 1.228 -0.068 0 N-CA-C 107.961 -1.125 . . . . 2.02 107.961 176.34 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 5.3 t30 -58.24 -33.08 68.97 Favored 'General case' 0 CA--C 1.538 0.516 0 N-CA-C 111.962 0.356 . . . . 1.95 111.962 -178.891 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 28.8 t70 -71.31 -44.07 65.86 Favored 'General case' 0 CA--C 1.517 -0.306 0 C-N-CA 125.203 1.401 . . . . 1.97 110.777 178.459 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 11.7 mm100 -83.42 54.05 2.7 Favored 'General case' 0 CA--C 1.537 0.45 0 CA-C-O 121.486 0.66 . . . . 3.48 110.306 -172.806 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -70.85 116.78 12.95 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.43 0 O-C-N 121.389 -0.819 . . . . 4.81 108.814 -176.193 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 20.8 tttp -150.92 140.23 21.34 Favored 'General case' 0 N--CA 1.454 -0.228 0 N-CA-C 106.562 -1.644 . . . . 11.6 106.562 174.229 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 102' ' ' PHE . . . . . . . . . . . . . 31.2 p90 -96.46 139.97 31.8 Favored 'General case' 0 N--CA 1.452 -0.359 0 N-CA-C 107.248 -1.39 . . . . 8.45 107.248 164.309 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -132.27 119.33 39.4 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.362 0 N-CA-C 104.597 -2.372 . . . . 5.12 104.597 176.677 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 104' ' ' ILE . . . . . . . . . . . . . 24.0 mm 39.7 90.39 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.537 0.448 0 C-N-CA 126.52 1.928 . . . . 7.65 112.123 -173.366 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 7.5 m-20 -51.54 145.78 8.39 Favored 'General case' 0 CA--C 1.528 0.128 0 C-N-CA 123.361 0.664 . . . . 7.65 110.68 178.966 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 24.9 t . . . . . 0 C--O 1.253 1.256 0 C-N-CA 125.394 1.477 . . . . 9.62 107.261 179.728 . . . . . . . . 0 0 . 1 . 025 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.225 -0.451 0 N-CA-C 106.381 -2.687 . . . . 15.35 106.381 . . . . . . . . . 0 0 . 1 . 025 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 49.6 m -122.3 82.88 2.03 Favored 'General case' 0 N--CA 1.456 -0.172 0 CA-C-N 118.766 1.283 . . . . 16.65 108.121 172.164 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 5.2 mmpt? -144.99 145.0 31.33 Favored 'General case' 0 N--CA 1.452 -0.341 0 N-CA-C 106.81 -1.552 . . . . 21.43 106.81 179.239 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 145.18 175.14 18.06 Favored Glycine 0 CA--C 1.522 0.516 0 N-CA-C 108.281 -1.928 . . . . 16.66 108.281 -178.948 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 34.0 m -93.86 -162.07 0.1 OUTLIER 'Isoleucine or valine' 0 N--CA 1.444 -0.726 0 N-CA-C 106.965 -1.494 . . . . 17.52 106.965 156.473 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -81.1 113.45 19.29 Favored 'General case' 0 N--CA 1.447 -0.613 0 CA-C-O 122.156 0.979 . . . . 12.0 111.576 174.978 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -145.12 52.0 1.21 Allowed 'General case' 0 N--CA 1.449 -0.492 0 C-N-CA 125.823 1.649 . . . . 11.03 108.354 174.897 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 29.4 mtp180 62.15 48.35 5.04 Favored 'General case' 0 N--CA 1.461 0.09 0 C-N-CA 124.227 1.011 . . . . 8.17 111.827 -177.825 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 1.2 m120 -49.58 -33.98 16.53 Favored 'General case' 0 C--O 1.219 -0.552 0 N-CA-C 113.139 0.792 . . . . 4.11 113.139 178.401 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -56.23 -56.73 17.4 Favored 'General case' 0 N--CA 1.449 -0.518 0 C-N-CA 122.966 0.506 . . . . 2.78 111.524 176.322 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 26.6 m -79.73 -46.11 17.67 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 121.55 0.691 . . . . 2.31 110.196 -170.858 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 38.0 tt0 -68.86 -33.97 74.67 Favored 'General case' 0 CA--C 1.533 0.312 0 N-CA-C 108.381 -0.97 . . . . 3.71 108.381 -179.209 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -62.8 -55.71 25.3 Favored Glycine 0 C--O 1.222 -0.656 0 N-CA-C 108.8 -1.72 . . . . 1.04 108.8 174.411 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 3.2 t80 -46.43 -54.95 8.17 Favored 'General case' 0 C--O 1.227 -0.12 0 CA-C-N 118.549 1.175 . . . . 4.37 111.24 -175.11 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 0.5 OUTLIER -66.17 -34.37 69.74 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.501 0 O-C-N 121.567 -0.708 . . . . 1.78 112.159 -177.907 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 5.3 t60 -63.38 -53.0 59.33 Favored 'General case' 0 N--CA 1.453 -0.295 0 N-CA-C 107.832 -1.173 . . . . 1.45 107.832 179.916 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 17.2 mt-10 -58.63 -38.66 78.54 Favored 'General case' 0 N--CA 1.449 -0.477 0 C-N-CA 127.398 2.279 . . . . 2.92 110.004 179.683 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -51.56 -47.05 63.6 Favored 'General case' 0 CA--C 1.519 -0.225 0 C-N-CA 123.709 0.804 . . . . 3.48 109.689 170.829 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -48.77 -49.26 28.57 Favored Glycine 0 CA--C 1.527 0.841 0 CA-C-O 119.728 -0.484 . . . . 0.72 111.912 171.851 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 60.4 m-70 -60.62 -45.4 94.17 Favored 'General case' 0 C--O 1.223 -0.299 0 CA-C-N 119.338 1.569 . . . . 5.0 111.422 176.115 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -62.19 -24.42 67.19 Favored 'General case' 0 CA--C 1.534 0.339 0 O-C-N 121.019 -1.051 . . . . 1.81 111.159 -179.474 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 78.3 t -78.26 -35.7 20.02 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.183 0 O-C-N 121.197 -0.94 . . . . 2.4 110.938 173.44 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 15.1 t0 -54.86 -33.13 61.46 Favored 'General case' 0 C--N 1.333 -0.109 0 C-N-CA 124.37 1.068 . . . . 2.7 109.716 171.278 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 11.9 t70 -61.21 -54.5 43.52 Favored 'General case' 0 CA--C 1.519 -0.214 0 N-CA-C 108.935 -0.765 . . . . 3.2 108.935 -177.384 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 31.4 t80 -56.39 -49.58 74.04 Favored 'General case' 0 N--CA 1.454 -0.228 0 C-N-CA 122.535 0.334 . . . . 6.22 110.101 -179.105 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -56.83 -38.32 72.48 Favored 'General case' 0 N--CA 1.451 -0.416 0 C-N-CA 120.566 -0.453 . . . . 2.61 110.99 -179.828 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -80.6 -22.25 62.49 Favored Glycine 0 CA--C 1.525 0.71 0 C-N-CA 124.163 0.887 . . . . 1.31 113.032 -177.758 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 1.1 t80 -76.57 -46.0 28.06 Favored 'General case' 0 N--CA 1.448 -0.571 0 O-C-N 121.029 -1.277 . . . . 3.61 108.348 179.586 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -72.97 -39.41 66.16 Favored 'General case' 0 N--CA 1.445 -0.678 0 C-N-CA 124.264 1.026 . . . . 4.33 111.527 179.768 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 7.9 mt -117.64 123.32 45.84 Favored 'General case' 0 N--CA 1.453 -0.325 0 N-CA-C 107.254 -1.387 . . . . 4.24 107.254 -170.486 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER 58.91 56.58 3.98 Favored 'General case' 0 CA--C 1.54 0.578 0 C-N-CA 124.249 1.02 . . . . 5.26 110.578 -175.689 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 2.6 tmtt? -48.89 102.24 0.03 OUTLIER 'General case' 0 N--CA 1.468 0.465 0 C-N-CA 124.426 1.09 . . . . 12.43 111.481 -169.477 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 33.1 t-20 -150.79 159.1 44.76 Favored 'General case' 0 N--CA 1.453 -0.292 0 N-CA-C 106.792 -1.559 . . . . 6.96 106.792 -179.493 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 34.0 tt0 -89.49 -35.1 16.16 Favored 'General case' 0 CA--C 1.531 0.241 0 CA-C-N 118.794 0.725 . . . . 13.88 109.889 171.086 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 15.2 t -107.22 22.13 16.45 Favored 'General case' 0 CA--C 1.53 0.202 0 C-N-CA 123.111 0.564 . . . . 7.87 111.089 -170.529 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 5.0 t0 -151.69 132.78 14.35 Favored 'General case' 0 C--N 1.331 -0.232 0 N-CA-C 104.294 -2.484 . . . . 7.18 104.294 173.074 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 1.2 mm? -116.62 -148.28 0.42 Allowed 'General case' 0 CA--C 1.531 0.226 0 CA-C-N 119.598 1.09 . . . . 3.96 108.393 -177.509 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 4.5 p -70.74 -19.68 21.7 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.398 0 O-C-N 121.142 -0.974 . . . . 3.46 111.161 176.502 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 4.5 t -46.65 148.2 1.06 Allowed 'General case' 0 N--CA 1.455 -0.218 0 C-N-CA 123.696 0.799 . . . . 3.83 109.796 167.301 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 28.7 t30 52.59 46.28 27.01 Favored 'General case' 0 CA--C 1.529 0.172 0 O-C-N 121.708 -0.62 . . . . 7.87 112.044 173.34 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 11.4 t -52.99 96.13 0.01 OUTLIER 'General case' 0 C--O 1.224 -0.241 0 CA-C-O 118.516 -0.754 . . . . 4.54 111.303 -177.214 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 6.0 mmpt? 30.26 69.68 0.09 Allowed 'General case' 0 N--CA 1.466 0.327 0 C-N-CA 124.955 1.302 . . . . 16.61 112.362 -166.709 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 31.3 mmtt 57.43 33.95 23.99 Favored 'General case' 0 N--CA 1.465 0.312 0 C-N-CA 122.769 0.428 . . . . 17.34 112.088 177.536 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 3.6 m-30 -73.63 -75.23 0.15 Allowed 'General case' 0 C--O 1.222 -0.385 0 N-CA-C 108.405 -0.961 . . . . 8.4 108.405 162.444 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER 36.08 80.96 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.544 0.745 0 O-C-N 123.768 0.667 . . . . 4.13 111.876 -164.107 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 21.5 t70 -123.26 -60.11 1.52 Allowed 'General case' 0 N--CA 1.47 0.56 0 O-C-N 120.688 -1.257 . . . . 2.25 110.823 -174.191 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 5.2 mm -46.92 -52.13 4.37 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.622 0 C-N-CA 125.244 1.418 . . . . 1.96 108.839 174.175 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 33.9 t80 -63.97 -28.01 69.52 Favored 'General case' 0 N--CA 1.453 -0.287 0 O-C-N 120.785 -1.197 . . . . 0.51 113.288 179.322 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . 0.452 ' HA ' ' HE2' ' A' ' 49' ' ' LYS . 10.5 mmpt? -68.97 -48.76 62.35 Favored 'General case' 0 C--N 1.329 -0.323 0 O-C-N 119.908 -1.745 . . . . 2.0 110.834 -177.838 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 4.2 tp10 -84.88 -58.48 2.69 Favored 'General case' 0 N--CA 1.453 -0.322 0 N-CA-C 108.743 -0.836 . . . . 2.29 108.743 -174.232 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 20.7 mp0 -74.56 -31.74 62.19 Favored 'General case' 0 C--O 1.235 0.3 0 O-C-N 121.052 -1.03 . . . . 2.68 110.982 -174.844 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . 0.403 ' HA2' ' CD1' ' A' ' 66' ' ' PHE . . . -72.39 42.98 0.85 Allowed Glycine 0 CA--C 1.531 1.091 0 C-N-CA 125.097 1.332 . . . . 0.4 114.336 174.354 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 27.9 t -155.03 35.15 0.39 Allowed 'General case' 0 N--CA 1.451 -0.409 0 O-C-N 121.048 -1.266 . . . . 2.63 108.614 153.332 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 42.9 t30 -140.52 -40.56 0.42 Allowed 'General case' 0 C--N 1.341 0.197 0 N-CA-C 112.728 0.64 . . . . 2.82 112.728 -164.997 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 30.9 mt -64.31 -38.68 91.91 Favored 'General case' 0 C--N 1.332 -0.177 0 O-C-N 121.85 -0.531 . . . . 1.6 110.754 178.209 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 1.4 t 177.57 171.6 0.6 Allowed 'General case' 0 CA--C 1.531 0.241 0 C-N-CA 125.513 1.525 . . . . 1.72 107.612 -175.372 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 8.5 m -59.82 -31.32 69.62 Favored 'General case' 0 N--CA 1.455 -0.216 0 O-C-N 121.717 -0.614 . . . . 1.32 110.634 168.421 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -66.28 -19.05 65.71 Favored 'General case' 0 N--CA 1.463 0.183 0 N-CA-C 112.045 0.387 . . . . 2.28 112.045 174.735 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -83.04 -8.44 85.69 Favored Glycine 0 N--CA 1.439 -1.102 0 CA-C-O 118.579 -1.123 . . . . 0.5 110.546 175.792 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -110.77 -18.99 13.0 Favored 'General case' 0 C--O 1.232 0.166 0 CA-C-N 119.357 1.579 . . . . 3.73 112.527 -176.347 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 3.4 p -62.77 -163.57 0.01 OUTLIER 'General case' 0 CA--C 1.538 0.483 0 C-N-CA 124.177 0.991 . . . . 1.87 109.447 168.282 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 78.1 m-20 -53.29 148.33 8.84 Favored 'General case' 0 CA--C 1.53 0.175 0 O-C-N 120.449 -1.407 . . . . 3.48 110.445 -174.14 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 30.7 tt0 -59.77 -26.94 66.11 Favored 'General case' 0 CA--C 1.537 0.477 0 C-N-CA 123.226 0.61 . . . . 2.87 111.168 -176.07 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -62.38 -39.27 92.64 Favored 'General case' 0 N--CA 1.458 -0.063 0 O-C-N 121.367 -0.833 . . . . 1.97 112.509 171.63 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 13.9 mt-10 -69.2 -44.35 72.31 Favored 'General case' 0 CA--C 1.514 -0.439 0 O-C-N 121.041 -1.037 . . . . 2.21 110.435 177.45 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 66' ' ' PHE . . . . . 0.403 ' CD1' ' HA2' ' A' ' 52' ' ' GLY . 51.7 t80 -53.04 -46.03 68.3 Favored 'General case' 0 CA--C 1.534 0.328 0 C-N-CA 125.308 1.443 . . . . 0.4 111.296 173.485 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 62.3 t80 -64.01 -48.48 76.21 Favored 'General case' 0 CA--C 1.534 0.33 0 CA-C-O 122.217 1.008 . . . . 0.87 109.973 177.379 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -64.44 -41.96 96.26 Favored 'General case' 0 N--CA 1.446 -0.648 0 O-C-N 121.203 -0.936 . . . . 1.68 113.226 -174.564 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -68.67 -35.77 77.66 Favored 'General case' 0 C--N 1.332 -0.154 0 O-C-N 121.054 -1.029 . . . . 3.63 109.848 175.006 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -54.24 -41.27 68.56 Favored 'General case' 0 C--O 1.223 -0.315 0 CA-C-N 118.949 0.795 . . . . 1.53 110.327 171.101 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 19.7 t80 -58.48 -49.97 75.44 Favored 'General case' 0 N--CA 1.464 0.241 0 CA-C-N 120.027 1.285 . . . . 4.98 111.635 173.45 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -51.44 -54.38 27.46 Favored 'General case' 0 CA--C 1.531 0.239 0 O-C-N 121.709 -0.62 . . . . 5.43 110.506 179.035 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -66.65 -32.77 74.31 Favored 'General case' 0 C--N 1.324 -0.543 0 C-N-CA 124.377 1.071 . . . . 1.57 109.96 -174.468 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 1.8 tmt? -61.58 -39.32 90.75 Favored 'General case' 0 N--CA 1.447 -0.606 0 C-N-CA 123.676 0.79 . . . . 3.43 112.124 -177.774 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 13.0 p80 -94.59 -8.93 36.68 Favored 'General case' 0 C--O 1.232 0.133 0 CA-C-O 117.3 -1.333 . . . . 1.48 113.187 -179.655 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 9.7 m -40.03 127.37 2.16 Favored 'General case' 0 N--CA 1.45 -0.434 0 CA-C-O 123.24 1.495 . . . . 1.9 110.81 -168.459 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 1.4 p -52.63 -42.77 64.93 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 112.692 -2.049 . . . . 2.36 108.892 -178.315 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 14.4 t0 -70.62 114.19 8.48 Favored 'General case' 0 N--CA 1.444 -0.739 0 CA-C-O 121.98 0.895 . . . . 1.92 108.916 169.548 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 52.5 m80 -57.72 -32.39 67.36 Favored 'General case' 0 N--CA 1.455 -0.194 0 O-C-N 121.639 -0.663 . . . . 6.76 110.615 174.597 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -61.85 -50.83 70.68 Favored 'General case' 0 N--CA 1.451 -0.381 0 CA-C-O 118.401 -0.809 . . . . 1.65 110.313 179.722 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 4.2 mt-10 -43.17 -45.45 5.57 Favored 'General case' 0 C--N 1.339 0.138 0 C-N-CA 124.725 1.21 . . . . 2.78 110.204 176.648 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 1.9 mtp180 -63.91 -52.75 58.42 Favored 'General case' 0 N--CA 1.453 -0.32 0 CA-C-N 115.828 -0.623 . . . . 3.94 109.778 -178.497 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 1.3 mm? -63.67 -21.08 66.2 Favored 'General case' 0 N--CA 1.452 -0.33 0 CA-C-O 117.651 -1.166 . . . . 1.93 112.701 178.042 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 2.5 mptm? -64.12 -44.55 91.89 Favored 'General case' 0 C--O 1.225 -0.221 0 CA-C-N 121.324 1.875 . . . . 2.26 107.639 171.2 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 84.4 t -62.11 -60.82 2.11 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.489 0 CA-C-O 118.144 -0.931 . . . . 1.78 110.368 175.324 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -51.13 -48.14 61.87 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 119.765 1.166 . . . . 2.87 111.197 -174.493 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 37.4 tttm -56.85 -48.54 77.84 Favored 'General case' 0 N--CA 1.449 -0.519 0 C-N-CA 123.769 0.828 . . . . 4.2 111.754 176.457 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 47.4 m-20 -79.29 -7.81 58.58 Favored 'General case' 0 CA--C 1.532 0.261 0 C-N-CA 123.231 0.612 . . . . 1.34 111.556 -177.244 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -165.8 73.19 1.3 Allowed Pre-proline 0 N--CA 1.448 -0.558 0 C-N-CA 125.488 1.515 . . . . 1.77 110.345 -167.72 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 74.4 Cg_endo -73.31 8.14 1.91 Allowed 'Trans proline' 0 N--CA 1.457 -0.62 0 C-N-CA 123.099 2.532 . . . . 1.95 112.875 -175.093 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -122.43 -47.93 2.09 Favored 'General case' 0 N--CA 1.45 -0.431 0 C-N-CA 125.221 1.408 . . . . 3.26 109.638 -177.625 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 2.7 m -53.92 -46.87 71.61 Favored 'General case' 0 C--N 1.334 -0.081 0 C-N-CA 123.706 0.803 . . . . 1.55 111.132 177.568 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 10.3 t80 -60.27 -47.45 85.94 Favored 'General case' 0 CA--C 1.508 -0.635 0 CA-C-O 121.355 0.598 . . . . 3.98 110.567 178.499 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 24.2 tt0 -56.58 -33.76 66.5 Favored 'General case' 0 N--CA 1.441 -0.912 0 CA-C-N 114.693 -1.139 . . . . 2.58 109.882 -179.914 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 3.2 t80 -63.33 -57.94 8.73 Favored 'General case' 0 N--CA 1.455 -0.221 0 C-N-CA 124.443 1.097 . . . . 1.31 109.633 -175.891 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 47.0 mm -51.9 -46.72 41.18 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.14 0 C-N-CA 123.345 0.658 . . . . 3.36 109.67 175.575 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 40.3 t30 -63.75 -32.99 74.67 Favored 'General case' 0 CA--C 1.53 0.205 0 N-CA-C 111.714 0.264 . . . . 2.03 111.714 -176.559 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -63.31 -44.54 94.69 Favored 'General case' 0 CA--C 1.523 -0.075 0 C-N-CA 124.304 1.042 . . . . 2.17 108.639 176.778 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 30.5 mm100 -81.88 58.89 4.05 Favored 'General case' 0 N--CA 1.452 -0.339 0 C-N-CA 123.223 0.609 . . . . 3.9 110.628 178.439 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 6.9 tp -75.11 72.09 0.35 Allowed 'Isoleucine or valine' 0 CA--C 1.54 0.588 0 C-N-CA 124.578 1.151 . . . . 4.83 110.106 179.967 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 2.3 ttmt -169.13 -176.21 2.52 Favored 'General case' 0 CA--C 1.527 0.07 0 O-C-N 120.66 -1.275 . . . . 8.66 108.973 176.22 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 102' ' ' PHE . . . . . . . . . . . . . 6.2 p90 -149.16 157.59 43.5 Favored 'General case' 0 C--N 1.33 -0.282 0 N-CA-C 108.286 -1.005 . . . . 8.7 108.286 178.044 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -68.79 -48.25 71.96 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.377 0 N-CA-C 108.663 -0.866 . . . . 6.47 108.663 173.941 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 104' ' ' ILE . . . . . . . . . . . . . 4.8 tt -154.54 175.8 0.48 Allowed 'Isoleucine or valine' 0 N--CA 1.454 -0.262 0 N-CA-C 107.561 -1.274 . . . . 8.62 107.561 177.941 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 30.7 p-10 -142.16 174.26 10.77 Favored 'General case' 0 N--CA 1.453 -0.314 0 C-N-CA 124.687 1.195 . . . . 6.81 108.702 -178.773 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 15.6 t . . . . . 0 C--O 1.253 1.238 0 CA-C-O 115.383 -2.246 . . . . 10.59 108.506 172.457 . . . . . . . . 0 0 . 1 . 026 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.469 0.841 0 N-CA-C 108.956 -1.658 . . . . 20.4 108.956 . . . . . . . . . 0 0 . 1 . 026 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 5.5 m 21.21 101.12 0.0 OUTLIER 'General case' 0 CA--C 1.531 0.235 0 C-N-CA 129.036 2.934 . . . . 20.58 116.425 160.426 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 4.2 ptpt -146.57 130.32 17.06 Favored 'General case' 0 C--O 1.226 -0.163 0 N-CA-C 108.246 -1.02 . . . . 22.18 108.246 172.705 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 63.64 -150.63 49.63 Favored Glycine 0 CA--C 1.522 0.514 0 CA-C-N 118.209 0.458 . . . . 19.75 112.148 177.585 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 33.7 m -80.43 -154.16 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.446 -0.627 0 C-N-CA 123.609 0.764 . . . . 18.19 109.032 172.957 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 20.8 mt-10 -102.14 109.93 21.76 Favored 'General case' 0 N--CA 1.449 -0.485 0 O-C-N 121.147 -0.971 . . . . 11.64 110.103 175.909 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 1.9 mm? -99.21 33.11 2.5 Favored 'General case' 0 N--CA 1.455 -0.181 0 C-N-CA 123.746 0.819 . . . . 11.74 109.696 -178.403 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 4.6 mmm-85 -146.88 110.2 4.82 Favored 'General case' 0 N--CA 1.445 -0.679 0 N-CA-C 107.593 -1.262 . . . . 12.24 107.593 -175.161 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 3.7 m-20 -52.59 -29.95 28.51 Favored 'General case' 0 C--O 1.221 -0.423 0 C-N-CA 123.595 0.758 . . . . 2.89 111.832 170.683 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 3.8 t0 -56.13 -56.68 17.94 Favored 'General case' 0 C--N 1.323 -0.586 0 C-N-CA 125.76 1.624 . . . . 2.75 110.651 173.268 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 11.9 m -67.24 -51.05 57.83 Favored 'General case' 0 CA--C 1.533 0.31 0 O-C-N 121.219 -0.926 . . . . 2.6 111.019 178.467 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 3.7 tt0 -67.99 -22.01 65.03 Favored 'General case' 0 CA--C 1.542 0.647 0 C-N-CA 125.703 1.601 . . . . 3.51 110.09 -171.851 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -88.22 -38.15 7.38 Favored Glycine 0 CA--C 1.524 0.627 0 C-N-CA 125.785 1.66 . . . . 1.03 110.781 174.974 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -51.0 -50.44 58.5 Favored 'General case' 0 CA--C 1.522 -0.097 0 CA-C-N 118.52 1.16 . . . . 5.49 109.853 179.823 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER -62.36 -33.65 60.24 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.313 0 N-CA-C 112.617 0.599 . . . . 1.76 112.617 178.838 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 10.1 t60 -61.62 -52.33 64.8 Favored 'General case' 0 CA--C 1.531 0.213 0 N-CA-C 106.684 -1.599 . . . . 0.98 106.684 178.349 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 36.7 mt-10 -57.21 -36.84 71.37 Favored 'General case' 0 CA--C 1.53 0.207 0 O-C-N 121.473 -0.767 . . . . 2.63 111.337 176.946 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 1.1 t80 -56.9 -41.73 78.63 Favored 'General case' 0 C--N 1.33 -0.25 0 O-C-N 121.511 -0.743 . . . . 3.26 110.881 175.398 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -52.88 -45.11 61.59 Favored Glycine 0 CA--C 1.53 0.97 0 N-CA-C 111.249 -0.74 . . . . 0.79 111.249 172.631 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 71.6 m-70 -59.7 -49.02 79.35 Favored 'General case' 0 C--O 1.227 -0.105 0 CA-C-N 118.216 1.008 . . . . 5.2 111.279 175.403 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -58.69 -29.29 66.52 Favored 'General case' 0 CA--C 1.533 0.291 0 O-C-N 122.018 -0.426 . . . . 1.94 110.982 -179.185 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 49.3 t -66.57 -42.21 89.59 Favored 'Isoleucine or valine' 0 C--O 1.233 0.223 0 O-C-N 121.08 -1.012 . . . . 1.99 111.053 176.27 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 65.0 m-20 -62.02 -21.25 64.73 Favored 'General case' 0 C--O 1.232 0.146 0 CA-C-N 117.904 0.32 . . . . 2.17 111.648 175.777 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 45.5 t0 -71.21 -51.17 26.22 Favored 'General case' 0 N--CA 1.457 -0.121 0 CA-C-O 121.981 0.896 . . . . 2.2 109.06 -176.052 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -53.86 -52.31 60.85 Favored 'General case' 0 C--O 1.233 0.195 0 N-CA-C 109.011 -0.737 . . . . 3.95 109.011 175.075 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -59.99 -28.79 67.99 Favored 'General case' 0 N--CA 1.451 -0.388 0 N-CA-C 112.093 0.405 . . . . 1.8 112.093 178.713 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -66.45 -36.28 91.3 Favored Glycine 0 CA--C 1.52 0.37 0 N-CA-C 111.1 -0.8 . . . . 1.15 111.1 177.99 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 0.8 OUTLIER -78.98 -42.83 25.75 Favored 'General case' 0 N--CA 1.454 -0.249 0 CA-C-N 117.866 0.833 . . . . 2.88 110.909 -177.974 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 2.9 mm? -80.64 -32.37 36.2 Favored 'General case' 0 N--CA 1.449 -0.487 0 C-N-CA 123.844 0.858 . . . . 2.64 113.178 -173.116 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 14.2 mt -111.97 -134.84 0.35 Allowed 'General case' 0 N--CA 1.45 -0.442 0 N-CA-C 106.793 -1.558 . . . . 2.6 106.793 -172.975 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 18.19 93.02 0.01 OUTLIER 'General case' 0 N--CA 1.468 0.432 0 C-N-CA 127.971 2.508 . . . . 5.72 115.993 168.705 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 6.9 ptmm? -60.32 167.03 2.66 Favored 'General case' 0 CA--C 1.533 0.3 0 CA-C-O 121.508 0.67 . . . . 8.86 112.55 -178.352 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 56.0 t30 -48.39 146.06 3.06 Favored 'General case' 0 CA--C 1.532 0.286 0 C-N-CA 124.731 1.212 . . . . 8.48 112.157 -178.594 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 45.6 mt-30 66.69 24.14 10.07 Favored 'General case' 0 CA--C 1.531 0.22 0 C-N-CA 126.844 2.058 . . . . 9.47 112.159 -164.1 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 3.9 t -135.31 153.98 51.69 Favored 'General case' 0 N--CA 1.448 -0.527 0 N-CA-C 104.895 -2.261 . . . . 6.98 104.895 153.765 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 49.7 t0 -150.12 129.48 12.91 Favored 'General case' 0 C--N 1.329 -0.286 0 N-CA-C 107.099 -1.445 . . . . 5.38 107.099 179.788 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 6.2 mp 60.79 147.53 0.02 OUTLIER 'General case' 0 CA--C 1.536 0.433 0 C-N-CA 125.47 1.508 . . . . 3.06 110.464 -156.574 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 7.7 p -71.58 128.93 35.2 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.192 0 O-C-N 120.294 -1.504 . . . . 3.15 107.723 174.18 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 59.0 p -134.56 109.31 8.6 Favored 'General case' 0 CA--C 1.529 0.155 0 CA-C-N 119.042 0.837 . . . . 4.14 108.984 173.72 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 7.6 m-80 37.43 49.86 1.01 Allowed 'General case' 0 CA--C 1.532 0.273 0 C-N-CA 127.235 2.214 . . . . 8.31 115.332 179.429 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 34.3 t -55.71 -50.24 70.86 Favored 'General case' 0 CA--C 1.533 0.326 0 O-C-N 121.059 -1.026 . . . . 3.67 112.343 -179.357 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 6.4 mtpm? -66.5 -20.51 66.05 Favored 'General case' 0 N--CA 1.465 0.323 0 O-C-N 121.41 -0.806 . . . . 7.0 112.714 -176.817 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 24.7 mttt -143.26 71.91 1.35 Allowed 'General case' 0 N--CA 1.451 -0.406 0 N-CA-C 106.392 -1.706 . . . . 8.21 106.392 -174.572 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 9.3 m-85 -38.71 101.4 0.02 OUTLIER 'General case' 0 N--CA 1.456 -0.169 0 C-N-CA 125.639 1.576 . . . . 6.51 111.164 -172.117 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 2.4 tt 36.94 57.48 0.18 Allowed 'Isoleucine or valine' 0 CA--C 1.542 0.655 0 C-N-CA 125.73 1.612 . . . . 3.17 111.856 -179.518 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 1.6 t70 -118.62 -57.85 2.02 Favored 'General case' 0 N--CA 1.468 0.432 0 C-N-CA 125.661 1.584 . . . . 2.19 109.612 -176.677 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 4.4 mm -50.3 -53.25 12.52 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.26 0 C-N-CA 123.988 0.915 . . . . 1.79 109.383 178.262 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 20.2 t80 -60.11 -32.22 70.78 Favored 'General case' 0 N--CA 1.452 -0.338 0 C-N-CA 123.504 0.722 . . . . 0.44 112.243 178.465 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . 0.444 ' HA ' ' HE2' ' A' ' 49' ' ' LYS . 0.6 OUTLIER -63.38 -51.14 67.09 Favored 'General case' 0 CA--C 1.519 -0.22 0 O-C-N 120.336 -1.478 . . . . 1.87 110.502 -179.331 . . . . . . . . 3 3 . 1 . 026 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 3.1 tp10 -79.44 -65.98 0.93 Allowed 'General case' 0 N--CA 1.452 -0.338 0 CA-C-O 122.27 1.033 . . . . 2.13 108.559 -175.368 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 3.8 mm-40 -72.14 -30.23 64.82 Favored 'General case' 0 N--CA 1.453 -0.316 0 C-N-CA 124.006 0.923 . . . . 2.3 109.956 -167.336 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . 0.425 ' HA2' ' CD1' ' A' ' 66' ' ' PHE . . . -68.99 41.68 0.34 Allowed Glycine 0 CA--C 1.527 0.815 0 C-N-CA 125.706 1.622 . . . . 0.33 113.838 169.036 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 65.3 p -145.77 22.42 1.44 Allowed 'General case' 0 N--CA 1.448 -0.55 0 O-C-N 120.871 -1.37 . . . . 2.57 111.49 159.681 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 47.9 t-20 -135.44 -44.32 0.69 Allowed 'General case' 0 C--O 1.226 -0.16 0 N-CA-C 111.906 0.336 . . . . 2.31 111.906 -165.529 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 28.7 mt -58.55 -38.55 78.07 Favored 'General case' 0 N--CA 1.462 0.163 0 CA-C-O 120.985 0.421 . . . . 1.79 111.142 -174.987 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER 178.16 172.03 0.68 Allowed 'General case' 0 CA--C 1.531 0.22 0 C-N-CA 125.468 1.507 . . . . 1.68 107.591 -178.244 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 14.4 m -56.89 -35.55 69.08 Favored 'General case' 0 N--CA 1.453 -0.283 0 O-C-N 121.572 -0.705 . . . . 1.29 110.319 166.7 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -64.67 -21.43 66.73 Favored 'General case' 0 CA--C 1.534 0.343 0 CA-C-O 121.085 0.469 . . . . 2.1 111.858 175.969 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -80.73 -12.49 82.76 Favored Glycine 0 N--CA 1.444 -0.791 0 N-CA-C 111.125 -0.79 . . . . 0.52 111.125 176.372 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 36.4 ttt-85 -110.98 -11.59 14.31 Favored 'General case' 0 CA--C 1.529 0.171 0 CA-C-N 118.758 1.279 . . . . 3.08 112.151 -179.15 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 2.2 p -63.9 -161.63 0.01 OUTLIER 'General case' 0 CA--C 1.54 0.568 0 C-N-CA 123.616 0.766 . . . . 1.83 109.9 167.059 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 16.3 t-20 -52.34 151.83 3.78 Favored 'General case' 0 CA--C 1.532 0.287 0 O-C-N 120.907 -1.121 . . . . 2.14 110.709 -177.574 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 35.7 tt0 -59.91 -36.37 76.85 Favored 'General case' 0 CA--C 1.53 0.182 0 CA-C-N 118.915 0.78 . . . . 2.47 110.349 -176.527 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -55.37 -30.14 59.78 Favored 'General case' 0 C--N 1.331 -0.198 0 O-C-N 121.522 -0.736 . . . . 1.53 112.813 176.924 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 1.6 mm-40 -82.16 -38.67 24.34 Favored 'General case' 0 N--CA 1.447 -0.589 0 CA-C-O 118.612 -0.709 . . . . 2.65 110.362 -179.177 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 66' ' ' PHE . . . . . 0.425 ' CD1' ' HA2' ' A' ' 52' ' ' GLY . 59.0 t80 -55.16 -47.29 75.36 Favored 'General case' 0 N--CA 1.452 -0.361 0 C-N-CA 124.267 1.027 . . . . 0.4 111.43 170.73 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 56.9 t80 -65.03 -48.11 75.02 Favored 'General case' 0 CA--C 1.538 0.501 0 O-C-N 121.061 -1.024 . . . . 0.57 109.819 176.141 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -58.82 -55.69 31.92 Favored 'General case' 0 CA--C 1.536 0.44 0 N-CA-C 113.252 0.834 . . . . 1.63 113.252 -174.7 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -55.4 -39.56 70.34 Favored 'General case' 0 C--N 1.331 -0.218 0 O-C-N 121.027 -1.045 . . . . 3.87 111.355 171.264 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -60.17 -32.95 71.54 Favored 'General case' 0 CA--C 1.533 0.311 0 CA-C-N 119.737 1.153 . . . . 1.58 110.872 175.516 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -59.17 -49.71 76.83 Favored 'General case' 0 N--CA 1.464 0.229 0 CA-C-N 119.127 0.876 . . . . 4.97 111.901 168.681 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 10.7 ttp180 -51.92 -61.61 2.15 Favored 'General case' 0 CA--C 1.534 0.352 0 O-C-N 121.392 -0.818 . . . . 2.77 110.82 174.905 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -62.25 -45.89 91.3 Favored 'General case' 0 C--O 1.221 -0.436 0 C-N-CA 125.56 1.544 . . . . 1.65 110.649 -170.94 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -63.61 -25.96 68.46 Favored 'General case' 0 C--N 1.331 -0.216 0 O-C-N 120.276 -1.515 . . . . 5.48 111.808 -179.867 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -91.96 -12.11 34.28 Favored 'General case' 0 C--O 1.232 0.169 0 CA-C-O 117.063 -1.446 . . . . 1.34 112.327 175.214 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 80.3 p -48.9 122.66 5.99 Favored 'General case' 0 N--CA 1.446 -0.642 0 CA-C-N 119.8 1.182 . . . . 3.25 108.31 -167.436 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 2.2 p -51.21 -39.36 56.36 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 114.646 -1.161 . . . . 2.1 109.641 177.102 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 13.5 t0 -63.98 104.35 0.7 Allowed 'General case' 0 N--CA 1.448 -0.528 0 CA-C-O 121.641 0.734 . . . . 2.06 109.846 166.685 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 39.3 p-80 -50.17 -35.23 25.28 Favored 'General case' 0 C--N 1.332 -0.171 0 C-N-CA 122.991 0.517 . . . . 5.73 111.994 174.268 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -61.12 -51.24 69.93 Favored 'General case' 0 N--CA 1.449 -0.512 0 CA-C-O 118.516 -0.754 . . . . 1.92 110.736 -178.072 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 1.2 mt-10 -50.42 -39.52 47.53 Favored 'General case' 0 C--O 1.233 0.198 0 CA-C-N 119.132 0.878 . . . . 3.25 110.478 177.759 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -62.97 -52.96 60.98 Favored 'General case' 0 N--CA 1.453 -0.312 0 C-N-CA 119.218 -0.993 . . . . 4.08 108.891 -178.588 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 1.2 mm? -65.64 -18.1 65.08 Favored 'General case' 0 N--CA 1.451 -0.423 0 CA-C-O 117.866 -1.064 . . . . 1.56 112.114 178.851 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 6.0 mttt -65.83 -44.65 84.91 Favored 'General case' 0 CA--C 1.516 -0.335 0 CA-C-N 120.824 1.647 . . . . 2.12 108.299 169.371 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 95.8 t -58.2 -60.28 2.44 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.497 0 CA-C-N 118.757 0.708 . . . . 1.65 110.051 171.254 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -57.37 -45.54 84.34 Favored 'General case' 0 CA--C 1.53 0.202 0 CA-C-N 119.512 1.051 . . . . 3.36 111.812 -169.721 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 56.6 tttt -58.09 -53.44 58.25 Favored 'General case' 0 N--CA 1.451 -0.404 0 C-N-CA 123.723 0.809 . . . . 3.21 109.712 177.03 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 4.3 m-20 -77.23 -6.5 53.27 Favored 'General case' 0 N--CA 1.453 -0.283 0 CA-C-O 118.825 -0.607 . . . . 1.52 111.229 -173.927 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -164.46 72.9 1.61 Allowed Pre-proline 0 N--CA 1.447 -0.609 0 C-N-CA 124.952 1.301 . . . . 1.86 110.587 -171.75 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 72.9 Cg_endo -74.27 16.89 0.55 Allowed 'Trans proline' 0 CA--C 1.536 0.584 0 C-N-CA 123.461 2.774 . . . . 1.47 113.283 -173.861 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -133.75 -41.82 0.84 Allowed 'General case' 0 N--CA 1.454 -0.252 0 C-N-CA 125.385 1.474 . . . . 3.39 109.29 -177.635 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 5.7 m -54.55 -48.1 72.4 Favored 'General case' 0 CA--C 1.521 -0.154 0 O-C-N 121.159 -0.963 . . . . 1.62 110.615 171.517 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 2.7 t80 -59.12 -46.67 87.72 Favored 'General case' 0 CA--C 1.506 -0.733 0 C-N-CA 119.849 -0.741 . . . . 3.96 110.492 179.342 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 50.2 tt0 -54.09 -37.13 63.93 Favored 'General case' 0 N--CA 1.442 -0.85 0 O-C-N 123.964 0.79 . . . . 3.12 110.319 177.708 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 4.4 t80 -60.66 -57.63 11.9 Favored 'General case' 0 N--CA 1.457 -0.078 0 CA-C-N 118.549 0.613 . . . . 1.14 109.568 -174.557 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 3.2 mp -60.9 -39.01 80.58 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.284 0 N-CA-C 109.588 -0.523 . . . . 1.82 109.588 177.598 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 9.3 t-20 -62.0 -35.41 78.43 Favored 'General case' 0 N--CA 1.455 -0.198 0 O-C-N 121.597 -0.689 . . . . 3.4 111.443 -174.789 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -57.16 -52.45 65.28 Favored 'General case' 0 C--O 1.231 0.11 0 C-N-CA 125.679 1.592 . . . . 2.1 108.303 174.904 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 7.6 mm100 -78.6 85.91 4.62 Favored 'General case' 0 N--CA 1.449 -0.486 0 CA-C-N 115.832 -0.622 . . . . 3.69 109.796 177.577 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 2.9 pt -39.71 118.64 0.13 Allowed 'Isoleucine or valine' 0 CA--C 1.533 0.302 0 C-N-CA 124.271 1.029 . . . . 6.14 111.038 177.176 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -80.51 60.42 3.88 Favored 'General case' 0 CA--C 1.532 0.286 0 O-C-N 121.789 -0.57 . . . . 13.01 111.221 -175.307 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 102' ' ' PHE . . . . . . . . . . . . . 81.2 m-85 -142.04 44.33 1.68 Allowed 'General case' 0 N--CA 1.452 -0.359 0 C-N-CA 125.708 1.603 . . . . 10.19 107.38 -179.574 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 11.2 tp -66.23 149.88 11.26 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.247 0 N-CA-C 108.275 -1.009 . . . . 5.32 108.275 172.433 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 104' ' ' ILE . . . . . . . . . . . . . 97.7 mt -126.84 159.18 36.97 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.186 0 N-CA-C 106.301 -1.74 . . . . 8.56 106.301 -176.316 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 6.8 p30 -124.6 162.99 22.9 Favored 'General case' 0 C--N 1.332 -0.195 0 C-N-CA 124.146 0.978 . . . . 7.62 108.424 -177.481 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 14.1 t . . . . . 0 C--O 1.252 1.219 0 CA-C-O 116.469 -1.729 . . . . 12.71 109.068 -160.122 . . . . . . . . 0 0 . 1 . 027 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.466 0.674 0 N-CA-C 107.988 -2.045 . . . . 14.63 107.988 . . . . . . . . . 0 0 . 1 . 027 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 1.7 m -65.82 164.14 15.38 Favored 'General case' 0 CA--C 1.537 0.445 0 C-N-CA 124.352 1.061 . . . . 13.38 110.728 179.582 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 5.8 ttmt -159.78 147.41 16.88 Favored 'General case' 0 C--N 1.339 0.135 0 N-CA-C 108.784 -0.821 . . . . 18.63 108.784 177.448 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 156.19 -172.5 34.07 Favored Glycine 0 C--N 1.333 0.371 0 N-CA-C 108.734 -1.746 . . . . 13.71 108.734 -174.925 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 28.0 m -98.01 -158.76 0.09 OUTLIER 'Isoleucine or valine' 0 N--CA 1.444 -0.759 0 N-CA-C 106.966 -1.494 . . . . 14.09 106.966 159.837 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 5.3 pt-20 -99.66 119.98 38.97 Favored 'General case' 0 N--CA 1.447 -0.591 0 CA-C-O 121.879 0.847 . . . . 9.27 110.83 176.58 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 1.6 mm? -112.4 30.35 7.16 Favored 'General case' 0 N--CA 1.453 -0.297 0 C-N-CA 124.164 0.986 . . . . 10.24 109.936 -179.004 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER 68.31 -68.56 0.17 Allowed 'General case' 0 N--CA 1.465 0.303 0 C-N-CA 125.316 1.447 . . . . 7.93 110.606 -172.141 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 3.5 m120 -50.12 -34.06 20.86 Favored 'General case' 0 CA--C 1.513 -0.475 0 C-N-CA 124.64 1.176 . . . . 3.02 112.793 172.21 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 16.3 t70 -68.18 -40.67 82.17 Favored 'General case' 0 C--O 1.223 -0.332 0 C-N-CA 119.932 -0.707 . . . . 3.62 110.913 177.99 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 50.6 m -62.66 -57.88 9.46 Favored 'General case' 0 N--CA 1.455 -0.212 0 CA-C-N 119.154 0.888 . . . . 2.02 110.99 176.518 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 9.1 pt-20 -70.12 -21.13 63.14 Favored 'General case' 0 CA--C 1.536 0.412 0 O-C-N 121.625 -0.672 . . . . 3.37 110.404 -176.375 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -76.61 -38.79 31.41 Favored Glycine 0 CA--C 1.528 0.89 0 C-N-CA 124.366 0.984 . . . . 0.7 111.873 175.668 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 34.0 t80 -58.21 -51.98 67.49 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 118.72 1.26 . . . . 4.76 109.344 -174.876 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 0.7 OUTLIER -63.1 -33.97 63.94 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.469 0 O-C-N 121.625 -0.672 . . . . 1.87 111.956 179.694 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 2.2 t-160 -60.29 -53.69 54.63 Favored 'General case' 0 CA--C 1.533 0.32 0 N-CA-C 106.7 -1.592 . . . . 0.72 106.7 176.554 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 86.4 mt-10 -51.54 -44.7 62.75 Favored 'General case' 0 C--O 1.223 -0.32 0 C-N-CA 124.455 1.102 . . . . 2.47 110.05 177.669 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -53.37 -56.98 12.3 Favored 'General case' 0 CA--C 1.519 -0.25 0 C-N-CA 124.476 1.11 . . . . 3.79 110.892 177.987 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -48.03 -46.66 26.6 Favored Glycine 0 CA--C 1.523 0.537 0 N-CA-C 110.466 -1.054 . . . . 0.54 110.466 175.652 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 2.6 t-160 -60.68 -46.35 90.67 Favored 'General case' 0 N--CA 1.45 -0.428 0 O-C-N 122.052 -0.675 . . . . 2.6 112.028 -179.525 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -60.38 -31.46 70.37 Favored 'General case' 0 N--CA 1.447 -0.575 0 N-CA-C 109.428 -0.582 . . . . 1.94 109.428 -179.214 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 26.3 t -66.47 -41.54 88.77 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.182 0 C-N-CA 118.567 -1.253 . . . . 1.87 111.682 175.44 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 33.3 t0 -57.87 -29.54 65.1 Favored 'General case' 0 N--CA 1.464 0.243 0 CA-C-O 122.098 0.952 . . . . 2.06 111.114 174.925 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 6.8 t70 -74.17 -51.99 13.85 Favored 'General case' 0 N--CA 1.446 -0.626 0 N-CA-C 108.407 -0.96 . . . . 2.28 108.407 -174.482 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 1.2 t80 -59.75 -47.8 84.22 Favored 'General case' 0 N--CA 1.454 -0.249 0 C-N-CA 124.232 1.013 . . . . 5.1 109.304 -179.161 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -61.32 -30.06 70.26 Favored 'General case' 0 N--CA 1.446 -0.638 0 CA-C-O 118.284 -0.865 . . . . 2.0 111.469 178.289 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -88.71 -4.32 76.1 Favored Glycine 0 CA--C 1.525 0.68 0 CA-C-N 119.839 1.199 . . . . 1.4 112.56 179.188 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -90.15 -49.55 6.5 Favored 'General case' 0 N--CA 1.451 -0.416 0 N-CA-C 108.715 -0.846 . . . . 2.67 108.715 173.012 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 3.0 mm? -79.58 -38.62 33.62 Favored 'General case' 0 N--CA 1.449 -0.509 0 C-N-CA 125.151 1.38 . . . . 2.65 111.976 -177.037 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 2.7 mt -116.51 173.65 6.49 Favored 'General case' 0 N--CA 1.445 -0.678 0 N-CA-C 106.32 -1.733 . . . . 2.85 106.32 -177.994 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER 57.48 99.18 0.02 OUTLIER 'General case' 0 CA--C 1.537 0.468 0 CA-C-O 122.941 1.353 . . . . 5.66 112.063 -177.07 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 24.5 mttm -68.62 168.51 12.89 Favored 'General case' 0 C--O 1.226 -0.141 0 O-C-N 120.216 -1.553 . . . . 8.52 110.255 -176.583 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -58.67 88.53 0.01 OUTLIER 'General case' 0 CA--C 1.533 0.31 0 C-N-CA 124.616 1.166 . . . . 7.35 112.284 -165.234 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 1.1 mt-30 -149.47 -48.02 0.14 Allowed 'General case' 0 C--N 1.332 -0.165 0 C-N-CA 124.312 1.045 . . . . 12.25 109.968 -174.322 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 34.4 t -127.78 157.47 40.31 Favored 'General case' 0 N--CA 1.452 -0.37 0 N-CA-C 106.564 -1.643 . . . . 6.11 106.564 167.05 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 16.3 t70 -91.87 143.09 26.86 Favored 'General case' 0 N--CA 1.449 -0.476 0 N-CA-C 107.091 -1.448 . . . . 5.22 107.091 174.393 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 4.0 mp 63.87 152.13 0.04 OUTLIER 'General case' 0 CA--C 1.541 0.617 0 C-N-CA 125.917 1.687 . . . . 2.71 111.044 -168.266 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 11.2 p -66.09 -45.22 91.06 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.498 0 O-C-N 120.337 -1.477 . . . . 2.79 109.866 -174.413 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 24.1 p 46.32 -146.7 0.17 Allowed 'General case' 0 CA--C 1.538 0.49 0 C-N-CA 125.07 1.348 . . . . 4.25 112.255 179.847 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 40.3 t-20 -100.59 76.4 1.82 Allowed 'General case' 0 C--O 1.232 0.153 0 O-C-N 121.034 -1.041 . . . . 8.48 110.405 -177.349 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 25.3 p -69.04 -49.86 53.84 Favored 'General case' 0 N--CA 1.453 -0.322 0 CA-C-N 116.481 -0.327 . . . . 3.76 111.191 -178.135 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 6.8 mtpm? -57.5 -34.75 69.4 Favored 'General case' 0 N--CA 1.465 0.318 0 N-CA-C 113.5 0.926 . . . . 8.05 113.5 -175.958 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 34.1 mmtt -134.44 97.21 3.76 Favored 'General case' 0 N--CA 1.452 -0.34 0 N-CA-C 106.575 -1.639 . . . . 7.18 106.575 -177.282 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 27.3 t80 -48.85 95.23 0.01 OUTLIER 'General case' 0 N--CA 1.456 -0.154 0 C-N-CA 125.396 1.478 . . . . 8.22 110.88 -167.672 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 44.9 pt 39.1 79.67 0.02 OUTLIER 'Isoleucine or valine' 0 CA--C 1.538 0.497 0 C-N-CA 126.4 1.88 . . . . 4.02 112.911 -172.05 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 42.2 t0 -116.48 -58.32 2.1 Favored 'General case' 0 N--CA 1.467 0.41 0 C-N-CA 123.693 0.797 . . . . 2.28 110.335 -174.145 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 5.4 mm -51.94 -54.74 12.18 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.397 0 C-N-CA 124.74 1.216 . . . . 1.7 109.523 172.673 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 48' ' ' PHE . . . . . 0.434 ' CD2' ' HE3' ' A' ' 49' ' ' LYS . 22.1 t80 -57.77 -28.62 64.14 Favored 'General case' 0 N--CA 1.452 -0.325 0 O-C-N 120.414 -1.429 . . . . 0.54 112.148 176.538 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . 0.434 ' HE3' ' CD2' ' A' ' 48' ' ' PHE . 0.2 OUTLIER -69.17 -46.21 68.08 Favored 'General case' 0 N--CA 1.45 -0.431 0 O-C-N 120.353 -1.467 . . . . 2.11 111.251 -178.317 . . . . . . . . 3 3 . 1 . 027 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 52.3 tp10 -83.68 -66.01 0.94 Allowed 'General case' 0 C--N 1.33 -0.264 0 N-CA-C 109.009 -0.738 . . . . 2.82 109.009 -179.688 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 29.9 mp0 -69.19 -32.6 72.0 Favored 'General case' 0 C--O 1.236 0.384 0 O-C-N 121.384 -0.823 . . . . 2.69 111.35 -172.082 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -72.14 42.27 0.78 Allowed Glycine 0 CA--C 1.529 0.913 0 C-N-CA 124.652 1.12 . . . . 0.43 113.949 172.5 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 22.9 t -146.38 24.43 1.26 Allowed 'General case' 0 N--CA 1.447 -0.584 0 O-C-N 121.246 -1.149 . . . . 2.45 109.511 159.257 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -138.06 -27.99 0.88 Allowed 'General case' 0 C--N 1.342 0.273 0 N-CA-C 113.778 1.029 . . . . 3.7 113.778 -169.979 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 32.0 mt -68.28 -40.02 81.96 Favored 'General case' 0 C--N 1.333 -0.151 0 CA-C-N 119.06 0.845 . . . . 1.49 110.793 -179.441 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER 177.71 165.42 0.65 Allowed 'General case' 0 C--N 1.33 -0.253 0 C-N-CA 125.511 1.524 . . . . 1.66 106.961 -173.477 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 7.2 m -59.8 -35.18 74.14 Favored 'General case' 0 N--CA 1.453 -0.278 0 C-N-CA 123.027 0.531 . . . . 1.36 110.637 170.262 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -71.18 -6.09 36.84 Favored 'General case' 0 CA--C 1.533 0.306 0 C-N-CA 122.88 0.472 . . . . 1.66 112.032 176.127 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -101.85 4.23 52.97 Favored Glycine 0 CA--C 1.524 0.606 0 C-N-CA 124.524 1.059 . . . . 0.61 111.196 172.853 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -114.1 -17.89 11.81 Favored 'General case' 0 CA--C 1.527 0.064 0 C-N-CA 124.356 1.062 . . . . 4.4 111.514 177.274 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 13.9 p -61.74 -160.13 0.01 OUTLIER 'General case' 0 CA--C 1.541 0.607 0 C-N-CA 125.443 1.497 . . . . 1.81 109.691 168.069 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 3.7 m120 -50.49 146.62 5.26 Favored 'General case' 0 CA--C 1.535 0.373 0 O-C-N 119.983 -1.698 . . . . 2.16 111.469 -177.081 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 38.8 tt0 -56.52 -30.62 63.24 Favored 'General case' 0 N--CA 1.467 0.398 0 CA-C-O 121.443 0.64 . . . . 2.65 110.493 179.095 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -53.69 -45.05 70.24 Favored 'General case' 0 N--CA 1.452 -0.367 0 C-N-CA 123.841 0.857 . . . . 1.58 112.183 172.643 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 8.7 mt-10 -72.75 -39.26 66.99 Favored 'General case' 0 C--O 1.221 -0.397 0 O-C-N 121.562 -0.712 . . . . 2.29 110.756 178.484 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 55.4 t80 -51.45 -52.93 42.2 Favored 'General case' 0 C--N 1.332 -0.159 0 C-N-CA 123.337 0.655 . . . . 0.33 111.18 173.99 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 73.4 t80 -66.61 -45.54 78.83 Favored 'General case' 0 N--CA 1.449 -0.492 0 C-N-CA 123.711 0.804 . . . . 0.47 110.579 -178.567 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -60.12 -47.6 85.22 Favored 'General case' 0 CA--C 1.539 0.537 0 O-C-N 121.198 -0.939 . . . . 1.6 111.963 -178.666 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 48.1 mm-40 -55.41 -44.79 76.55 Favored 'General case' 0 CA--C 1.517 -0.292 0 C-N-CA 125.011 1.324 . . . . 4.23 109.975 169.36 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -55.7 -45.94 77.77 Favored 'General case' 0 N--CA 1.446 -0.632 0 CA-C-O 118.06 -0.971 . . . . 1.62 109.508 -175.869 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 73.9 t80 -56.82 -50.8 71.3 Favored 'General case' 0 N--CA 1.464 0.271 0 CA-C-N 119.343 0.974 . . . . 3.73 111.913 172.799 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 18.3 ttp180 -46.15 -58.02 4.0 Favored 'General case' 0 CA--C 1.531 0.25 0 CA-C-N 118.283 0.492 . . . . 3.41 110.826 178.103 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -65.14 -32.51 74.23 Favored 'General case' 0 C--N 1.324 -0.528 0 C-N-CA 125.332 1.453 . . . . 1.8 110.92 -178.428 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -59.48 -39.57 84.14 Favored 'General case' 0 CA--C 1.517 -0.315 0 C-N-CA 123.701 0.8 . . . . 3.22 110.012 -178.047 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 22.9 p80 -90.52 -36.45 14.48 Favored 'General case' 0 N--CA 1.45 -0.443 0 CA-C-O 115.723 -2.084 . . . . 1.17 110.867 -176.948 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 15.9 m -8.14 111.32 0.01 OUTLIER 'General case' 0 C--N 1.348 0.53 0 C-N-CA 127.883 2.473 . . . . 1.69 113.342 -171.765 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 4.1 p -46.56 -42.62 16.19 Favored 'General case' 0 N--CA 1.45 -0.465 0 C-N-CA 125.186 1.394 . . . . 2.04 110.567 -177.013 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 14.6 t0 -70.13 105.63 2.99 Favored 'General case' 0 N--CA 1.447 -0.586 0 C-N-CA 118.073 -1.451 . . . . 2.26 110.162 164.333 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 5.9 p-80 -39.38 -43.36 1.19 Allowed 'General case' 0 N--CA 1.45 -0.464 0 CA-C-N 114.457 -1.247 . . . . 5.56 113.039 169.657 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -66.98 -40.1 87.35 Favored 'General case' 0 N--CA 1.453 -0.291 0 O-C-N 121.872 -0.517 . . . . 2.18 110.195 -172.549 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 1.1 tm-20 -50.94 -41.79 59.24 Favored 'General case' 0 C--N 1.328 -0.327 0 C-N-CA 124.604 1.161 . . . . 3.33 110.097 172.625 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -63.53 -47.18 82.68 Favored 'General case' 0 CA--C 1.519 -0.234 0 C-N-CA 119.327 -0.949 . . . . 4.44 108.795 176.926 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 2.1 mm? -56.57 -25.11 51.52 Favored 'General case' 0 N--CA 1.456 -0.129 0 CA-C-O 118.042 -0.98 . . . . 1.58 113.308 174.061 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 14.9 mptt -64.64 -48.33 75.23 Favored 'General case' 0 CA--C 1.52 -0.21 0 CA-C-N 121.082 1.764 . . . . 4.17 108.956 172.337 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 2.4 t -57.87 -60.51 2.1 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.5 0 CA-C-N 118.608 0.64 . . . . 2.03 109.921 173.488 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 36.0 mt-30 -52.48 -50.44 62.73 Favored 'General case' 0 N--CA 1.453 -0.32 0 CA-C-N 118.909 0.777 . . . . 4.59 111.091 -171.064 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 8.5 pttp -65.02 -41.09 95.61 Favored 'General case' 0 N--CA 1.455 -0.214 0 O-C-N 121.623 -0.673 . . . . 4.47 110.842 -179.249 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 89.9 m-20 -79.75 -8.5 59.29 Favored 'General case' 0 CA--C 1.529 0.16 0 O-C-N 122.077 -0.389 . . . . 1.69 110.891 -177.27 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -160.9 62.52 1.63 Allowed Pre-proline 0 N--CA 1.446 -0.648 0 C-N-CA 123.606 0.763 . . . . 1.71 110.769 -169.416 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 28.5 Cg_endo -59.99 -35.9 91.61 Favored 'Trans proline' 0 N--CA 1.452 -0.929 0 C-N-CA 122.018 1.812 . . . . 2.16 110.56 -174.153 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 3.4 tttt -77.56 -44.23 29.23 Favored 'General case' 0 N--CA 1.453 -0.285 0 C-N-CA 123.496 0.718 . . . . 5.67 111.219 -177.038 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 12.0 m -58.21 -42.47 86.26 Favored 'General case' 0 CA--C 1.518 -0.288 0 O-C-N 121.22 -0.925 . . . . 1.62 110.394 177.734 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 56.3 t80 -54.9 -51.38 66.2 Favored 'General case' 0 CA--C 1.502 -0.893 0 C-N-CA 120.07 -0.652 . . . . 3.9 111.161 178.144 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 36.6 tt0 -50.94 -35.61 34.24 Favored 'General case' 0 N--CA 1.445 -0.701 0 O-C-N 124.374 1.046 . . . . 2.25 111.016 178.74 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 4.1 t80 -58.75 -58.95 6.32 Favored 'General case' 0 CA--C 1.532 0.288 0 C-N-CA 123.268 0.627 . . . . 1.18 110.102 -177.55 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 3.9 mp -62.89 -35.29 70.55 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.128 0 O-C-N 121.419 -0.801 . . . . 2.02 109.59 178.781 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -63.23 -29.81 71.08 Favored 'General case' 0 N--CA 1.452 -0.328 0 C-N-CA 122.693 0.397 . . . . 2.43 110.206 -179.012 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 10.7 t70 -70.91 -45.72 63.79 Favored 'General case' 0 C--N 1.333 -0.116 0 CA-C-O 121.546 0.689 . . . . 2.56 109.734 174.57 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 5.5 mm-40 -62.08 -52.57 63.36 Favored 'General case' 0 CA--C 1.532 0.286 0 C-N-CA 123.493 0.717 . . . . 3.37 111.893 -175.015 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -75.5 103.71 3.32 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.291 0 N-CA-C 107.575 -1.268 . . . . 5.91 107.575 -174.167 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 4.2 tmtt? -154.64 -42.82 0.09 Allowed 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.016 -0.538 . . . . 11.25 110.423 -165.386 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 102' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -135.75 -46.26 0.67 Allowed 'General case' 0 N--CA 1.456 -0.141 0 C-N-CA 124.186 0.994 . . . . 9.63 109.963 177.566 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 7.2 tp -61.39 136.72 24.6 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.327 0 N-CA-C 109.555 -0.535 . . . . 6.23 109.555 178.428 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 104' ' ' ILE . . . . . . . . . . . . . 7.9 tp -155.0 -53.89 0.02 OUTLIER 'Isoleucine or valine' 0 CA--C 1.528 0.113 0 N-CA-C 109.519 -0.548 . . . . 10.27 109.519 176.793 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 2.9 t-20 -158.02 175.9 13.23 Favored 'General case' 0 C--O 1.233 0.212 0 N-CA-C 107.787 -1.19 . . . . 7.91 107.787 176.932 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 89.5 p . . . . . 0 C--O 1.248 0.979 0 CA-C-O 116.354 -1.784 . . . . 9.65 108.15 170.188 . . . . . . . . 0 0 . 1 . 028 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.472 1.087 0 N-CA-C 108.932 -1.667 . . . . 15.25 108.932 . . . . . . . . . 0 0 . 1 . 028 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 13.1 m -153.19 84.5 1.2 Allowed 'General case' 0 CA--C 1.519 -0.228 0 CA-C-N 118.652 1.226 . . . . 17.72 109.935 -177.759 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 2.6 ttmt -167.1 41.37 0.05 OUTLIER 'General case' 0 C--O 1.224 -0.246 0 C-N-CA 121.047 -0.261 . . . . 21.57 111.534 178.315 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 58.77 39.54 93.83 Favored Glycine 0 C--N 1.336 0.559 0 N-CA-C 111.586 -0.606 . . . . 15.59 111.586 -175.103 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 30.2 m -84.81 -169.93 0.13 Allowed 'Isoleucine or valine' 0 N--CA 1.439 -0.99 0 N-CA-C 109.627 -0.509 . . . . 13.2 109.627 179.466 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 12.2 pt-20 -82.02 111.04 17.81 Favored 'General case' 0 N--CA 1.448 -0.559 0 CA-C-O 122.31 1.052 . . . . 8.55 111.114 179.779 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -95.55 40.37 1.11 Allowed 'General case' 0 N--CA 1.451 -0.379 0 N-CA-C 108.498 -0.927 . . . . 11.42 108.498 -178.942 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 69.7 mtt180 -137.52 -84.47 0.32 Allowed 'General case' 0 N--CA 1.448 -0.575 0 C-N-CA 125.714 1.605 . . . . 8.06 107.504 -173.022 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 2.3 m120 -62.68 -61.42 2.43 Favored 'General case' 0 C--O 1.224 -0.27 0 CA-C-N 119.291 0.951 . . . . 2.96 111.953 179.276 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 32.7 t70 -52.87 -43.22 65.95 Favored 'General case' 0 N--CA 1.465 0.28 0 CA-C-N 119.425 1.011 . . . . 2.4 111.309 179.642 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 62.0 m -58.61 -60.43 3.82 Favored 'General case' 0 C--O 1.225 -0.201 0 O-C-N 121.575 -0.703 . . . . 1.98 112.655 177.242 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 30.0 mt-10 -69.36 -37.27 77.53 Favored 'General case' 0 C--N 1.329 -0.321 0 C-N-CA 125.076 1.35 . . . . 3.33 109.998 -168.825 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -54.36 -63.77 4.9 Favored Glycine 0 CA--C 1.526 0.723 0 N-CA-C 109.993 -1.243 . . . . 0.81 109.993 167.079 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 79.4 t80 -49.84 -55.9 12.46 Favored 'General case' 0 C--O 1.224 -0.256 0 C-N-CA 124.031 0.932 . . . . 4.46 111.28 -175.635 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -66.69 -31.0 51.54 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.192 0 O-C-N 121.457 -0.777 . . . . 1.51 112.632 -179.199 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 5.7 t60 -59.65 -57.2 13.97 Favored 'General case' 0 C--N 1.341 0.228 0 N-CA-C 106.406 -1.702 . . . . 0.85 106.406 176.359 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 44.0 mt-10 -54.11 -39.51 66.47 Favored 'General case' 0 N--CA 1.452 -0.343 0 C-N-CA 124.607 1.163 . . . . 2.1 110.713 178.384 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 4.0 t80 -58.78 -48.08 82.5 Favored 'General case' 0 CA--C 1.521 -0.16 0 C-N-CA 124.054 0.942 . . . . 3.14 110.488 178.625 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -51.15 -45.44 51.74 Favored Glycine 0 CA--C 1.525 0.67 0 N-CA-C 110.322 -1.111 . . . . 0.5 110.322 172.983 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 2.3 t-160 -60.81 -48.68 80.72 Favored 'General case' 0 N--CA 1.45 -0.426 0 O-C-N 122.109 -0.642 . . . . 2.65 111.32 179.434 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -60.3 -30.89 69.77 Favored 'General case' 0 N--CA 1.453 -0.319 0 O-C-N 121.696 -0.628 . . . . 1.72 110.169 179.846 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 74.2 t -69.95 -39.47 77.52 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.163 0 O-C-N 121.338 -0.851 . . . . 2.0 110.633 176.8 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 9.5 t0 -59.49 -30.66 68.71 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-O 121.364 0.602 . . . . 2.14 110.698 172.242 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 8.5 t0 -67.88 -52.45 36.34 Favored 'General case' 0 N--CA 1.452 -0.367 0 N-CA-C 107.714 -1.217 . . . . 1.99 107.714 -174.881 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 40.8 t80 -56.08 -49.61 73.32 Favored 'General case' 0 N--CA 1.454 -0.231 0 CA-C-N 115.898 -0.592 . . . . 3.45 110.239 177.869 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -57.6 -38.71 75.36 Favored 'General case' 0 N--CA 1.448 -0.537 0 C-N-CA 120.851 -0.34 . . . . 2.0 111.206 -179.332 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -71.46 -41.13 58.8 Favored Glycine 0 CA--C 1.525 0.668 0 N-CA-C 111.084 -0.806 . . . . 1.09 111.084 -179.194 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 1.7 t80 -61.77 -47.2 86.23 Favored 'General case' 0 N--CA 1.454 -0.242 0 C-N-CA 123.487 0.715 . . . . 2.59 109.411 -176.39 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -81.81 -32.65 31.19 Favored 'General case' 0 N--CA 1.451 -0.41 0 C-N-CA 123.275 0.63 . . . . 2.92 112.432 -176.59 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 2.6 mt -124.53 75.61 1.42 Allowed 'General case' 0 N--CA 1.451 -0.386 0 N-CA-C 107.106 -1.442 . . . . 3.2 107.106 -169.487 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -46.92 -51.76 16.13 Favored 'General case' 0 N--CA 1.468 0.453 0 C-N-CA 124.635 1.174 . . . . 6.64 111.301 -165.398 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 34.27 74.6 0.06 Allowed 'General case' 0 CA--C 1.54 0.563 0 C-N-CA 127.819 2.448 . . . . 10.66 113.072 174.215 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 17.2 t-20 71.09 140.97 0.05 OUTLIER 'General case' 0 C--O 1.22 -0.455 0 C-N-CA 130.043 3.337 . . . . 8.48 112.381 -175.099 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 11.3 pt20 -80.62 36.44 0.38 Allowed 'General case' 0 CA--C 1.534 0.36 0 C-N-CA 123.37 0.668 . . . . 9.41 111.563 -176.655 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -147.77 147.04 29.45 Favored 'General case' 0 N--CA 1.451 -0.396 0 N-CA-C 107.793 -1.188 . . . . 7.54 107.793 178.809 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 38.5 m-20 54.82 -163.78 0.12 Allowed 'General case' 0 CA--C 1.54 0.581 0 C-N-CA 124.888 1.275 . . . . 11.08 109.923 -173.266 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 2.7 mm? -116.91 -144.49 0.38 Allowed 'General case' 0 CA--C 1.539 0.552 0 N-CA-C 106.831 -1.544 . . . . 5.12 106.831 176.277 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 3.0 p -74.61 -24.48 18.5 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.446 0 O-C-N 119.941 -1.725 . . . . 3.61 110.392 -179.256 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 8.8 t -49.8 151.75 1.71 Allowed 'General case' 0 CA--C 1.538 0.498 0 C-N-CA 124.956 1.302 . . . . 5.0 111.792 169.143 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 13.5 m-80 38.83 46.2 1.03 Allowed 'General case' 0 CA--C 1.538 0.491 0 C-N-CA 126.214 1.806 . . . . 8.0 113.839 -176.875 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 10.5 t -74.13 -65.69 0.81 Allowed 'General case' 0 CA--C 1.537 0.456 0 O-C-N 120.861 -1.149 . . . . 4.12 112.377 -177.856 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 3.8 mptt -55.91 -62.16 1.88 Allowed 'General case' 0 N--CA 1.469 0.511 0 O-C-N 121.138 -0.977 . . . . 7.02 111.124 -173.677 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -89.52 101.46 14.14 Favored 'General case' 0 N--CA 1.449 -0.497 0 N-CA-C 105.537 -2.023 . . . . 6.88 105.537 167.328 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 57.7 m-85 -52.57 128.14 25.08 Favored 'General case' 0 N--CA 1.452 -0.366 0 O-C-N 124.137 0.898 . . . . 6.74 108.968 173.44 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 5.0 tt 34.36 78.41 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.543 0.7 0 C-N-CA 126.519 1.928 . . . . 3.05 112.74 176.76 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 14.8 t70 -140.39 -58.24 0.53 Allowed 'General case' 0 N--CA 1.465 0.31 0 C-N-CA 124.684 1.194 . . . . 2.12 110.396 -170.086 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 5.7 mm -53.31 -50.08 49.38 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.19 0 N-CA-C 108.339 -0.986 . . . . 1.69 108.339 172.052 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 19.6 t80 -63.61 -25.76 68.38 Favored 'General case' 0 N--CA 1.454 -0.225 0 O-C-N 121.906 -0.496 . . . . 0.48 112.008 177.667 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . 0.497 ' HA ' ' CE ' ' A' ' 49' ' ' LYS . 0.6 OUTLIER -71.22 -48.37 51.75 Favored 'General case' 0 N--CA 1.45 -0.43 0 O-C-N 119.774 -1.829 . . . . 2.58 110.888 -178.192 . . . . . . . . 3 3 . 1 . 028 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 22.8 tp10 -85.63 -63.53 1.31 Allowed 'General case' 0 C--N 1.328 -0.331 0 N-CA-C 108.582 -0.896 . . . . 2.6 108.582 -176.927 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 3.4 mm-40 -67.22 -32.86 74.2 Favored 'General case' 0 CA--C 1.536 0.407 0 C-N-CA 123.833 0.853 . . . . 2.73 109.789 -170.175 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . 0.456 ' HA2' ' CD1' ' A' ' 66' ' ' PHE . . . -68.05 43.9 0.3 Allowed Glycine 0 CA--C 1.53 1.028 0 C-N-CA 126.917 2.199 . . . . 0.34 114.587 171.132 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 33.1 p -154.2 32.25 0.43 Allowed 'General case' 0 N--CA 1.448 -0.536 0 O-C-N 121.104 -1.233 . . . . 2.62 109.869 160.274 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -137.35 -43.94 0.55 Allowed 'General case' 0 CA--C 1.517 -0.296 0 N-CA-C 112.908 0.707 . . . . 2.66 112.908 -168.719 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 15.3 mt -63.11 -36.48 83.74 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 120.872 0.367 . . . . 1.79 110.749 -175.926 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 1.1 t 176.53 171.01 0.45 Allowed 'General case' 0 CA--C 1.531 0.234 0 C-N-CA 125.835 1.654 . . . . 1.62 107.501 -177.919 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 20.8 m -57.38 -33.71 68.1 Favored 'General case' 0 N--CA 1.453 -0.306 0 O-C-N 121.713 -0.617 . . . . 1.35 110.555 168.016 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -61.15 -30.89 70.66 Favored 'General case' 0 CA--C 1.53 0.199 0 CA-C-N 118.475 0.58 . . . . 1.67 110.894 174.207 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -71.8 -11.56 73.69 Favored Glycine 0 C--O 1.221 -0.663 0 O-C-N 121.354 -0.841 . . . . 0.48 111.729 176.524 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 32.1 ttt180 -105.14 -12.54 16.07 Favored 'General case' 0 CA--C 1.533 0.294 0 CA-C-N 118.817 1.308 . . . . 3.52 112.473 177.224 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 41.4 p -66.39 -134.9 0.0 OUTLIER 'General case' 0 N--CA 1.47 0.573 0 CA-C-N 118.833 0.742 . . . . 1.81 111.211 178.204 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 6.7 t-20 -69.07 152.91 44.62 Favored 'General case' 0 N--CA 1.453 -0.307 0 O-C-N 119.465 -2.022 . . . . 2.9 107.943 179.871 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 5.3 tm-20 -60.7 -33.1 72.36 Favored 'General case' 0 CA--C 1.531 0.246 0 CA-C-N 118.72 0.691 . . . . 3.4 109.625 177.487 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -61.0 -30.73 70.46 Favored 'General case' 0 N--CA 1.45 -0.435 0 N-CA-C 113.246 0.832 . . . . 1.62 113.246 174.848 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 2.4 mt-10 -80.13 -42.31 23.76 Favored 'General case' 0 CA--C 1.51 -0.567 0 CA-C-O 118.392 -0.813 . . . . 2.36 110.592 176.5 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 66' ' ' PHE . . . . . 0.456 ' CD1' ' HA2' ' A' ' 52' ' ' GLY . 54.7 t80 -48.99 -49.0 42.92 Favored 'General case' 0 N--CA 1.453 -0.309 0 C-N-CA 123.596 0.758 . . . . 0.39 111.164 172.816 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 82.7 t80 -63.29 -44.42 95.11 Favored 'General case' 0 CA--C 1.539 0.53 0 O-C-N 121.319 -0.863 . . . . 0.47 110.772 177.074 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -62.21 -56.44 18.66 Favored 'General case' 0 CA--C 1.54 0.586 0 O-C-N 121.296 -0.878 . . . . 1.65 113.021 -175.594 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 1.1 pp20? -56.19 -38.45 70.98 Favored 'General case' 0 C--N 1.333 -0.123 0 O-C-N 120.962 -1.086 . . . . 3.73 111.204 171.376 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -57.91 -42.55 84.99 Favored 'General case' 0 N--CA 1.45 -0.438 0 CA-C-O 118.493 -0.765 . . . . 1.8 110.562 175.347 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 55.7 t80 -59.98 -50.08 75.16 Favored 'General case' 0 N--CA 1.464 0.268 0 CA-C-N 120.37 1.441 . . . . 3.94 111.544 174.453 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 6.9 ttt180 -44.71 -62.22 1.29 Allowed 'General case' 0 N--CA 1.465 0.294 0 N-CA-C 109.097 -0.705 . . . . 3.02 109.097 178.08 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -60.43 -37.93 82.47 Favored 'General case' 0 CA--C 1.515 -0.372 0 C-N-CA 125.651 1.58 . . . . 1.55 111.107 -177.253 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 1.6 tmt? -65.81 -33.01 74.86 Favored 'General case' 0 N--CA 1.451 -0.393 0 O-C-N 122.189 -0.319 . . . . 3.58 111.263 -174.593 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 5.2 p80 -92.8 -20.43 20.74 Favored 'General case' 0 CA--C 1.527 0.096 0 CA-C-O 117.159 -1.4 . . . . 1.08 112.708 177.35 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 76' ' ' SER . . . . . 0.429 ' O ' ' HD2' ' A' ' 82' ' ' ARG . 32.0 m -33.77 114.43 0.19 Allowed 'General case' 0 C--O 1.22 -0.491 0 C-N-CA 125.981 1.712 . . . . 1.63 112.446 -169.547 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 1.4 p -46.11 -39.96 10.24 Favored 'General case' 0 C--N 1.326 -0.441 0 C-N-CA 124.863 1.265 . . . . 2.3 110.832 -178.968 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 11.5 t0 -65.03 103.42 0.74 Allowed 'General case' 0 N--CA 1.451 -0.407 0 CA-C-O 121.823 0.821 . . . . 1.87 110.238 165.486 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 11.7 p80 -46.15 -37.7 7.32 Favored 'General case' 0 N--CA 1.455 -0.212 0 C-N-CA 123.574 0.75 . . . . 5.71 112.13 173.316 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -61.1 -47.05 88.09 Favored 'General case' 0 N--CA 1.451 -0.394 0 CA-C-N 118.378 0.535 . . . . 1.51 110.292 -178.555 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 2.9 mt-10 -52.8 -40.22 63.04 Favored 'General case' 0 CA--C 1.512 -0.484 0 CA-C-O 121.116 0.484 . . . . 3.13 111.365 177.348 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 82' ' ' ARG . . . . . 0.429 ' HD2' ' O ' ' A' ' 76' ' ' SER . 15.3 mtp180 -64.77 -56.49 13.25 Favored 'General case' 0 N--CA 1.45 -0.468 0 C-N-CA 119.173 -1.011 . . . . 3.31 108.343 178.762 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -56.34 -23.77 39.48 Favored 'General case' 0 C--O 1.223 -0.291 0 N-CA-C 113.28 0.844 . . . . 1.71 113.28 178.883 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 32.1 mttt -67.66 -45.3 75.68 Favored 'General case' 0 CA--C 1.517 -0.31 0 CA-C-N 120.242 1.383 . . . . 2.5 108.777 173.64 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 39.8 t -60.11 -53.48 48.0 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.614 0 CA-C-O 118.661 -0.685 . . . . 1.75 110.671 170.95 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 60.1 mt-30 -60.6 -44.59 96.11 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 120.394 1.452 . . . . 4.99 110.965 -171.125 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 22.4 tttt -59.87 -51.32 70.24 Favored 'General case' 0 N--CA 1.452 -0.362 0 C-N-CA 123.948 0.899 . . . . 3.02 110.6 175.751 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 38.9 m-20 -78.41 -8.24 58.26 Favored 'General case' 0 C--N 1.331 -0.212 0 C-N-CA 122.944 0.498 . . . . 1.59 111.474 -174.144 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -159.37 69.61 3.29 Favored Pre-proline 0 N--CA 1.447 -0.598 0 C-N-CA 125.013 1.325 . . . . 1.25 109.305 -173.144 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 36.2 Cg_endo -61.36 -25.76 80.61 Favored 'Trans proline' 0 N--CA 1.453 -0.907 0 C-N-CA 122.454 2.103 . . . . 1.74 110.759 -176.462 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 7.1 mttp -81.62 -52.96 6.64 Favored 'General case' 0 N--CA 1.449 -0.493 0 C-N-CA 123.211 0.604 . . . . 5.71 110.557 177.902 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 2.3 m -55.51 -39.9 71.1 Favored 'General case' 0 N--CA 1.467 0.385 0 CA-C-N 119.28 0.946 . . . . 1.7 111.296 -175.67 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 3.2 t80 -48.96 -65.67 0.53 Allowed 'General case' 0 CA--C 1.503 -0.836 0 CA-C-O 121.423 0.63 . . . . 5.96 112.562 175.261 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 44.7 tt0 -54.2 -31.98 54.44 Favored 'General case' 0 N--CA 1.44 -0.965 0 CA-C-N 113.926 -1.488 . . . . 1.86 109.727 -178.162 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 4.7 t80 -68.9 -58.53 4.01 Favored 'General case' 0 N--CA 1.451 -0.398 0 C-N-CA 122.87 0.468 . . . . 2.42 110.442 -173.102 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 35.5 mm -48.27 -46.41 13.75 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.139 0 C-N-CA 123.9 0.88 . . . . 2.94 109.961 172.279 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 12.4 t-20 -64.82 -32.7 74.52 Favored 'General case' 0 CA--C 1.535 0.373 0 CA-C-N 117.853 0.297 . . . . 2.44 111.631 -176.153 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 12.5 t70 -61.4 -45.38 94.6 Favored 'General case' 0 N--CA 1.464 0.236 0 CA-C-O 121.61 0.719 . . . . 2.06 109.404 174.723 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -72.09 -46.93 54.87 Favored 'General case' 0 CA--C 1.536 0.425 0 CA-C-N 115.492 -0.776 . . . . 5.05 110.805 -172.137 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 20.7 mm -72.19 97.31 0.7 Allowed 'Isoleucine or valine' 0 N--CA 1.454 -0.237 0 N-CA-C 108.498 -0.927 . . . . 8.09 108.498 -175.291 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -134.27 84.83 2.14 Favored 'General case' 0 C--O 1.222 -0.349 0 O-C-N 121.601 -0.687 . . . . 10.54 109.498 177.376 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 102' ' ' PHE . . . . . . . . . . . . . 7.8 m-85 48.58 89.12 0.02 OUTLIER 'General case' 0 CA--C 1.535 0.402 0 C-N-CA 125.658 1.583 . . . . 8.94 112.67 178.437 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 0.5 OUTLIER -112.69 4.6 8.19 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.489 0 O-C-N 121.897 -0.502 . . . . 5.5 111.418 179.495 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 104' ' ' ILE . . . . . . . . . . . . . 6.9 pt -87.43 68.53 0.62 Allowed 'Isoleucine or valine' 0 CA--C 1.529 0.164 0 O-C-N 120.813 -1.18 . . . . 9.82 110.46 -176.768 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 1.5 t-20 70.25 176.86 0.27 Allowed 'General case' 0 CA--C 1.534 0.33 0 C-N-CA 123.955 0.902 . . . . 7.93 110.436 -178.389 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 20.3 t . . . . . 0 C--O 1.253 1.238 0 CA-C-O 116.574 -1.679 . . . . 13.28 110.661 -174.987 . . . . . . . . 0 0 . 1 . 029 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . 0.537 ' HA2' ' OE2' ' A' ' 17' ' ' GLU . . . . . . . . 0 N--CA 1.469 0.862 0 N-CA-C 109.638 -1.385 . . . . 12.81 109.638 . . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 11.5 p -125.85 -105.95 0.33 Allowed 'General case' 0 N--CA 1.449 -0.482 0 N-CA-C 106.038 -1.838 . . . . 12.44 106.038 170.628 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 71.85 166.21 0.3 Allowed 'General case' 0 N--CA 1.466 0.333 0 C-N-CA 125.965 1.706 . . . . 16.28 111.038 -176.378 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 95.89 -167.92 25.8 Favored Glycine 0 C--N 1.333 0.415 0 N-CA-C 110.499 -1.04 . . . . 12.46 110.499 177.132 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 33.5 m -95.52 -163.2 0.11 Allowed 'Isoleucine or valine' 0 N--CA 1.443 -0.801 0 N-CA-C 108.027 -1.101 . . . . 13.3 108.027 169.549 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 9.8 pt-20 -81.51 121.97 26.96 Favored 'General case' 0 N--CA 1.45 -0.43 0 CA-C-O 121.734 0.778 . . . . 10.15 110.877 174.52 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -158.04 38.99 0.26 Allowed 'General case' 0 N--CA 1.451 -0.382 0 C-N-CA 124.653 1.181 . . . . 8.94 110.372 178.572 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 76.96 -55.66 0.55 Allowed 'General case' 0 N--CA 1.468 0.463 0 C-N-CA 125.317 1.447 . . . . 10.93 111.776 -176.999 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 1.9 m120 -55.94 -33.96 65.21 Favored 'General case' 0 CA--C 1.51 -0.583 0 C-N-CA 123.974 0.91 . . . . 2.66 111.483 -178.131 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 13.6 t70 -60.95 -52.46 64.91 Favored 'General case' 0 N--CA 1.443 -0.821 0 CA-C-O 119.108 -0.472 . . . . 2.16 110.672 173.753 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 19.3 m -58.65 -57.05 14.7 Favored 'General case' 0 CA--C 1.531 0.231 0 CA-C-N 119.444 1.02 . . . . 1.83 111.488 -179.124 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -71.23 -27.7 63.66 Favored 'General case' 0 CA--C 1.536 0.416 0 CA-C-O 121.472 0.654 . . . . 3.95 110.197 -172.759 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -73.03 -37.78 55.99 Favored Glycine 0 CA--C 1.522 0.504 0 N-CA-C 110.68 -0.968 . . . . 0.75 110.68 176.485 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 15.3 t80 -64.15 -54.86 27.07 Favored 'General case' 0 CA--C 1.517 -0.29 0 CA-C-N 118.082 0.941 . . . . 3.66 108.481 -176.359 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 0.6 OUTLIER -61.43 -34.5 61.57 Favored 'Isoleucine or valine' 0 CA--C 1.528 0.113 0 CA-C-O 118.864 -0.589 . . . . 1.85 112.579 175.547 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 4.6 t60 -56.44 -55.09 37.92 Favored 'General case' 0 C--N 1.341 0.211 0 N-CA-C 106.916 -1.513 . . . . 0.65 106.916 177.309 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . 0.537 ' OE2' ' HA2' ' A' ' 1' ' ' GLY . 48.3 mt-10 -62.41 -32.11 72.9 Favored 'General case' 0 N--CA 1.452 -0.367 0 CA-C-O 118.709 -0.662 . . . . 2.63 111.802 179.608 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 17.7 t80 -59.19 -50.21 74.9 Favored 'General case' 0 N--CA 1.452 -0.326 0 CA-C-N 118.999 0.818 . . . . 3.37 109.618 177.34 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -51.87 -43.08 54.49 Favored Glycine 0 CA--C 1.529 0.909 0 N-CA-C 111.011 -0.836 . . . . 0.66 111.011 173.889 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 3.4 t60 -63.28 -53.04 59.04 Favored 'General case' 0 N--CA 1.453 -0.307 0 O-C-N 121.82 -0.812 . . . . 2.47 111.593 -177.738 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -63.65 -27.56 69.31 Favored 'General case' 0 N--CA 1.451 -0.388 0 C-N-CA 123.094 0.558 . . . . 2.06 110.172 -179.352 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 25.1 t -68.28 -42.39 84.44 Favored 'Isoleucine or valine' 0 C--O 1.235 0.307 0 O-C-N 121.342 -0.848 . . . . 2.44 109.646 177.049 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 2.8 t70 -65.24 -20.63 66.52 Favored 'General case' 0 N--CA 1.451 -0.381 0 C-N-CA 120.204 -0.599 . . . . 2.8 111.837 176.209 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 28.1 t70 -63.93 -49.51 72.32 Favored 'General case' 0 N--CA 1.453 -0.282 0 N-CA-C 108.014 -1.106 . . . . 2.22 108.014 -177.942 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -55.4 -43.48 75.26 Favored 'General case' 0 N--CA 1.453 -0.3 0 CA-C-N 115.354 -0.839 . . . . 5.9 111.229 173.049 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -59.45 -39.68 84.39 Favored 'General case' 0 N--CA 1.449 -0.508 0 C-N-CA 119.77 -0.772 . . . . 1.89 110.717 179.619 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -72.87 -40.42 52.3 Favored Glycine 0 CA--C 1.523 0.545 0 CA-C-N 119.083 0.856 . . . . 1.2 111.142 -177.998 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -60.68 -44.57 96.33 Favored 'General case' 0 N--CA 1.452 -0.339 0 O-C-N 121.555 -0.967 . . . . 3.52 109.794 -176.246 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 3.0 mm? -79.7 -35.28 39.28 Favored 'General case' 0 N--CA 1.445 -0.698 0 C-N-CA 123.627 0.771 . . . . 2.52 112.338 179.647 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 2.8 mt -125.97 117.89 24.23 Favored 'General case' 0 CA--C 1.535 0.387 0 N-CA-C 108.021 -1.103 . . . . 2.33 108.021 -168.037 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 46.4 t0 68.54 68.81 0.3 Allowed 'General case' 0 N--CA 1.474 0.735 0 C-N-CA 126.014 1.726 . . . . 4.65 110.802 -166.811 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -69.6 75.96 0.42 Allowed 'General case' 0 CA--C 1.534 0.334 0 C-N-CA 124.552 1.141 . . . . 7.72 111.002 -179.447 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 3.0 t-20 -121.95 173.36 7.57 Favored 'General case' 0 C--N 1.328 -0.341 0 O-C-N 121.631 -0.668 . . . . 6.82 109.25 -163.827 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 15.5 pt20 -66.64 -20.96 66.11 Favored 'General case' 0 CA--C 1.532 0.264 0 O-C-N 121.379 -0.825 . . . . 8.46 111.353 172.773 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -93.26 115.2 27.8 Favored 'General case' 0 N--CA 1.447 -0.578 0 N-CA-C 106.701 -1.592 . . . . 6.08 106.701 173.483 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 26.1 m-20 -71.79 175.27 5.88 Favored 'General case' 0 CA--C 1.534 0.361 0 N-CA-C 109.65 -0.5 . . . . 5.76 109.65 172.316 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 5.8 mp 70.17 153.37 0.11 Allowed 'General case' 0 N--CA 1.467 0.377 0 C-N-CA 127.478 2.311 . . . . 3.56 111.754 -173.61 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 6.7 p -93.0 33.47 0.13 Allowed 'Isoleucine or valine' 0 CA--C 1.535 0.401 0 O-C-N 121.037 -1.04 . . . . 2.55 109.47 178.19 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 12.3 t -52.21 -40.42 61.55 Favored 'General case' 0 N--CA 1.454 -0.255 0 C-N-CA 123.993 0.917 . . . . 3.93 110.182 179.103 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 20.4 t-20 -75.48 82.38 2.53 Favored 'General case' 0 N--CA 1.448 -0.528 0 N-CA-C 108.678 -0.86 . . . . 7.46 108.678 172.761 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 13.5 t -156.53 -175.59 5.51 Favored 'General case' 0 N--CA 1.451 -0.411 0 N-CA-C 109.169 -0.678 . . . . 5.54 109.169 176.445 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . 0.422 ' NZ ' ' OD2' ' A' ' 98' ' ' ASP . 1.9 tpmt? 56.91 -73.24 0.02 OUTLIER 'General case' 0 N--CA 1.463 0.212 0 C-N-CA 126.754 2.021 . . . . 8.07 110.746 -165.522 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 13.4 mttt -141.86 46.56 1.66 Allowed 'General case' 0 C--O 1.222 -0.386 0 C-N-CA 123.639 0.776 . . . . 7.17 110.168 176.74 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 29.4 p90 44.14 65.78 0.97 Allowed 'General case' 0 CA--C 1.534 0.348 0 C-N-CA 125.256 1.422 . . . . 8.11 113.297 169.433 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 1.1 mp 69.84 100.34 0.05 OUTLIER 'Isoleucine or valine' 0 CA--C 1.541 0.598 0 C-N-CA 124.365 1.066 . . . . 4.54 108.159 -171.867 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 50.8 t0 -160.83 -62.85 0.06 Allowed 'General case' 0 N--CA 1.465 0.322 0 O-C-N 120.615 -1.303 . . . . 2.19 108.4 -179.474 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 2.0 mm -52.71 -51.6 34.34 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.29 0 C-N-CA 124.781 1.232 . . . . 1.94 110.211 -179.203 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 37.5 t80 -57.71 -31.54 66.52 Favored 'General case' 0 N--CA 1.454 -0.254 0 N-CA-C 113.044 0.757 . . . . 0.46 113.044 178.305 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . 0.412 ' HA ' ' HE2' ' A' ' 49' ' ' LYS . 1.0 OUTLIER -62.19 -44.8 95.79 Favored 'General case' 0 C--N 1.331 -0.216 0 O-C-N 120.967 -1.083 . . . . 2.04 111.091 -178.255 . . . . . . . . 3 3 . 1 . 029 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 17.8 tp10 -90.62 -61.61 1.64 Allowed 'General case' 0 CA--C 1.531 0.25 0 CA-C-O 122.442 1.115 . . . . 2.58 109.625 -177.141 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . 0.487 ' OE2' ' HE3' ' A' ' 91' ' ' LYS . 28.3 mm-40 -71.41 -34.23 70.16 Favored 'General case' 0 C--N 1.329 -0.305 0 C-N-CA 123.773 0.829 . . . . 2.43 109.889 -169.785 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . 0.43 ' HA2' ' CD1' ' A' ' 66' ' ' PHE . . . -69.84 38.8 0.4 Allowed Glycine 0 CA--C 1.528 0.889 0 C-N-CA 125.705 1.621 . . . . 0.4 113.894 168.162 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 34.3 t -153.37 37.82 0.48 Allowed 'General case' 0 N--CA 1.446 -0.656 0 O-C-N 121.133 -1.216 . . . . 2.42 108.191 159.371 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -141.18 -47.63 0.4 Allowed 'General case' 0 CA--C 1.518 -0.251 0 N-CA-C 112.384 0.513 . . . . 2.64 112.384 -169.203 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 37.7 mt -63.31 -36.76 84.77 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 120.808 0.337 . . . . 1.68 110.911 -176.361 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER 177.09 166.5 0.55 Allowed 'General case' 0 CA--C 1.529 0.172 0 C-N-CA 124.673 1.189 . . . . 1.64 108.289 -173.602 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 9.3 m -60.04 -35.07 74.31 Favored 'General case' 0 N--CA 1.454 -0.253 0 C-N-CA 123.212 0.605 . . . . 1.29 110.608 168.73 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -67.59 -10.75 54.83 Favored 'General case' 0 CA--C 1.533 0.324 0 C-N-CA 123.126 0.57 . . . . 2.13 111.716 175.359 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -93.05 -8.62 61.49 Favored Glycine 0 N--CA 1.445 -0.721 0 C-N-CA 124.887 1.232 . . . . 0.45 110.982 174.895 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 37.0 ttt180 -108.88 -11.58 14.99 Favored 'General case' 0 CA--C 1.528 0.118 0 CA-C-N 118.598 1.199 . . . . 3.41 111.88 177.725 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 31.9 p -65.33 -156.1 0.01 OUTLIER 'General case' 0 CA--C 1.541 0.611 0 N-CA-C 109.361 -0.607 . . . . 1.86 109.361 170.098 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 1.3 m-20 -52.82 145.84 11.7 Favored 'General case' 0 CA--C 1.53 0.188 0 O-C-N 120.119 -1.613 . . . . 1.91 110.312 -178.01 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 31.4 tt0 -60.97 -27.91 68.61 Favored 'General case' 0 CA--C 1.537 0.461 0 CA-C-O 122.118 0.961 . . . . 3.17 111.083 -177.595 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -58.62 -41.45 85.93 Favored 'General case' 0 N--CA 1.452 -0.351 0 C-N-CA 124.848 1.259 . . . . 1.58 112.447 170.626 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 6.0 mt-10 -71.73 -42.03 67.8 Favored 'General case' 0 C--O 1.219 -0.534 0 CA-C-O 118.163 -0.922 . . . . 1.79 110.323 176.405 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 66' ' ' PHE . . . . . 0.43 ' CD1' ' HA2' ' A' ' 52' ' ' GLY . 52.7 t80 -50.33 -52.92 32.65 Favored 'General case' 0 N--CA 1.456 -0.143 0 C-N-CA 123.377 0.671 . . . . 0.44 111.077 175.488 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 52.2 t80 -59.64 -42.98 93.98 Favored 'General case' 0 CA--C 1.539 0.555 0 O-C-N 121.712 -0.617 . . . . 0.66 110.53 177.003 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -64.1 -54.28 36.48 Favored 'General case' 0 CA--C 1.538 0.505 0 O-C-N 121.278 -0.889 . . . . 1.64 113.054 -175.124 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 1.4 pp20? -61.56 -37.48 83.98 Favored 'General case' 0 C--N 1.332 -0.195 0 O-C-N 120.97 -1.081 . . . . 3.9 110.174 175.523 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -58.73 -36.27 74.03 Favored 'General case' 0 N--CA 1.451 -0.409 0 CA-C-N 118.377 0.535 . . . . 1.77 110.938 173.761 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 41.6 t80 -63.68 -51.04 66.84 Favored 'General case' 0 CA--C 1.531 0.221 0 CA-C-N 119.758 1.163 . . . . 4.7 111.359 171.627 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 6.2 ttp180 -45.15 -54.14 7.22 Favored 'General case' 0 N--CA 1.468 0.426 0 C-N-CA 123.244 0.618 . . . . 2.89 109.463 177.311 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -67.25 -55.26 14.72 Favored 'General case' 0 C--N 1.329 -0.325 0 C-N-CA 126.615 1.966 . . . . 1.56 110.793 -174.24 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -56.82 -31.73 65.03 Favored 'General case' 0 N--CA 1.464 0.268 0 CA-C-N 119.576 1.08 . . . . 3.98 111.416 -177.622 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -90.72 -19.92 23.02 Favored 'General case' 0 N--CA 1.454 -0.233 0 CA-C-O 117.342 -1.313 . . . . 1.16 111.748 179.284 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 3.1 m -47.01 115.94 1.22 Allowed 'General case' 0 CA--C 1.507 -0.705 0 CA-C-N 119.953 1.251 . . . . 2.26 108.031 -174.815 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -46.12 -39.45 9.49 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 114.793 -1.094 . . . . 3.22 110.306 -179.533 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 18.0 t0 -57.3 104.78 0.18 Allowed 'General case' 0 N--CA 1.452 -0.337 0 CA-C-O 122.7 1.238 . . . . 2.04 111.556 168.562 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 1.9 p80 -46.73 -38.25 9.66 Favored 'General case' 0 N--CA 1.45 -0.428 0 CA-C-N 114.664 -1.153 . . . . 6.54 112.612 171.539 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -61.2 -58.76 6.98 Favored 'General case' 0 N--CA 1.45 -0.454 0 CA-C-N 119.276 0.944 . . . . 2.34 109.245 -176.346 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -48.27 -39.9 23.06 Favored 'General case' 0 N--CA 1.453 -0.275 0 C-N-CA 123.595 0.758 . . . . 3.68 112.101 179.125 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 12.8 mtt180 -64.23 -53.93 41.49 Favored 'General case' 0 C--N 1.328 -0.362 0 C-N-CA 120.441 -0.504 . . . . 4.19 110.904 178.6 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 1.1 mm? -62.06 -23.26 66.37 Favored 'General case' 0 N--CA 1.449 -0.486 0 CA-C-O 117.883 -1.056 . . . . 2.02 111.57 177.654 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 1.7 mptm? -64.57 -42.46 95.62 Favored 'General case' 0 C--O 1.224 -0.281 0 CA-C-N 120.857 1.662 . . . . 2.48 108.283 171.867 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 69.6 t -61.99 -63.45 0.81 Allowed 'Isoleucine or valine' 0 C--O 1.218 -0.557 0 CA-C-O 118.13 -0.938 . . . . 1.59 110.107 172.928 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -48.96 -47.47 43.89 Favored 'General case' 0 CA--C 1.536 0.412 0 CA-C-N 120.328 1.422 . . . . 2.85 111.704 -173.619 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 32.7 tttm -63.0 -50.53 70.39 Favored 'General case' 0 N--CA 1.452 -0.353 0 C-N-CA 124.449 1.1 . . . . 2.95 111.784 179.102 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 25.3 m-20 -86.78 5.16 37.86 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 119.038 -0.506 . . . . 1.43 110.997 -175.006 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -162.28 69.36 2.16 Favored Pre-proline 0 N--CA 1.447 -0.575 0 C-N-CA 125.54 1.536 . . . . 1.73 109.277 -176.112 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 90.3 Cg_endo -79.45 59.86 7.57 Favored 'Trans proline' 0 N--CA 1.458 -0.566 0 C-N-CA 124.214 3.276 . . . . 1.96 110.801 -173.659 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 91' ' ' LYS . . . . . 0.487 ' HE3' ' OE2' ' A' ' 51' ' ' GLU . 0.0 OUTLIER 175.89 -48.4 0.01 OUTLIER 'General case' 0 CA--C 1.531 0.232 0 C-N-CA 127.046 2.139 . . . . 3.24 109.713 -172.574 . . . . . . . . 3 3 . 1 . 029 nuclear orig full ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 8.6 m -57.74 -43.55 85.46 Favored 'General case' 0 CA--C 1.516 -0.333 0 O-C-N 121.101 -0.999 . . . . 1.54 111.445 179.991 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 3.7 t80 -54.28 -48.43 71.24 Favored 'General case' 0 CA--C 1.515 -0.402 0 C-N-CA 120.114 -0.635 . . . . 3.7 110.021 176.251 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 30.0 tt0 -60.82 -29.72 69.65 Favored 'General case' 0 N--CA 1.441 -0.888 0 CA-C-N 115.025 -0.989 . . . . 2.03 111.118 -179.799 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -63.41 -61.97 1.99 Allowed 'General case' 0 N--CA 1.463 0.205 0 C-N-CA 124.427 1.091 . . . . 2.1 108.919 -177.223 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 3.8 mp -53.35 -45.06 56.17 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.323 0 N-CA-C 108.48 -0.933 . . . . 2.07 108.48 177.246 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -57.69 -35.35 70.48 Favored 'General case' 0 C--O 1.225 -0.197 0 N-CA-C 112.352 0.501 . . . . 2.27 112.352 -179.655 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 98' ' ' ASP . . . . . 0.422 ' OD2' ' NZ ' ' A' ' 42' ' ' LYS . 0.4 OUTLIER -64.67 -42.66 95.22 Favored 'General case' 0 C--N 1.334 -0.1 0 C-N-CA 124.845 1.258 . . . . 2.35 109.203 178.636 . . . . . . . . 3 3 . 1 . 029 nuclear orig full ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 26.5 mm100 -79.76 69.16 6.03 Favored 'General case' 0 CA--C 1.532 0.26 0 C-N-CA 123.532 0.733 . . . . 3.55 110.479 179.892 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 68.7 mt -63.41 -70.1 0.18 Allowed 'Isoleucine or valine' 0 CA--C 1.531 0.215 0 C-N-CA 124.269 1.028 . . . . 6.52 109.264 178.784 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 4.7 tttm 51.25 -161.15 0.08 Allowed 'General case' 0 CA--C 1.539 0.529 0 C-N-CA 124.019 0.927 . . . . 12.42 110.911 -172.178 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 102' ' ' PHE . . . . . . . . . . . . . 0.8 OUTLIER -157.36 121.17 4.18 Favored 'General case' 0 N--CA 1.453 -0.316 0 N-CA-C 104.438 -2.43 . . . . 6.91 104.438 161.337 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 7.9 tp -151.97 128.3 1.91 Allowed 'Isoleucine or valine' 0 N--CA 1.448 -0.54 0 N-CA-C 108.69 -0.856 . . . . 4.73 108.69 173.932 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 104' ' ' ILE . . . . . . . . . . . . . 6.9 mt 65.02 133.61 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.537 0.452 0 C-N-CA 125.761 1.624 . . . . 8.3 109.087 -172.347 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 13.2 t-20 -125.64 161.77 26.51 Favored 'General case' 0 C--O 1.234 0.256 0 O-C-N 120.954 -1.091 . . . . 8.4 108.197 -178.151 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 20.0 m . . . . . 0 C--O 1.247 0.965 0 CA-C-O 116.207 -1.854 . . . . 9.81 109.57 166.99 . . . . . . . . 0 0 . 1 . 030 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.469 0.847 0 N-CA-C 110.159 -1.177 . . . . 10.97 110.159 . . . . . . . . . 0 0 . 1 . 030 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 73.6 m -85.73 -67.59 0.79 Allowed 'General case' 0 C--O 1.226 -0.162 0 CA-C-N 118.477 1.139 . . . . 13.07 111.602 -179.956 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 9.6 ptpt -158.14 140.06 13.98 Favored 'General case' 0 N--CA 1.455 -0.195 0 N-CA-C 107.889 -1.152 . . . . 16.63 107.889 -176.367 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 157.29 -178.18 33.77 Favored Glycine 0 N--CA 1.451 -0.308 0 N-CA-C 109.258 -1.537 . . . . 12.81 109.258 -179.729 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 35.6 m -91.75 -164.3 0.1 Allowed 'Isoleucine or valine' 0 N--CA 1.442 -0.846 0 N-CA-C 107.146 -1.427 . . . . 14.1 107.146 156.343 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 5.3 pt-20 -83.05 124.59 30.59 Favored 'General case' 0 N--CA 1.443 -0.792 0 CA-C-O 121.71 0.767 . . . . 9.67 111.475 176.994 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 3.1 mt -125.79 25.67 6.83 Favored 'General case' 0 N--CA 1.454 -0.264 0 C-N-CA 123.725 0.81 . . . . 9.6 109.545 -175.331 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 22.4 mtp180 65.92 -69.33 0.11 Allowed 'General case' 0 C--O 1.227 -0.09 0 C-N-CA 124.981 1.312 . . . . 7.63 110.269 -161.53 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 2.3 m120 -49.78 -38.87 36.05 Favored 'General case' 0 CA--C 1.512 -0.494 0 C-N-CA 123.78 0.832 . . . . 2.72 112.53 177.218 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 7.7 t70 -70.39 -35.49 73.51 Favored 'General case' 0 N--CA 1.455 -0.217 0 C-N-CA 117.387 -1.725 . . . . 4.22 111.397 -177.14 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 18.5 m -67.79 -56.4 9.36 Favored 'General case' 0 C--O 1.231 0.127 0 C-N-CA 125.031 1.333 . . . . 2.02 111.073 178.009 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 35.8 mt-10 -68.61 -26.0 65.14 Favored 'General case' 0 CA--C 1.532 0.274 0 CA-C-O 121.289 0.566 . . . . 3.83 110.331 -178.799 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -61.62 -53.56 42.75 Favored Glycine 0 C--O 1.218 -0.862 0 N-CA-C 109.89 -1.284 . . . . 0.65 109.89 163.308 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 11.2 t80 -50.98 -49.56 59.96 Favored 'General case' 0 CA--C 1.519 -0.236 0 O-C-N 120.814 -1.403 . . . . 3.95 110.677 -169.996 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 0.6 OUTLIER -69.46 -32.85 54.63 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.328 0 CA-C-O 118.809 -0.615 . . . . 1.77 112.571 178.894 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 9.3 t60 -59.94 -58.51 8.23 Favored 'General case' 0 CA--C 1.53 0.21 0 N-CA-C 107.227 -1.397 . . . . 0.95 107.227 175.775 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 1.5 mp0 -51.37 -44.55 62.16 Favored 'General case' 0 C--O 1.226 -0.135 0 C-N-CA 124.154 0.982 . . . . 4.04 110.634 176.697 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -54.2 -52.17 62.09 Favored 'General case' 0 CA--C 1.517 -0.322 0 C-N-CA 123.582 0.753 . . . . 4.04 109.505 179.884 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -45.97 -49.05 13.88 Favored Glycine 0 CA--C 1.524 0.646 0 N-CA-C 110.808 -0.917 . . . . 0.49 110.808 174.435 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 2.1 t-160 -59.16 -47.06 86.68 Favored 'General case' 0 N--CA 1.452 -0.346 0 O-C-N 122.015 -0.697 . . . . 2.58 111.393 179.209 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -61.03 -32.66 72.27 Favored 'General case' 0 N--CA 1.453 -0.294 0 O-C-N 121.635 -0.666 . . . . 1.88 110.47 178.438 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 40.4 t -67.63 -35.28 72.39 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.267 0 O-C-N 121.235 -0.915 . . . . 2.05 110.393 178.271 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 8.0 t0 -59.3 -29.59 67.72 Favored 'General case' 0 N--CA 1.451 -0.391 0 CA-C-O 121.506 0.669 . . . . 1.9 110.983 176.611 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 26.8 t0 -73.87 -47.21 39.74 Favored 'General case' 0 N--CA 1.454 -0.254 0 N-CA-C 108.927 -0.768 . . . . 2.49 108.927 -176.411 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 33.6 t80 -49.97 -48.76 51.97 Favored 'General case' 0 CA--C 1.521 -0.141 0 CA-C-N 115.855 -0.612 . . . . 4.11 109.429 170.788 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -58.98 -37.22 76.31 Favored 'General case' 0 N--CA 1.443 -0.789 0 CA-C-O 118.492 -0.766 . . . . 1.84 112.31 -179.264 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -77.11 -18.84 78.06 Favored Glycine 0 CA--C 1.526 0.766 0 CA-C-N 118.944 0.793 . . . . 1.11 112.209 -178.189 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 1.1 t80 -81.95 -49.93 9.73 Favored 'General case' 0 N--CA 1.452 -0.354 0 O-C-N 121.783 -0.834 . . . . 3.01 109.474 175.246 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -72.27 -43.9 63.62 Favored 'General case' 0 CA--C 1.514 -0.436 0 C-N-CA 124.503 1.121 . . . . 3.03 112.145 -175.83 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 5.7 mt -109.76 143.94 38.88 Favored 'General case' 0 N--CA 1.441 -0.886 0 N-CA-C 104.319 -2.474 . . . . 3.2 104.319 -176.965 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 30.1 m-20 71.96 -64.49 0.39 Allowed 'General case' 0 CA--C 1.535 0.39 0 C-N-CA 124.283 1.033 . . . . 5.56 110.845 -179.015 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 2.6 tmmm? 73.87 62.64 0.08 Allowed 'General case' 0 CA--C 1.518 -0.288 0 C-N-CA 126.702 2.001 . . . . 10.33 108.962 175.127 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 57.2 t30 -154.61 157.79 38.73 Favored 'General case' 0 N--CA 1.45 -0.466 0 CA-C-N 116.06 -0.518 . . . . 6.27 109.95 175.263 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 4.0 tt0 -81.02 15.45 1.85 Allowed 'General case' 0 CA--C 1.536 0.439 0 N-CA-C 112.796 0.665 . . . . 11.09 112.796 -172.744 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 64.1 p -143.96 23.88 1.69 Allowed 'General case' 0 C--O 1.23 0.061 0 CA-C-N 119.058 0.845 . . . . 5.56 111.703 178.843 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 2.7 m-20 -138.47 125.29 21.04 Favored 'General case' 0 N--CA 1.453 -0.284 0 N-CA-C 105.241 -2.133 . . . . 8.77 105.241 -170.194 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 4.7 mp -147.2 167.3 24.55 Favored 'General case' 0 CA--C 1.534 0.356 0 N-CA-C 107.968 -1.123 . . . . 4.73 107.968 -167.617 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 4.3 p -94.69 42.85 0.09 OUTLIER 'Isoleucine or valine' 0 N--CA 1.467 0.406 0 O-C-N 120.41 -1.431 . . . . 4.65 110.496 -172.986 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 1.3 t -116.05 -47.03 2.79 Favored 'General case' 0 N--CA 1.45 -0.446 0 C-N-CA 124.621 1.168 . . . . 5.1 108.424 174.338 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 22.6 p-10 -111.11 83.46 1.77 Allowed 'General case' 0 N--CA 1.441 -0.897 0 N-CA-C 107.582 -1.266 . . . . 6.38 107.582 -163.283 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 31.0 t -97.55 -174.2 2.85 Favored 'General case' 0 CA--C 1.533 0.323 0 N-CA-C 109.425 -0.583 . . . . 5.33 109.425 177.713 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 24.47 95.42 0.0 OUTLIER 'General case' 0 N--CA 1.469 0.524 0 C-N-CA 128.981 2.913 . . . . 7.94 113.777 -178.022 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 29.4 tptt 70.09 10.83 7.51 Favored 'General case' 0 N--CA 1.463 0.218 0 C-N-CA 125.199 1.4 . . . . 14.43 111.479 -173.205 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 74.4 m-85 55.58 28.18 11.52 Favored 'General case' 0 N--CA 1.451 -0.402 0 C-N-CA 125.315 1.446 . . . . 8.09 112.049 -177.375 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 45' ' ' ILE . . . . . 0.425 ' CG1' ' HE3' ' A' ' 49' ' ' LYS . 2.1 tt -172.52 108.61 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.537 0.469 0 N-CA-C 108.758 -0.831 . . . . 4.11 108.758 -177.38 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 16.2 t70 -159.85 -69.34 0.08 Allowed 'General case' 0 N--CA 1.468 0.456 0 O-C-N 121.088 -1.008 . . . . 2.2 109.112 176.072 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 2.8 mm -54.69 -49.46 67.86 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.449 0 C-N-CA 125.338 1.455 . . . . 1.63 108.548 178.304 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 38.4 t80 -59.85 -26.35 65.76 Favored 'General case' 0 N--CA 1.453 -0.319 0 O-C-N 120.596 -1.315 . . . . 0.94 113.462 177.683 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . 0.561 ' HA ' ' HE2' ' A' ' 49' ' ' LYS . 9.0 mmpt? -70.04 -48.0 59.72 Favored 'General case' 0 CA--C 1.516 -0.339 0 O-C-N 120.095 -1.628 . . . . 2.58 110.859 -179.482 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 4.4 tp10 -87.51 -56.64 3.27 Favored 'General case' 0 CA--C 1.533 0.314 0 N-CA-C 109.039 -0.726 . . . . 2.27 109.039 -173.622 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . 0.473 ' OE1' ' HE3' ' A' ' 91' ' ' LYS . 19.0 mp0 -76.81 -31.87 57.25 Favored 'General case' 0 C--O 1.235 0.321 0 O-C-N 121.024 -1.048 . . . . 2.8 111.452 -175.952 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . 0.415 ' HA2' ' CD1' ' A' ' 66' ' ' PHE . . . -70.04 38.76 0.42 Allowed Glycine 0 CA--C 1.532 1.124 0 C-N-CA 124.997 1.284 . . . . 0.39 114.343 171.595 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 39.2 t -154.21 49.37 0.63 Allowed 'General case' 0 N--CA 1.448 -0.537 0 N-CA-C 107.234 -1.395 . . . . 2.77 107.234 153.692 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -145.34 -49.7 0.24 Allowed 'General case' 0 CA--C 1.516 -0.339 0 N-CA-C 112.644 0.609 . . . . 2.99 112.644 -177.306 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 17.5 mt -60.46 -35.54 76.12 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-O 120.891 0.377 . . . . 1.63 111.047 -172.962 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER 178.28 169.58 0.78 Allowed 'General case' 0 CA--C 1.53 0.209 0 C-N-CA 125.752 1.621 . . . . 1.51 107.487 -179.307 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 26.4 m -59.16 -33.36 70.82 Favored 'General case' 0 N--CA 1.454 -0.233 0 O-C-N 121.673 -0.642 . . . . 1.36 110.633 169.93 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -59.58 -34.19 72.4 Favored 'General case' 0 C--N 1.34 0.189 0 CA-C-N 118.31 0.505 . . . . 2.1 109.992 173.114 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -67.95 -9.91 57.67 Favored Glycine 0 C--O 1.22 -0.741 0 CA-C-O 119.074 -0.848 . . . . 0.42 111.836 178.184 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 41.3 ttt180 -107.77 -8.92 15.9 Favored 'General case' 0 N--CA 1.454 -0.237 0 CA-C-N 119.082 1.441 . . . . 4.35 112.582 178.084 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 68.7 p -69.45 -126.34 0.0 OUTLIER 'General case' 0 CA--C 1.537 0.461 0 CA-C-N 118.404 0.547 . . . . 2.0 111.196 179.456 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 4.2 t-20 -75.13 148.65 39.49 Favored 'General case' 0 N--CA 1.45 -0.43 0 O-C-N 120.081 -1.637 . . . . 1.87 107.497 176.156 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 30.7 tt0 -60.61 -31.98 71.12 Favored 'General case' 0 CA--C 1.538 0.5 0 CA-C-O 121.828 0.823 . . . . 3.26 110.37 179.425 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -61.36 -34.45 75.32 Favored 'General case' 0 CA--C 1.53 0.192 0 O-C-N 121.172 -0.955 . . . . 1.87 113.105 173.542 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 4.6 mt-10 -77.55 -39.27 46.48 Favored 'General case' 0 C--O 1.222 -0.378 0 O-C-N 121.016 -1.053 . . . . 2.07 110.137 179.246 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 66' ' ' PHE . . . . . 0.415 ' CD1' ' HA2' ' A' ' 52' ' ' GLY . 43.7 t80 -50.34 -45.66 55.16 Favored 'General case' 0 CA--C 1.532 0.253 0 C-N-CA 124.775 1.23 . . . . 0.46 110.959 170.434 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 72.1 t80 -65.86 -43.96 86.85 Favored 'General case' 0 CA--C 1.533 0.309 0 O-C-N 120.994 -1.067 . . . . 0.56 111.758 175.311 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -62.96 -53.98 45.63 Favored 'General case' 0 CA--C 1.537 0.449 0 O-C-N 121.381 -0.824 . . . . 1.6 112.002 -174.369 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -55.94 -40.97 73.94 Favored 'General case' 0 C--N 1.332 -0.182 0 O-C-N 120.92 -1.112 . . . . 3.89 111.299 169.868 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -55.99 -40.17 72.93 Favored 'General case' 0 C--O 1.223 -0.297 0 CA-C-N 119.122 0.874 . . . . 1.67 110.844 177.471 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 56.9 t80 -58.06 -49.93 75.19 Favored 'General case' 0 C--O 1.233 0.224 0 CA-C-N 119.683 1.129 . . . . 4.93 111.504 174.316 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 48.3 ttt180 -49.56 -53.8 21.66 Favored 'General case' 0 N--CA 1.467 0.377 0 N-CA-C 109.322 -0.621 . . . . 2.83 109.322 177.605 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -65.38 -34.24 77.84 Favored 'General case' 0 C--N 1.327 -0.392 0 C-N-CA 124.187 0.995 . . . . 1.53 110.289 -175.851 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER -60.04 -42.37 94.3 Favored 'General case' 0 C--N 1.333 -0.139 0 C-N-CA 123.77 0.828 . . . . 3.16 110.939 -176.341 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 9.3 p80 -95.13 -4.99 45.14 Favored 'General case' 0 N--CA 1.457 -0.113 0 CA-C-O 116.964 -1.493 . . . . 1.09 113.365 -178.306 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 12.4 m -40.92 126.29 2.48 Favored 'General case' 0 N--CA 1.452 -0.34 0 CA-C-O 123.222 1.487 . . . . 2.16 110.806 -168.349 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 1.1 p -52.82 -42.19 64.89 Favored 'General case' 0 N--CA 1.447 -0.584 0 CA-C-N 112.642 -2.072 . . . . 1.76 108.8 179.481 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 62.3 t0 -72.55 111.68 7.94 Favored 'General case' 0 N--CA 1.451 -0.414 0 CA-C-O 122.089 0.947 . . . . 2.07 108.673 168.885 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 4.2 t-160 -54.3 -33.05 57.91 Favored 'General case' 0 CA--C 1.532 0.268 0 CA-C-N 115.738 -0.665 . . . . 7.01 109.802 176.899 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -56.87 -52.19 66.1 Favored 'General case' 0 N--CA 1.451 -0.4 0 CA-C-N 117.904 0.32 . . . . 1.9 110.708 176.672 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 5.2 mt-10 -52.12 -39.57 60.06 Favored 'General case' 0 CA--C 1.514 -0.428 0 C-N-CA 123.365 0.666 . . . . 2.86 110.966 -177.59 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 2.4 mtp180 -61.92 -53.54 54.36 Favored 'General case' 0 N--CA 1.448 -0.546 0 C-N-CA 119.971 -0.692 . . . . 3.62 109.738 176.864 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 1.3 mm? -61.01 -24.53 66.23 Favored 'General case' 0 N--CA 1.453 -0.294 0 CA-C-O 117.421 -1.276 . . . . 1.88 112.936 177.655 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 2.0 mptm? -63.73 -43.11 97.5 Favored 'General case' 0 CA--C 1.522 -0.131 0 CA-C-N 121.499 1.954 . . . . 2.11 107.981 173.882 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 99.7 t -64.13 -63.3 0.89 Allowed 'Isoleucine or valine' 0 C--O 1.214 -0.808 0 CA-C-O 118.437 -0.792 . . . . 1.72 110.009 173.233 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -49.44 -38.57 29.88 Favored 'General case' 0 CA--C 1.532 0.256 0 CA-C-N 120.325 1.42 . . . . 2.89 112.277 -172.492 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 22.7 tttt -64.52 -58.98 4.88 Favored 'General case' 0 N--CA 1.45 -0.439 0 C-N-CA 124.81 1.244 . . . . 2.82 110.833 174.025 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 61.6 m-20 -80.48 2.37 25.54 Favored 'General case' 0 CA--C 1.535 0.373 0 C-N-CA 123.505 0.722 . . . . 1.45 111.815 -173.733 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -156.66 73.63 4.74 Favored Pre-proline 0 N--CA 1.446 -0.639 0 C-N-CA 126.802 2.041 . . . . 1.61 108.012 -175.387 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 62.1 Cg_endo -80.69 60.81 8.01 Favored 'Trans proline' 0 N--CA 1.454 -0.824 0 C-N-CA 124.057 3.171 . . . . 1.96 109.351 -179.837 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 91' ' ' LYS . . . . . 0.473 ' HE3' ' OE1' ' A' ' 51' ' ' GLU . 0.0 OUTLIER 171.28 -56.81 0.01 OUTLIER 'General case' 0 C--O 1.224 -0.269 0 C-N-CA 126.411 1.884 . . . . 3.32 110.466 -170.345 . . . . . . . . 3 3 . 1 . 030 nuclear orig full ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 1.4 m -53.69 -46.01 70.56 Favored 'General case' 0 N--CA 1.466 0.373 0 CA-C-N 119.95 1.25 . . . . 1.68 110.75 -179.534 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 8.6 t80 -61.21 -46.34 90.87 Favored 'General case' 0 CA--C 1.509 -0.599 0 CA-C-O 121.653 0.74 . . . . 3.96 110.187 178.852 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 8.1 tt0 -58.53 -30.95 67.48 Favored 'General case' 0 N--CA 1.441 -0.902 0 CA-C-N 114.482 -1.236 . . . . 1.93 110.126 -178.538 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -63.99 -68.74 0.32 Allowed 'General case' 0 N--CA 1.452 -0.349 0 C-N-CA 124.634 1.174 . . . . 1.44 108.753 -177.666 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 3.8 mp -49.86 -43.38 19.59 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.217 0 C-N-CA 123.457 0.703 . . . . 1.89 109.743 176.653 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 13.0 t30 -61.03 -35.42 76.83 Favored 'General case' 0 CA--C 1.531 0.241 0 O-C-N 121.961 -0.462 . . . . 2.04 111.94 -177.418 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 23.1 t70 -60.41 -44.57 95.6 Favored 'General case' 0 CA--C 1.516 -0.362 0 C-N-CA 123.499 0.719 . . . . 2.12 109.624 173.777 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 2.3 mp0 -81.35 77.99 8.17 Favored 'General case' 0 N--CA 1.444 -0.772 0 CA-C-O 121.622 0.725 . . . . 4.82 109.153 179.013 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 9.8 tp -47.86 133.72 4.94 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.339 0 C-N-CA 124.746 1.219 . . . . 4.82 109.753 179.869 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 1.4 tmtp? -64.08 96.56 0.15 Allowed 'General case' 0 N--CA 1.462 0.142 0 N-CA-C 109.219 -0.66 . . . . 12.26 109.219 -173.22 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 102' ' ' PHE . . . . . . . . . . . . . 1.0 OUTLIER -103.11 -29.24 11.46 Favored 'General case' 0 CA--C 1.529 0.168 0 C-N-CA 123.934 0.893 . . . . 7.99 111.028 -175.414 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -64.77 140.54 19.55 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.424 0 C-N-CA 123.512 0.725 . . . . 5.03 109.496 -179.34 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 104' ' ' ILE . . . . . . . . . . . . . 48.8 mt -103.22 -85.47 0.18 Allowed 'Isoleucine or valine' 0 CA--C 1.534 0.351 0 N-CA-C 107.798 -1.186 . . . . 6.53 107.798 -176.384 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 10.2 t30 72.25 101.88 0.07 Allowed 'General case' 0 N--CA 1.464 0.226 0 C-N-CA 127.236 2.215 . . . . 11.06 111.57 -177.329 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 15.0 p . . . . . 0 C--O 1.246 0.909 0 N-CA-C 107.139 -1.43 . . . . 9.56 107.139 -175.575 . . . . . . . . 0 0 . 1 . 031 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . 0.47 ' CA ' ' OE2' ' A' ' 65' ' ' GLU . . . . . . . . 0 N--CA 1.467 0.735 0 N-CA-C 110.227 -1.149 . . . . 15.71 110.227 . . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 22.5 m -153.37 -36.51 0.1 Allowed 'General case' 0 C--N 1.332 -0.172 0 CA-C-N 117.281 0.541 . . . . 17.87 111.742 -177.748 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -137.69 168.09 20.37 Favored 'General case' 0 N--CA 1.45 -0.45 0 N-CA-C 107.373 -1.343 . . . . 19.44 107.373 173.18 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 164.05 -173.37 40.07 Favored Glycine 0 N--CA 1.452 -0.282 0 N-CA-C 109.652 -1.379 . . . . 18.15 109.652 179.803 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 3.1 m -79.09 -166.11 0.08 OUTLIER 'Isoleucine or valine' 0 N--CA 1.45 -0.442 0 N-CA-C 108.426 -0.953 . . . . 19.21 108.426 164.893 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 10.6 pt-20 -111.47 101.16 9.61 Favored 'General case' 0 N--CA 1.453 -0.314 0 CA-C-O 122.434 1.112 . . . . 13.67 111.068 -173.624 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -115.01 54.6 0.78 Allowed 'General case' 0 N--CA 1.448 -0.561 0 N-CA-C 106.543 -1.651 . . . . 13.22 106.543 -179.145 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 25.5 mtp85 51.93 56.61 7.54 Favored 'General case' 0 C--O 1.224 -0.244 0 CA-C-N 114.969 -1.014 . . . . 7.31 111.391 -175.667 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 2.4 m120 -51.97 -31.25 28.33 Favored 'General case' 0 C--O 1.224 -0.275 0 O-C-N 120.805 -1.184 . . . . 6.59 112.564 177.207 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -66.56 -49.13 67.46 Favored 'General case' 0 N--CA 1.446 -0.673 0 O-C-N 121.289 -0.882 . . . . 3.19 112.783 178.446 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 43.9 m -84.34 -52.98 5.78 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-O 122.157 0.979 . . . . 2.6 108.888 -172.581 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 1.1 mp0 -89.64 -26.33 20.81 Favored 'General case' 0 C--N 1.325 -0.457 0 C-N-CA 124.255 1.022 . . . . 3.75 109.937 -173.881 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -78.96 -37.02 26.68 Favored Glycine 0 C--O 1.221 -0.668 0 N-CA-C 109.615 -1.394 . . . . 0.93 109.615 178.671 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 49.7 t80 -52.33 -61.04 2.53 Favored 'General case' 0 N--CA 1.463 0.204 0 CA-C-N 119.462 1.631 . . . . 5.49 110.685 172.723 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 1.2 pt -63.05 -33.18 59.27 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.449 0 O-C-N 121.151 -0.968 . . . . 1.71 112.093 -178.488 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 2.6 t-160 -58.49 -49.27 77.98 Favored 'General case' 0 CA--C 1.532 0.268 0 N-CA-C 107.69 -1.226 . . . . 1.2 107.69 174.903 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 40.1 mt-10 -61.01 -36.56 79.82 Favored 'General case' 0 C--O 1.218 -0.554 0 C-N-CA 124.168 0.987 . . . . 2.73 109.752 -178.195 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 4.1 t80 -55.04 -50.23 69.61 Favored 'General case' 0 CA--C 1.522 -0.099 0 CA-C-N 119.354 0.979 . . . . 5.3 110.284 171.827 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -48.35 -50.23 23.98 Favored Glycine 0 CA--C 1.524 0.615 0 N-CA-C 111.454 -0.658 . . . . 0.64 111.454 172.768 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 2.0 t-160 -63.89 -44.93 91.51 Favored 'General case' 0 N--CA 1.45 -0.443 0 O-C-N 121.846 -0.796 . . . . 2.76 111.408 -177.533 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -55.86 -34.1 65.14 Favored 'General case' 0 N--CA 1.448 -0.536 0 C-N-CA 123.575 0.75 . . . . 2.07 109.125 -178.318 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 98.5 t -68.37 -42.37 84.13 Favored 'Isoleucine or valine' 0 N--CA 1.457 -0.101 0 C-N-CA 119.782 -0.767 . . . . 2.15 111.986 174.474 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 3.7 t70 -59.0 -29.6 67.36 Favored 'General case' 0 N--CA 1.465 0.312 0 CA-C-O 122.284 1.04 . . . . 2.34 111.428 173.262 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -76.26 -47.41 23.91 Favored 'General case' 0 N--CA 1.446 -0.649 0 N-CA-C 107.883 -1.154 . . . . 4.14 107.883 -173.626 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 60.2 t80 -63.48 -56.59 14.93 Favored 'General case' 0 N--CA 1.451 -0.382 0 C-N-CA 123.047 0.539 . . . . 3.74 110.353 179.839 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -55.58 -33.89 64.31 Favored 'General case' 0 N--CA 1.453 -0.304 0 CA-C-O 118.928 -0.558 . . . . 2.01 110.882 179.645 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -63.51 -56.13 21.38 Favored Glycine 0 C--O 1.225 -0.425 0 N-CA-C 110.503 -1.039 . . . . 1.09 110.503 174.515 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -52.04 -42.82 63.41 Favored 'General case' 0 N--CA 1.455 -0.225 0 C-N-CA 124.472 1.109 . . . . 2.53 111.252 -174.54 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -79.62 -33.06 41.78 Favored 'General case' 0 N--CA 1.446 -0.645 0 C-N-CA 124.21 1.004 . . . . 2.34 112.556 -179.097 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 5.3 mt -122.36 55.14 1.16 Allowed 'General case' 0 CA--C 1.53 0.203 0 CA-C-N 118.873 0.76 . . . . 2.63 109.263 -167.114 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 14.2 t70 -139.74 162.28 35.51 Favored 'General case' 0 CA--C 1.531 0.221 0 C-N-CA 124.712 1.205 . . . . 5.77 108.307 178.074 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . 0.518 ' HE3' ' O ' ' A' ' 32' ' ' LYS . 0.0 OUTLIER -133.37 45.78 2.66 Favored 'General case' 0 N--CA 1.454 -0.275 0 N-CA-C 107.871 -1.159 . . . . 9.46 107.871 176.979 . . . . . . . . 3 3 . 1 . 031 nuclear orig full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 3.5 t-20 -146.82 -166.23 2.44 Favored 'General case' 0 CA--C 1.537 0.458 0 C-N-CA 124.961 1.304 . . . . 6.55 107.979 -177.854 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 18.8 mm-40 -132.02 22.76 4.53 Favored 'General case' 0 CA--C 1.534 0.33 0 C-N-CA 125.827 1.651 . . . . 12.01 107.913 167.75 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 1.2 t -159.88 51.0 0.32 Allowed 'General case' 0 N--CA 1.453 -0.307 0 O-C-N 121.231 -0.918 . . . . 7.84 109.79 -179.361 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 5.6 t0 -153.2 164.39 38.16 Favored 'General case' 0 CA--C 1.531 0.231 0 N-CA-C 108.906 -0.775 . . . . 7.41 108.906 172.517 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 7.1 mp -133.45 176.86 8.16 Favored 'General case' 0 CA--C 1.531 0.242 0 C-N-CA 125.122 1.369 . . . . 3.66 107.945 179.152 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 6.0 p -64.62 -43.3 96.71 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.262 0 C-N-CA 119.244 -0.982 . . . . 3.11 109.319 178.795 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 26.2 p 50.05 -156.95 0.09 Allowed 'General case' 0 CA--C 1.536 0.431 0 CA-C-N 119.405 1.002 . . . . 4.1 110.828 -175.118 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 6.8 p-10 -68.22 -21.58 64.84 Favored 'General case' 0 CA--C 1.532 0.253 0 O-C-N 120.409 -1.432 . . . . 6.53 112.77 170.965 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 74.2 p 20.17 64.71 0.02 OUTLIER 'General case' 0 N--CA 1.469 0.49 0 C-N-CA 127.02 2.128 . . . . 4.22 114.237 -172.21 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -149.68 130.54 14.23 Favored 'General case' 0 CA--C 1.518 -0.267 0 N-CA-C 107.803 -1.184 . . . . 8.84 107.803 -177.331 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 4.1 tttt 27.17 61.84 0.09 Allowed 'General case' 0 N--CA 1.467 0.412 0 C-N-CA 128.141 2.576 . . . . 8.63 111.847 177.446 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 0.8 OUTLIER 40.14 72.17 0.16 Allowed 'General case' 0 CA--C 1.533 0.31 0 C-N-CA 125.103 1.361 . . . . 7.11 111.922 177.002 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . 0.264 28.0 pt 48.27 94.52 0.01 OUTLIER 'Isoleucine or valine' 0 C--O 1.222 -0.387 0 C-N-CA 126.402 1.881 . . . . 3.56 111.781 -173.435 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 45.9 t0 -120.74 -66.0 1.1 Allowed 'General case' 0 C--N 1.334 -0.105 0 C-N-CA 124.258 1.023 . . . . 2.48 108.817 -171.183 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 7.1 mm -50.2 -54.44 8.44 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.523 0 C-N-CA 125.32 1.448 . . . . 1.59 109.202 174.387 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 30.4 t80 -61.83 -26.5 68.16 Favored 'General case' 0 CA--C 1.531 0.245 0 O-C-N 120.927 -1.108 . . . . 0.44 113.232 179.578 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 49' ' ' LYS . . . . . 0.522 ' HA ' ' HE2' ' A' ' 49' ' ' LYS . 9.6 mmpt? -72.24 -45.01 62.01 Favored 'General case' 0 CA--C 1.516 -0.347 0 O-C-N 119.675 -1.891 . . . . 2.29 111.684 -175.513 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -86.72 -64.68 1.11 Allowed 'General case' 0 C--N 1.328 -0.349 0 N-CA-C 106.774 -1.565 . . . . 3.71 106.774 -177.701 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 15.0 mm-40 -65.09 -36.05 83.09 Favored 'General case' 0 N--CA 1.452 -0.367 0 CA-C-N 115.677 -0.692 . . . . 2.16 110.165 -170.925 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . 0.446 ' HA2' ' CD1' ' A' ' 66' ' ' PHE . . . -69.07 37.6 0.3 Allowed Glycine 0 CA--C 1.527 0.82 0 C-N-CA 125.582 1.563 . . . . 0.31 114.44 171.761 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 11.2 t -147.71 23.4 1.11 Allowed 'General case' 0 N--CA 1.451 -0.401 0 O-C-N 121.047 -1.267 . . . . 2.69 110.47 155.592 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 13.7 t30 -134.11 -23.13 1.75 Allowed 'General case' 0 C--N 1.342 0.28 0 N-CA-C 113.958 1.096 . . . . 2.73 113.958 -164.1 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 14.6 mt -76.91 -37.02 56.21 Favored 'General case' 0 C--O 1.226 -0.144 0 O-C-N 121.891 -0.505 . . . . 1.62 110.571 176.124 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER 178.2 169.91 0.76 Allowed 'General case' 0 CA--C 1.532 0.273 0 C-N-CA 125.795 1.638 . . . . 1.59 107.096 -175.796 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 7.2 m -60.11 -33.88 72.72 Favored 'General case' 0 N--CA 1.454 -0.266 0 O-C-N 121.708 -0.62 . . . . 1.88 110.721 168.596 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -67.77 -9.11 41.27 Favored 'General case' 0 N--CA 1.467 0.41 0 N-CA-C 112.328 0.492 . . . . 2.26 112.328 174.498 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -87.83 -3.91 79.67 Favored Glycine 0 C--O 1.221 -0.683 0 CA-C-O 118.472 -1.182 . . . . 0.57 111.09 173.366 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 3.6 ttp85 -118.0 -7.97 10.8 Favored 'General case' 0 CA--C 1.53 0.183 0 CA-C-N 119.292 1.546 . . . . 4.69 112.253 -177.155 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 25.4 p -67.39 -148.13 0.01 OUTLIER 'General case' 0 CA--C 1.537 0.477 0 C-N-CA 124.958 1.303 . . . . 1.96 109.079 172.165 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 3.7 m120 -56.7 143.77 35.12 Favored 'General case' 0 N--CA 1.455 -0.176 0 O-C-N 119.753 -1.842 . . . . 2.53 109.176 176.049 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 15.6 tm-20 -57.04 -32.86 66.62 Favored 'General case' 0 C--O 1.223 -0.338 0 CA-C-O 121.538 0.685 . . . . 3.58 110.078 178.086 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -56.62 -35.37 68.22 Favored 'General case' 0 N--CA 1.45 -0.466 0 O-C-N 121.357 -0.839 . . . . 1.93 112.676 176.332 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . 0.47 ' OE2' ' CA ' ' A' ' 1' ' ' GLY . 8.9 mt-10 -75.62 -42.18 52.38 Favored 'General case' 0 CA--C 1.512 -0.485 0 O-C-N 121.4 -0.812 . . . . 2.09 110.834 175.184 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' A' A ' 66' ' ' PHE . . . . . 0.446 ' CD1' ' HA2' ' A' ' 52' ' ' GLY . 37.4 t80 -49.47 -56.49 9.57 Favored 'General case' 0 N--CA 1.454 -0.275 0 C-N-CA 123.782 0.833 . . . . 0.42 110.818 175.104 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 90.5 t80 -62.14 -48.37 80.43 Favored 'General case' 0 N--CA 1.451 -0.424 0 C-N-CA 123.19 0.596 . . . . 0.59 110.686 179.697 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -59.02 -39.4 81.81 Favored 'General case' 0 CA--C 1.544 0.737 0 O-C-N 121.112 -0.992 . . . . 1.49 112.54 -178.113 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 37.4 mm-40 -64.37 -42.21 96.31 Favored 'General case' 0 CA--C 1.518 -0.288 0 C-N-CA 124.563 1.145 . . . . 4.58 109.901 172.314 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -53.69 -43.05 68.6 Favored 'General case' 0 N--CA 1.449 -0.477 0 CA-C-O 118.282 -0.866 . . . . 1.6 109.694 178.485 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 10.8 t80 -59.15 -49.48 77.7 Favored 'General case' 0 N--CA 1.463 0.211 0 CA-C-N 119.437 1.017 . . . . 3.21 111.898 173.13 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -50.27 -55.95 13.26 Favored 'General case' 0 CA--C 1.531 0.223 0 O-C-N 121.588 -0.695 . . . . 3.51 110.408 179.301 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -63.66 -30.56 71.65 Favored 'General case' 0 C--N 1.325 -0.495 0 C-N-CA 125.819 1.648 . . . . 1.78 110.846 -179.756 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' A' A ' 74' ' ' MET . . . . . 0.44 ' HA ' ' CE2' ' A' ' 93' ' ' PHE . 1.1 tmt? -61.97 -39.92 93.82 Favored 'General case' 0 N--CA 1.451 -0.378 0 C-N-CA 123.281 0.632 . . . . 3.48 111.976 -177.364 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 27.6 p80 -90.06 -45.97 8.8 Favored 'General case' 0 C--O 1.225 -0.225 0 CA-C-O 116.758 -1.592 . . . . 1.17 110.064 179.992 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 14.8 m 5.4 111.1 0.0 OUTLIER 'General case' 0 N--CA 1.469 0.492 0 C-N-CA 129.09 2.956 . . . . 2.12 114.719 -174.514 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 3.1 p -46.47 -44.58 17.63 Favored 'General case' 0 C--O 1.235 0.325 0 C-N-CA 125.38 1.472 . . . . 2.13 110.837 179.417 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 11.3 t0 -66.17 104.31 1.15 Allowed 'General case' 0 N--CA 1.449 -0.482 0 N-CA-C 108.673 -0.862 . . . . 2.18 108.673 167.279 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 41.4 m80 -55.86 -30.96 62.32 Favored 'General case' 0 N--CA 1.454 -0.26 0 CA-C-O 118.994 -0.527 . . . . 6.77 111.084 176.747 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -58.13 -50.95 71.69 Favored 'General case' 0 N--CA 1.446 -0.668 0 CA-C-O 117.937 -1.03 . . . . 1.35 109.767 176.708 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 1.9 mt-10 -46.89 -41.2 15.47 Favored 'General case' 0 N--CA 1.464 0.236 0 CA-C-N 119.583 1.083 . . . . 3.1 111.083 179.128 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -62.94 -51.66 66.06 Favored 'General case' 0 C--N 1.327 -0.383 0 N-CA-C 109.359 -0.608 . . . . 4.14 109.359 179.149 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 1.7 mm? -66.56 -18.97 65.66 Favored 'General case' 0 N--CA 1.453 -0.301 0 CA-C-O 118.11 -0.948 . . . . 1.71 113.261 176.922 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 2.0 mptm? -65.56 -48.51 72.14 Favored 'General case' 0 CA--C 1.518 -0.279 0 CA-C-N 120.629 1.559 . . . . 2.35 106.805 169.346 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 45.6 t -63.9 -46.57 93.8 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.663 0 CA-C-O 117.482 -1.247 . . . . 1.85 111.809 177.955 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 30.3 mt-30 -60.9 -52.23 65.91 Favored 'General case' 0 N--CA 1.462 0.126 0 CA-C-N 122.114 2.233 . . . . 2.59 111.261 179.61 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -65.13 -40.46 94.5 Favored 'General case' 0 CA--C 1.532 0.254 0 O-C-N 121.654 -0.653 . . . . 3.79 110.463 -172.717 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 6.9 m-20 -75.32 -21.75 58.18 Favored 'General case' 0 C--O 1.226 -0.172 0 CA-C-O 118.772 -0.632 . . . . 1.42 110.771 177.948 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -143.54 77.29 15.41 Favored Pre-proline 0 C--O 1.237 0.444 0 C-N-CA 124.15 0.98 . . . . 1.69 110.217 -173.238 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 94.2 Cg_endo -79.75 66.67 8.77 Favored 'Trans proline' 0 N--CA 1.453 -0.856 0 C-N-CA 124.024 3.15 . . . . 1.94 109.8 -173.27 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER 168.34 -53.07 0.01 OUTLIER 'General case' 0 C--O 1.224 -0.273 0 C-N-CA 126.923 2.089 . . . . 3.04 111.234 -171.718 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 4.3 m -55.38 -47.02 76.47 Favored 'General case' 0 N--CA 1.466 0.338 0 CA-C-N 120.19 1.359 . . . . 1.56 110.567 -177.525 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 93' ' ' PHE . . . . . 0.44 ' CE2' ' HA ' ' A' ' 74' ' ' MET . 8.2 t80 -59.92 -48.11 83.03 Favored 'General case' 0 CA--C 1.511 -0.528 0 CA-C-O 121.552 0.691 . . . . 2.93 110.163 178.278 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 8.3 tt0 -56.76 -31.31 64.47 Favored 'General case' 0 N--CA 1.441 -0.875 0 CA-C-N 114.602 -1.181 . . . . 1.91 110.163 -178.019 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 7.1 t80 -64.86 -56.25 14.54 Favored 'General case' 0 N--CA 1.453 -0.319 0 C-N-CA 124.02 0.928 . . . . 1.34 109.798 -176.362 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 2.9 mp -57.93 -44.62 87.04 Favored 'Isoleucine or valine' 0 N--CA 1.457 -0.119 0 N-CA-C 108.44 -0.948 . . . . 1.96 108.44 177.321 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 24.3 t30 -60.61 -31.8 70.95 Favored 'General case' 0 CA--C 1.532 0.273 0 C-N-CA 122.285 0.234 . . . . 2.0 111.544 -177.427 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -63.8 -46.29 85.83 Favored 'General case' 0 CA--C 1.521 -0.145 0 C-N-CA 124.552 1.141 . . . . 2.64 109.17 176.086 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 80.5 mm-40 -83.09 63.56 7.2 Favored 'General case' 0 N--CA 1.452 -0.342 0 CA-C-O 122.082 0.944 . . . . 3.75 110.168 178.309 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 8.5 tp -71.36 83.29 0.29 Allowed 'Isoleucine or valine' 0 CA--C 1.537 0.476 0 C-N-CA 124.302 1.041 . . . . 4.95 110.698 -177.324 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 4.3 mtpt -138.76 171.5 14.25 Favored 'General case' 0 C--N 1.334 -0.086 0 O-C-N 121.072 -1.017 . . . . 9.38 108.698 170.32 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 102' ' ' PHE . . . . . . . . . . . . . 34.4 p90 -128.87 166.9 18.19 Favored 'General case' 0 N--CA 1.45 -0.434 0 N-CA-C 106.872 -1.529 . . . . 8.83 106.872 172.091 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -136.91 111.22 9.65 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.532 0 N-CA-C 106.989 -1.485 . . . . 5.31 106.989 176.208 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' A' A ' 104' ' ' ILE . . . . . . . . . . . . . 49.0 mt 61.32 163.35 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.539 0.532 0 C-N-CA 124.595 1.158 . . . . 7.54 111.295 -174.257 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 19.4 t-20 -150.15 119.8 7.01 Favored 'General case' 0 N--CA 1.451 -0.419 0 N-CA-C 106.39 -1.707 . . . . 10.0 106.39 174.47 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 15.7 p . . . . . 0 C--O 1.254 1.314 0 CA-C-O 114.24 -2.79 . . . . 11.03 107.574 -170.855 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 1.8 t80 . . . . . 0 C--O 1.224 -0.271 0 N-CA-C 110.755 -0.091 . . . . 2.32 110.755 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 1.8 pt -71.94 -29.91 35.0 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.299 0 N-CA-C 113.349 0.87 . . . . 0.58 113.349 176.666 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 4.9 t60 -59.67 -57.65 12.02 Favored 'General case' 0 CA--C 1.533 0.297 0 N-CA-C 106.6 -1.63 . . . . 0.55 106.6 174.662 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 28.1 mt-10 -48.1 -45.09 32.41 Favored 'General case' 0 C--O 1.223 -0.311 0 C-N-CA 126.631 1.972 . . . . 2.65 110.368 174.55 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 1.4 t80 -59.23 -48.15 82.69 Favored 'General case' 0 CA--C 1.519 -0.239 0 C-N-CA 123.421 0.688 . . . . 2.03 110.184 179.857 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -51.34 -45.18 52.93 Favored Glycine 0 CA--C 1.523 0.553 0 N-CA-C 110.476 -1.05 . . . . 0.44 110.476 171.835 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 20' ' ' HIS . . . . . 0.463 ' CE1' ' HB1' ' A' ' 64' ' ' ALA . 3.9 t60 -64.42 -34.05 77.29 Favored 'General case' 0 N--CA 1.45 -0.451 0 O-C-N 121.628 -0.925 . . . . 1.9 111.826 179.689 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -71.29 -30.09 65.84 Favored 'General case' 0 N--CA 1.454 -0.267 0 O-C-N 121.505 -0.747 . . . . 0.57 109.884 174.594 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 60.5 t -67.25 -39.94 83.98 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.299 0 O-C-N 120.951 -1.093 . . . . 0.76 109.641 174.55 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 15.3 t0 . . . . . 0 C--N 1.327 -0.376 0 C-N-CA 123.669 0.788 . . . . 2.02 111.468 175.465 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 3.3 t0 . . . . . 0 N--CA 1.47 0.567 0 CA-C-O 121.696 0.76 . . . . 2.51 110.518 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 3.9 mm -54.5 -47.43 71.17 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.301 0 C-N-CA 125.372 1.469 . . . . 0.45 108.616 -172.099 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 26.0 t80 -65.98 -37.1 85.11 Favored 'General case' 0 N--CA 1.449 -0.511 0 O-C-N 121.7 -0.625 . . . . 0.43 112.315 176.792 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 49' ' ' LYS . . . . . 0.488 ' CA ' ' HE2' ' A' ' 49' ' ' LYS . 0.0 OUTLIER -64.27 -45.74 86.75 Favored 'General case' 0 CA--C 1.514 -0.432 0 C-N-CA 118.007 -1.477 . . . . 1.38 111.244 -172.735 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 5.4 tp10 -84.31 -66.22 0.92 Allowed 'General case' 0 N--CA 1.446 -0.626 0 N-CA-C 108.242 -1.022 . . . . 2.05 108.242 -177.919 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 9.2 mm-40 -69.94 -32.13 70.24 Favored 'General case' 0 CA--C 1.533 0.29 0 O-C-N 121.439 -0.788 . . . . 2.04 110.555 -169.052 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -68.89 37.04 0.29 Allowed Glycine 0 CA--C 1.529 0.931 0 C-N-CA 125.992 1.758 . . . . 0.3 114.546 172.154 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 76.7 p -140.03 17.71 2.46 Favored 'General case' 0 N--CA 1.448 -0.546 0 O-C-N 121.224 -1.162 . . . . 2.09 111.401 160.093 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 30.4 t-20 -131.67 -39.3 1.12 Allowed 'General case' 0 C--N 1.339 0.146 0 N-CA-C 112.099 0.407 . . . . 1.56 112.099 -162.533 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 24.6 mt -63.05 -35.87 81.68 Favored 'General case' 0 CA--C 1.533 0.299 0 O-C-N 121.745 -0.597 . . . . 0.37 110.972 -176.257 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 4.4 t 168.32 175.55 0.04 OUTLIER 'General case' 0 CA--C 1.534 0.351 0 C-N-CA 127.463 2.305 . . . . 0.91 107.673 -179.052 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 6.9 m -59.69 -37.57 79.2 Favored 'General case' 0 N--CA 1.454 -0.249 0 C-N-CA 124.425 1.09 . . . . 0.91 111.378 176.348 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -63.97 -28.41 69.8 Favored 'General case' 0 N--CA 1.463 0.204 0 C-N-CA 122.938 0.495 . . . . 1.04 111.258 173.233 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -68.01 -3.71 31.11 Favored Glycine 0 CA--C 1.523 0.592 0 O-C-N 121.39 -0.819 . . . . 0.4 111.715 172.707 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 1.8 ttt180 -129.87 6.11 5.05 Favored 'General case' 0 N--CA 1.451 -0.402 0 CA-C-N 118.574 1.187 . . . . 2.18 112.231 -174.994 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 58.2 p -75.05 -132.03 0.01 OUTLIER 'General case' 0 CA--C 1.536 0.41 0 N-CA-C 108.123 -1.066 . . . . 0.89 108.123 169.59 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 1.5 m-20 -73.05 155.94 39.26 Favored 'General case' 0 CA--C 1.527 0.079 0 O-C-N 120.283 -1.511 . . . . 1.58 108.447 176.238 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 35.8 tt0 -62.09 -33.48 74.51 Favored 'General case' 0 CA--C 1.534 0.345 0 C-N-CA 119.512 -0.875 . . . . 2.56 110.463 178.531 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 64' ' ' ALA . . . . . 0.463 ' HB1' ' CE1' ' A' ' 20' ' ' HIS . . . -60.82 -21.08 62.79 Favored 'General case' 0 C--N 1.331 -0.236 0 O-C-N 121.117 -0.989 . . . . 0.64 113.596 176.9 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 4.9 mt-10 -85.49 -49.57 7.97 Favored 'General case' 0 CA--C 1.509 -0.615 0 O-C-N 121.331 -0.856 . . . . 1.9 110.919 171.254 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 49.8 t80 -41.11 -49.85 3.45 Favored 'General case' 0 CA--C 1.535 0.376 0 C-N-CA 123.874 0.87 . . . . 0.31 111.666 171.869 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 77.9 t80 -62.59 -47.54 83.36 Favored 'General case' 0 CA--C 1.533 0.3 0 C-N-CA 123.509 0.724 . . . . 0.38 111.314 175.674 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -59.93 -53.46 57.61 Favored 'General case' 0 CA--C 1.535 0.386 0 C-N-CA 124.15 0.98 . . . . 0.28 112.264 -175.672 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 8.0 pt-20 -66.06 -31.07 71.73 Favored 'General case' 0 N--CA 1.451 -0.412 0 O-C-N 120.575 -1.328 . . . . 3.24 112.079 173.527 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -59.33 -40.57 86.74 Favored 'General case' 0 N--CA 1.451 -0.391 0 CA-C-N 119.749 1.159 . . . . 0.35 109.122 174.452 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 23.1 t80 -58.6 -51.4 70.08 Favored 'General case' 0 C--O 1.23 0.055 0 C-N-CA 124.546 1.138 . . . . 2.31 110.92 175.002 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 26.0 ttt180 -46.39 -66.87 0.34 Allowed 'General case' 0 N--CA 1.464 0.247 0 C-N-CA 123.4 0.68 . . . . 1.88 109.548 175.147 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 73' ' ' LEU . . . . . 0.515 ' HB3' HG21 ' A' ' 85' ' ' VAL . 0.1 OUTLIER -55.89 -35.77 66.9 Favored 'General case' 0 N--CA 1.45 -0.458 0 C-N-CA 126.19 1.796 . . . . 0.41 109.491 -173.271 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 2.1 ttp -59.64 -37.96 80.09 Favored 'General case' 0 C--O 1.234 0.242 0 N-CA-C 112.283 0.475 . . . . 2.4 112.283 -176.489 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 11.0 p80 -100.01 2.14 43.16 Favored 'General case' 0 CA--C 1.53 0.208 0 N-CA-C 114.459 1.281 . . . . 1.05 114.459 -177.566 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 70.3 m -49.51 128.51 17.56 Favored 'General case' 0 N--CA 1.448 -0.54 0 CA-C-N 120.43 1.468 . . . . 1.11 112.797 -168.518 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 4.1 p -50.96 -45.51 60.79 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 112.97 -1.923 . . . . 0.98 108.88 172.9 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 22.5 t0 -69.22 99.02 1.09 Allowed 'General case' 0 N--CA 1.449 -0.493 0 N-CA-C 107.241 -1.392 . . . . 2.22 107.241 162.951 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 36.8 p-80 -62.86 -30.18 71.31 Favored 'General case' 0 N--CA 1.45 -0.444 0 CA-C-N 115.342 -0.845 . . . . 3.81 112.241 -178.346 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -59.32 -39.42 83.04 Favored 'General case' 0 C--N 1.326 -0.453 0 O-C-N 121.83 -0.543 . . . . 0.69 110.189 174.402 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 2.6 tt0 -52.91 -35.92 58.83 Favored 'General case' 0 N--CA 1.466 0.326 0 CA-C-O 121.643 0.735 . . . . 2.99 110.483 176.817 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 18.6 mtp180 -67.57 -48.19 67.59 Favored 'General case' 0 CA--C 1.519 -0.248 0 N-CA-C 109.262 -0.644 . . . . 2.28 109.262 179.561 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 1.5 mm? -62.89 -23.82 67.52 Favored 'General case' 0 N--CA 1.452 -0.338 0 CA-C-O 117.702 -1.142 . . . . 0.5 112.31 177.848 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 2.5 mptm? -62.09 -44.43 96.68 Favored 'General case' 0 C--O 1.225 -0.234 0 CA-C-N 120.822 1.646 . . . . 1.19 108.349 170.282 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 85' ' ' VAL . . . . . 0.515 HG21 ' HB3' ' A' ' 73' ' ' LEU . 96.7 t -61.29 -57.94 9.84 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.486 0 CA-C-O 117.467 -1.254 . . . . 0.36 110.962 176.107 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 57.0 mt-30 -55.51 -49.24 73.11 Favored 'General case' 0 N--CA 1.466 0.36 0 CA-C-N 121.603 2.001 . . . . 2.37 111.7 -176.355 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 76.6 tttt -53.92 -49.69 68.08 Favored 'General case' 0 N--CA 1.446 -0.645 0 C-N-CA 123.74 0.816 . . . . 1.95 110.92 179.963 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 3.0 m-20 -83.54 -9.0 59.23 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 118.918 -0.563 . . . . 1.04 111.727 -175.327 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -160.87 73.95 2.7 Favored Pre-proline 0 C--O 1.238 0.466 0 C-N-CA 124.991 1.317 . . . . 0.31 109.669 -170.628 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 84.9 Cg_endo -77.08 22.48 0.56 Allowed 'Trans proline' 0 CA--C 1.537 0.647 0 C-N-CA 123.521 2.814 . . . . 1.44 112.707 -173.41 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 4.7 ptmt -141.61 -43.15 0.36 Allowed 'General case' 0 N--CA 1.451 -0.423 0 C-N-CA 125.799 1.64 . . . . 2.59 109.397 -175.829 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 4.4 m -57.61 -46.09 84.52 Favored 'General case' 0 CA--C 1.517 -0.306 0 CA-C-N 119.924 1.238 . . . . 0.33 111.265 172.247 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 22.5 t80 -56.85 -49.25 76.04 Favored 'General case' 0 CA--C 1.505 -0.78 0 C-N-CA 119.835 -0.746 . . . . 1.79 109.55 177.432 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 55.3 tt0 -58.76 -28.59 66.05 Favored 'General case' 0 N--CA 1.439 -1.0 0 CA-C-N 114.9 -1.045 . . . . 1.4 110.844 178.721 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 18.4 t80 -67.13 -53.31 31.81 Favored 'General case' 0 N--CA 1.454 -0.231 0 CA-C-N 119.367 0.985 . . . . 0.96 109.615 -178.812 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 2.0 mp -63.99 -30.27 49.56 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.246 0 N-CA-C 108.315 -0.994 . . . . 0.8 108.315 177.284 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -73.73 -25.17 60.06 Favored 'General case' 0 CA--C 1.538 0.509 0 O-C-N 121.735 -0.603 . . . . 1.52 111.196 179.642 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 34.2 t0 . . . . . 0 CA--C 1.507 -0.674 0 N-CA-C 106.335 -1.728 . . . . 2.76 106.335 172.45 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--O 1.227 -0.127 0 CA-C-O 120.958 0.408 . . . . 3.46 110.297 . . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER -63.58 -36.01 74.79 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.488 0 N-CA-C 112.838 0.681 . . . . 0.5 112.838 177.664 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 2.5 t60 -57.23 -57.34 13.04 Favored 'General case' 0 C--N 1.341 0.235 0 N-CA-C 107.115 -1.439 . . . . 0.49 107.115 177.659 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 38.7 mt-10 -59.67 -40.37 87.55 Favored 'General case' 0 N--CA 1.452 -0.362 0 C-N-CA 123.712 0.805 . . . . 2.17 110.479 -178.248 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -53.15 -48.74 67.7 Favored 'General case' 0 CA--C 1.518 -0.26 0 CA-C-N 118.849 0.749 . . . . 3.36 110.319 175.842 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -48.72 -47.09 30.89 Favored Glycine 0 CA--C 1.525 0.7 0 N-CA-C 110.715 -0.954 . . . . 0.51 110.715 174.913 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 20' ' ' HIS . . . . . 0.451 ' CE1' ' HB1' ' A' ' 64' ' ' ALA . 1.9 t-80 -65.05 -44.5 88.84 Favored 'General case' 0 C--O 1.224 -0.282 0 O-C-N 122.149 -0.618 . . . . 1.83 111.682 179.493 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -61.72 -32.76 73.0 Favored 'General case' 0 N--CA 1.453 -0.302 0 O-C-N 120.915 -1.116 . . . . 0.97 109.933 -179.385 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 78.8 t -71.91 -36.35 57.59 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.306 0 O-C-N 121.519 -0.738 . . . . 1.31 109.292 176.267 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 8.9 t0 . . . . . 0 N--CA 1.453 -0.288 0 C-N-CA 123.491 0.717 . . . . 2.03 111.401 173.793 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 4.9 t0 . . . . . 0 CA--C 1.53 0.2 0 CA-C-O 121.72 0.771 . . . . 2.39 109.935 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 7.6 mm -48.92 -57.83 1.47 Allowed 'Isoleucine or valine' 0 CA--C 1.531 0.216 0 C-N-CA 125.897 1.679 . . . . 0.43 110.079 179.499 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 21.6 t80 -60.0 -29.76 68.69 Favored 'General case' 0 N--CA 1.451 -0.41 0 C-N-CA 124.038 0.935 . . . . 0.45 111.962 179.82 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 49' ' ' LYS . . . . . 0.402 ' HA ' ' HE2' ' A' ' 49' ' ' LYS . 0.1 OUTLIER -69.14 -45.09 70.98 Favored 'General case' 0 N--CA 1.453 -0.315 0 O-C-N 120.289 -1.507 . . . . 1.22 110.956 -175.597 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 3.9 tp10 -86.84 -60.62 1.93 Allowed 'General case' 0 CA--C 1.532 0.266 0 CA-C-O 122.253 1.025 . . . . 2.4 109.349 -178.088 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 22.1 mm-40 -72.6 -28.79 62.99 Favored 'General case' 0 C--O 1.235 0.313 0 O-C-N 121.519 -0.738 . . . . 2.55 110.358 -171.348 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -70.89 39.92 0.53 Allowed Glycine 0 CA--C 1.534 1.234 0 C-N-CA 124.838 1.209 . . . . 0.37 113.743 169.829 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 24.3 m -151.82 36.47 0.56 Allowed 'General case' 0 CA--C 1.529 0.161 0 C-N-CA 125.638 1.575 . . . . 1.89 108.746 159.779 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 1.3 m-80 -141.65 -47.25 0.37 Allowed 'General case' 0 CA--C 1.515 -0.381 0 O-C-N 122.052 -0.405 . . . . 1.86 112.074 -172.893 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 55' ' ' LEU . . . . . 0.544 HD22 HG22 ' A' ' 85' ' ' VAL . 23.7 mt -63.81 -34.04 77.03 Favored 'General case' 0 C--N 1.332 -0.156 0 C-N-CA 120.294 -0.562 . . . . 0.52 111.227 -172.201 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER 177.82 169.43 0.7 Allowed 'General case' 0 C--N 1.331 -0.208 0 C-N-CA 124.937 1.295 . . . . 0.81 107.775 -173.575 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 39.4 m -61.56 -36.8 81.66 Favored 'General case' 0 N--CA 1.456 -0.146 0 O-C-N 121.81 -0.556 . . . . 0.9 110.677 168.767 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 4.7 m-85 -67.36 -7.58 25.98 Favored 'General case' 0 N--CA 1.465 0.316 0 CA-C-N 118.359 0.527 . . . . 1.61 112.164 172.87 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -82.59 -8.82 85.59 Favored Glycine 0 N--CA 1.441 -1.024 0 CA-C-O 118.024 -1.431 . . . . 0.43 110.934 173.569 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 4.8 ttt-85 -116.39 -9.15 11.54 Favored 'General case' 0 CA--C 1.529 0.166 0 CA-C-N 119.897 1.849 . . . . 2.83 112.283 -177.3 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 22.3 p -72.35 -136.51 0.01 OUTLIER 'General case' 0 CA--C 1.536 0.437 0 C-N-CA 123.366 0.666 . . . . 0.92 109.376 177.601 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -65.87 146.47 54.7 Favored 'General case' 0 N--CA 1.454 -0.264 0 O-C-N 119.784 -1.822 . . . . 1.6 108.187 178.182 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 61.6 tt0 -55.7 -34.28 64.94 Favored 'General case' 0 CA--C 1.533 0.301 0 CA-C-O 121.651 0.739 . . . . 2.92 110.564 178.21 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 64' ' ' ALA . . . . . 0.451 ' HB1' ' CE1' ' A' ' 20' ' ' HIS . . . -59.44 -36.76 76.53 Favored 'General case' 0 N--CA 1.452 -0.36 0 C-N-CA 123.334 0.654 . . . . 0.43 112.523 176.45 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 9.1 mt-10 -72.27 -43.53 64.16 Favored 'General case' 0 N--CA 1.455 -0.224 0 O-C-N 121.402 -0.811 . . . . 2.45 109.989 177.461 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 43.6 t80 -50.58 -50.91 52.5 Favored 'General case' 0 N--CA 1.454 -0.257 0 C-N-CA 124.089 0.955 . . . . 0.3 111.086 173.543 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 63.2 t80 -61.56 -46.78 88.43 Favored 'General case' 0 N--CA 1.454 -0.249 0 C-N-CA 123.308 0.643 . . . . 0.52 110.521 178.3 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -59.42 -48.45 81.61 Favored 'General case' 0 CA--C 1.536 0.418 0 O-C-N 121.615 -0.678 . . . . 0.29 111.36 -176.646 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 5.6 mm-40 -58.23 -45.35 87.85 Favored 'General case' 0 CA--C 1.52 -0.191 0 C-N-CA 123.324 0.65 . . . . 4.03 110.406 172.737 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -56.21 -39.66 72.83 Favored 'General case' 0 N--CA 1.453 -0.281 0 CA-C-N 118.927 0.785 . . . . 0.43 109.97 -179.555 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 1.4 t80 -60.58 -48.79 80.22 Favored 'General case' 0 CA--C 1.531 0.246 0 C-N-CA 124.475 1.11 . . . . 2.79 110.716 174.187 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 3.3 tmm_? -51.98 -54.51 28.87 Favored 'General case' 0 CA--C 1.535 0.388 0 C-N-CA 124.669 1.188 . . . . 2.4 110.595 178.042 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 73' ' ' LEU . . . . . 0.663 HD12 HG23 ' A' ' 85' ' ' VAL . 0.1 OUTLIER -62.77 -33.83 75.99 Favored 'General case' 0 C--N 1.326 -0.431 0 C-N-CA 126.463 1.905 . . . . 0.48 110.665 179.659 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -53.37 -45.94 69.43 Favored 'General case' 0 C--N 1.331 -0.217 0 C-N-CA 123.556 0.742 . . . . 2.45 111.888 -175.671 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 12.6 p-80 -96.97 -19.03 19.07 Favored 'General case' 0 C--O 1.225 -0.201 0 CA-C-O 116.341 -1.79 . . . . 1.95 114.481 -179.778 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 10.0 m -18.9 117.42 0.02 OUTLIER 'General case' 0 C--N 1.345 0.376 0 C-N-CA 126.962 2.105 . . . . 1.17 113.237 -176.856 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 1.8 p -45.46 -44.32 12.19 Favored 'General case' 0 N--CA 1.45 -0.467 0 C-N-CA 126.097 1.759 . . . . 1.32 110.06 -178.808 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 59.1 t0 -75.68 107.46 7.86 Favored 'General case' 0 N--CA 1.451 -0.376 0 C-N-CA 118.097 -1.441 . . . . 1.91 109.161 169.182 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 3.4 p-80 -41.31 -36.97 0.89 Allowed 'General case' 0 CA--C 1.531 0.244 0 C-N-CA 124.202 1.001 . . . . 4.47 112.821 170.493 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -58.24 -45.88 86.95 Favored 'General case' 0 N--CA 1.45 -0.468 0 C-N-CA 122.841 0.456 . . . . 0.64 110.985 -178.822 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 9.2 mt-10 -59.49 -35.28 73.83 Favored 'General case' 0 N--CA 1.455 -0.219 0 CA-C-N 118.396 0.544 . . . . 2.52 110.921 -179.532 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 5.6 mtp180 -64.57 -50.52 66.94 Favored 'General case' 0 C--N 1.328 -0.346 0 N-CA-C 108.651 -0.87 . . . . 2.81 108.651 178.575 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 83' ' ' LEU . . . . . 0.408 HD13 ' HA ' ' A' ' 83' ' ' LEU . 1.4 mm? -62.05 -25.11 67.49 Favored 'General case' 0 N--CA 1.449 -0.485 0 CA-C-O 118.113 -0.946 . . . . 0.54 111.836 174.715 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 21.5 mmtp -68.26 -39.44 82.21 Favored 'General case' 0 CA--C 1.514 -0.416 0 CA-C-N 121.071 1.759 . . . . 2.8 109.221 176.528 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 85' ' ' VAL . . . . . 0.663 HG23 HD12 ' A' ' 73' ' ' LEU . 72.0 t -61.41 -65.97 0.45 Allowed 'Isoleucine or valine' 0 C--O 1.218 -0.57 0 CA-C-O 117.39 -1.29 . . . . 0.53 109.656 168.616 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 2.0 mt-30 -48.03 -45.64 32.31 Favored 'General case' 0 N--CA 1.469 0.494 0 CA-C-N 121.281 1.855 . . . . 2.15 112.531 -173.906 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 11.4 tttt -60.67 -59.58 5.17 Favored 'General case' 0 N--CA 1.45 -0.459 0 C-N-CA 125.111 1.365 . . . . 3.39 110.428 177.812 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 64.8 m-20 -84.85 14.56 4.68 Favored 'General case' 0 CA--C 1.532 0.287 0 CA-C-O 118.791 -0.623 . . . . 1.25 110.951 -175.559 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 89' ' ' ALA . . . . . 0.474 ' HB2' HD21 ' A' ' 55' ' ' LEU . . . -170.1 71.45 0.62 Allowed Pre-proline 0 N--CA 1.448 -0.552 0 C-N-CA 126.011 1.725 . . . . 0.34 109.024 -178.473 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 94.2 Cg_endo -81.56 52.51 4.29 Favored 'Trans proline' 0 N--CA 1.459 -0.541 0 C-N-CA 124.001 3.134 . . . . 1.82 110.721 -175.756 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -170.47 -44.81 0.02 OUTLIER 'General case' 0 CA--C 1.534 0.365 0 C-N-CA 126.55 1.94 . . . . 3.2 109.376 174.646 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 5.6 m -52.17 -47.91 65.26 Favored 'General case' 0 N--CA 1.467 0.406 0 CA-C-N 119.082 0.856 . . . . 0.38 111.862 177.951 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 13.0 t80 -57.69 -47.6 81.89 Favored 'General case' 0 CA--C 1.513 -0.462 0 O-C-N 121.684 -0.635 . . . . 1.89 110.643 177.451 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 2.3 tt0 -57.55 -29.01 64.05 Favored 'General case' 0 N--CA 1.443 -0.794 0 CA-C-N 114.874 -1.057 . . . . 1.49 110.6 -178.512 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 1.9 t80 -60.83 -60.81 3.21 Favored 'General case' 0 N--CA 1.456 -0.14 0 C-N-CA 124.558 1.143 . . . . 1.08 110.078 -178.562 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 3.6 mp -58.88 -42.19 85.06 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.227 0 N-CA-C 108.501 -0.926 . . . . 0.94 108.501 178.07 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 1.1 m-20 -56.54 -40.02 74.39 Favored 'General case' 0 CA--C 1.534 0.35 0 CA-C-N 117.812 0.278 . . . . 1.68 111.577 -179.833 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.231 0.099 0 C-N-CA 125.416 1.486 . . . . 2.65 108.796 -178.5 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 17.3 t80 . . . . . 0 N--CA 1.455 -0.187 0 CA-C-O 121.548 0.689 . . . . 3.01 109.779 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 1.7 pt -67.86 -32.19 55.4 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.208 0 O-C-N 121.269 -0.894 . . . . 0.61 112.833 175.624 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 16' ' ' HIS . . . . . 0.422 ' CD2' ' HG3' ' A' ' 69' ' ' GLU . 1.6 t-80 -57.18 -54.36 47.65 Favored 'General case' 0 C--N 1.341 0.206 0 N-CA-C 106.693 -1.595 . . . . 0.55 106.693 175.752 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 33.3 mt-10 -52.2 -47.64 65.48 Favored 'General case' 0 N--CA 1.454 -0.27 0 C-N-CA 125.278 1.431 . . . . 2.6 109.766 -179.555 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -52.8 -50.84 62.8 Favored 'General case' 0 C--O 1.227 -0.107 0 C-N-CA 123.344 0.658 . . . . 3.29 111.558 174.824 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -49.13 -46.17 33.9 Favored Glycine 0 CA--C 1.526 0.732 0 N-CA-C 110.632 -0.987 . . . . 0.43 110.632 176.676 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 2.0 t-160 -62.59 -46.47 88.13 Favored 'General case' 0 N--CA 1.45 -0.45 0 O-C-N 122.061 -0.67 . . . . 1.83 111.028 178.316 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -61.25 -28.97 69.55 Favored 'General case' 0 N--CA 1.455 -0.224 0 C-N-CA 123.376 0.67 . . . . 0.66 110.856 -178.636 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 80.4 t -65.92 -41.26 89.57 Favored 'Isoleucine or valine' 0 C--O 1.234 0.264 0 O-C-N 121.037 -1.039 . . . . 0.74 110.069 176.61 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 N--CA 1.453 -0.302 0 CA-C-N 116.715 -0.221 . . . . 2.47 111.591 178.232 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 26.6 t70 . . . . . 0 N--CA 1.468 0.456 0 CA-C-O 121.073 0.463 . . . . 2.63 112.047 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 8.1 mm -48.34 -53.17 6.67 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.392 0 C-N-CA 126.732 2.013 . . . . 0.85 109.421 175.179 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 32.3 t80 -64.42 -34.24 77.74 Favored 'General case' 0 C--O 1.224 -0.256 0 O-C-N 121.93 -0.481 . . . . 0.45 112.15 176.069 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 49' ' ' LYS . . . . . 0.457 ' HA ' ' HE2' ' A' ' 49' ' ' LYS . 10.3 mmpt? -63.11 -46.45 87.26 Favored 'General case' 0 N--CA 1.453 -0.288 0 O-C-N 120.94 -1.1 . . . . 1.04 110.784 -176.285 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 1.2 mm-40 -81.07 -67.12 0.81 Allowed 'General case' 0 N--CA 1.451 -0.378 0 CA-C-O 122.379 1.085 . . . . 2.9 109.717 179.012 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 51' ' ' GLU . . . . . 0.428 ' OE2' ' HE3' ' A' ' 91' ' ' LYS . 45.1 mm-40 -75.98 -22.79 55.51 Favored 'General case' 0 N--CA 1.451 -0.389 0 CA-C-N 115.589 -0.732 . . . . 3.39 110.952 -165.442 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 52' ' ' GLY . . . . . 0.407 ' HA2' ' CD1' ' A' ' 66' ' ' PHE . . . -71.99 35.45 0.63 Allowed Glycine 0 CA--C 1.531 1.065 0 C-N-CA 123.784 0.707 . . . . 0.43 113.284 168.008 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 30.0 t -152.1 36.27 0.54 Allowed 'General case' 0 N--CA 1.448 -0.551 0 O-C-N 120.899 -1.354 . . . . 2.15 108.269 156.794 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 4.6 t-20 -134.88 -50.52 0.77 Allowed 'General case' 0 CA--C 1.519 -0.217 0 C-N-CA 122.67 0.388 . . . . 1.76 110.837 -168.545 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 55' ' ' LEU . . . . . 0.431 HD22 HG22 ' A' ' 85' ' ' VAL . 16.0 mt -64.21 -35.03 79.46 Favored 'General case' 0 C--N 1.334 -0.091 0 CA-C-O 120.798 0.332 . . . . 0.51 111.266 -174.3 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER 178.2 165.94 0.76 Allowed 'General case' 0 CA--C 1.531 0.238 0 C-N-CA 124.845 1.258 . . . . 0.71 108.067 -174.81 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 9.0 m -59.11 -36.51 75.3 Favored 'General case' 0 N--CA 1.455 -0.204 0 C-N-CA 123.803 0.841 . . . . 0.92 110.881 170.557 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -59.78 -34.05 72.5 Favored 'General case' 0 C--O 1.223 -0.314 0 C-N-CA 123.825 0.85 . . . . 1.43 109.575 172.367 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -63.18 -11.55 39.81 Favored Glycine 0 C--O 1.223 -0.551 0 O-C-N 121.482 -0.761 . . . . 0.43 112.384 176.663 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 3.1 tmt_? -111.7 -3.79 14.9 Favored 'General case' 0 N--CA 1.452 -0.37 0 CA-C-N 118.515 1.158 . . . . 3.27 112.48 -176.857 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 56.3 p -72.27 -137.75 0.01 OUTLIER 'General case' 0 CA--C 1.538 0.481 0 N-CA-C 108.596 -0.89 . . . . 1.13 108.596 175.944 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 98.5 m-20 -69.76 149.84 47.55 Favored 'General case' 0 CA--C 1.528 0.119 0 O-C-N 119.717 -1.864 . . . . 1.58 108.73 178.199 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 45.0 tt0 -58.6 -27.76 64.96 Favored 'General case' 0 CA--C 1.538 0.516 0 CA-C-O 121.682 0.754 . . . . 3.1 111.222 -179.55 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -62.96 -36.61 84.02 Favored 'General case' 0 N--CA 1.452 -0.339 0 C-N-CA 124.163 0.985 . . . . 0.72 112.826 174.562 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 4.2 mt-10 -75.81 -48.47 21.51 Favored 'General case' 0 CA--C 1.511 -0.55 0 O-C-N 121.322 -0.861 . . . . 1.92 109.175 177.766 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 66' ' ' PHE . . . . . 0.407 ' CD1' ' HA2' ' A' ' 52' ' ' GLY . 41.2 t80 -40.23 -51.73 2.68 Favored 'General case' 0 CA--C 1.535 0.403 0 C-N-CA 123.969 0.908 . . . . 0.3 111.694 171.609 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 59.5 t80 -60.98 -42.99 99.42 Favored 'General case' 0 CA--C 1.538 0.483 0 C-N-CA 122.95 0.5 . . . . 0.48 111.828 175.989 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -60.76 -49.33 77.92 Favored 'General case' 0 CA--C 1.538 0.486 0 O-C-N 120.999 -1.063 . . . . 0.4 111.836 -178.993 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 69' ' ' GLU . . . . . 0.422 ' HG3' ' CD2' ' A' ' 16' ' ' HIS . 2.9 mp0 -58.28 -40.69 82.57 Favored 'General case' 0 CA--C 1.519 -0.219 0 O-C-N 121.437 -0.789 . . . . 4.51 110.644 171.863 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -56.01 -42.29 76.22 Favored 'General case' 0 N--CA 1.449 -0.485 0 C-N-CA 120.294 -0.563 . . . . 0.65 109.594 177.934 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -60.09 -51.47 69.5 Favored 'General case' 0 CA--C 1.528 0.114 0 CA-C-N 119.187 0.903 . . . . 3.6 112.09 174.88 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 20.9 ttt180 -45.85 -67.46 0.28 Allowed 'General case' 0 N--CA 1.467 0.387 0 CA-C-N 118.555 0.616 . . . . 1.85 109.569 175.489 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 73' ' ' LEU . . . . . 0.661 HD12 HG23 ' A' ' 85' ' ' VAL . 0.2 OUTLIER -59.12 -35.25 73.13 Favored 'General case' 0 CA--C 1.509 -0.605 0 C-N-CA 125.603 1.561 . . . . 0.61 111.314 -173.054 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 1.8 tmt? -59.06 -38.55 79.64 Favored 'General case' 0 N--CA 1.445 -0.683 0 CA-C-O 119.783 -0.151 . . . . 2.87 111.164 -177.256 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 23.1 p80 -91.13 -35.95 14.27 Favored 'General case' 0 N--CA 1.454 -0.237 0 CA-C-O 116.467 -1.73 . . . . 1.12 111.915 179.353 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 20.4 m -10.36 117.46 0.01 OUTLIER 'General case' 0 C--N 1.344 0.328 0 C-N-CA 128.532 2.733 . . . . 1.23 115.251 -169.359 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 6.9 p -46.66 -44.01 18.12 Favored 'General case' 0 N--CA 1.452 -0.347 0 C-N-CA 125.814 1.645 . . . . 1.09 110.346 176.585 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 10.5 t0 -68.33 102.68 1.44 Allowed 'General case' 0 N--CA 1.448 -0.558 0 CA-C-O 121.669 0.747 . . . . 2.21 109.243 166.04 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 34.4 p-80 -50.23 -35.54 27.22 Favored 'General case' 0 N--CA 1.455 -0.21 0 CA-C-N 115.832 -0.622 . . . . 4.35 111.986 175.145 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -59.47 -48.28 82.24 Favored 'General case' 0 N--CA 1.448 -0.538 0 CA-C-O 118.278 -0.868 . . . . 0.79 110.399 179.757 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 1.4 tt0 -46.69 -42.6 16.78 Favored 'General case' 0 N--CA 1.465 0.298 0 CA-C-N 119.066 0.848 . . . . 3.37 110.161 177.1 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -63.18 -51.88 64.6 Favored 'General case' 0 CA--C 1.516 -0.351 0 N-CA-C 109.504 -0.554 . . . . 3.08 109.504 -179.982 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 1.4 mm? -65.72 -18.38 65.29 Favored 'General case' 0 N--CA 1.45 -0.431 0 CA-C-O 117.628 -1.177 . . . . 0.58 113.059 178.166 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -67.04 -50.58 61.47 Favored 'General case' 0 CA--C 1.519 -0.218 0 CA-C-N 121.387 1.903 . . . . 1.55 107.141 168.092 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 85' ' ' VAL . . . . . 0.661 HG23 HD12 ' A' ' 73' ' ' LEU . 69.0 t -58.03 -43.53 85.25 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.671 0 CA-C-O 117.471 -1.252 . . . . 0.45 112.008 177.79 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 9.9 mt-30 -68.1 -47.79 67.25 Favored 'General case' 0 C--O 1.225 -0.225 0 CA-C-N 122.305 2.321 . . . . 1.71 111.853 177.972 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 72.4 tttt -57.12 -49.18 76.71 Favored 'General case' 0 N--CA 1.449 -0.506 0 O-C-N 121.568 -0.707 . . . . 2.27 110.602 -173.942 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 25.0 m120 -68.83 -48.76 62.73 Favored 'General case' 0 N--CA 1.453 -0.291 0 N-CA-C 109.622 -0.511 . . . . 1.82 109.622 175.738 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -122.81 77.62 48.88 Favored Pre-proline 0 C--O 1.236 0.393 0 C-N-CA 125.652 1.581 . . . . 0.6 111.656 -170.34 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 57.9 Cg_endo -69.78 4.18 2.35 Favored 'Trans proline' 0 CA--C 1.537 0.632 0 C-N-CA 122.907 2.404 . . . . 1.57 113.187 -176.815 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 91' ' ' LYS . . . . . 0.428 ' HE3' ' OE2' ' A' ' 51' ' ' GLU . 0.5 OUTLIER -122.49 -44.14 2.25 Favored 'General case' 0 N--CA 1.45 -0.448 0 C-N-CA 126.26 1.824 . . . . 3.32 110.143 -171.702 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 5.9 m -58.25 -45.52 87.64 Favored 'General case' 0 N--CA 1.464 0.237 0 O-C-N 120.946 -1.097 . . . . 0.52 111.214 175.668 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 10.9 t80 -58.15 -46.08 86.3 Favored 'General case' 0 CA--C 1.511 -0.556 0 CA-C-O 121.771 0.796 . . . . 2.21 110.83 178.136 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 26.8 tt0 -56.09 -34.75 66.31 Favored 'General case' 0 N--CA 1.44 -0.931 0 CA-C-N 114.284 -1.325 . . . . 2.44 109.834 179.851 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 4.0 t80 -62.7 -57.19 11.85 Favored 'General case' 0 N--CA 1.455 -0.207 0 C-N-CA 124.338 1.055 . . . . 0.98 110.305 -178.083 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 37.3 mm -53.91 -44.62 61.7 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.114 0 N-CA-C 109.591 -0.522 . . . . 1.33 109.591 177.368 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 9.3 t30 -62.56 -30.78 71.57 Favored 'General case' 0 CA--C 1.534 0.335 0 N-CA-C 111.957 0.354 . . . . 1.55 111.957 -179.329 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 7.7 t70 . . . . . 0 N--CA 1.462 0.156 0 C-N-CA 124.587 1.155 . . . . 2.46 110.003 175.118 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 C--O 1.227 -0.106 0 CA-C-O 121.055 0.455 . . . . 2.88 110.741 . . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -63.87 -34.33 67.56 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.559 0 N-CA-C 112.747 0.647 . . . . 0.48 112.747 178.891 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 2.1 t-160 -59.79 -54.65 43.82 Favored 'General case' 0 N--CA 1.462 0.128 0 N-CA-C 106.762 -1.57 . . . . 0.46 106.762 176.4 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 41.0 mt-10 -57.28 -39.32 75.45 Favored 'General case' 0 C--O 1.222 -0.349 0 CA-C-O 118.209 -0.901 . . . . 2.46 111.075 179.723 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -51.1 -54.72 22.5 Favored 'General case' 0 CA--C 1.52 -0.203 0 CA-C-N 119.368 0.985 . . . . 3.11 110.45 173.452 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -47.94 -46.26 25.93 Favored Glycine 0 CA--C 1.527 0.792 0 N-CA-C 110.999 -0.84 . . . . 0.44 110.999 176.5 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 2.6 t-80 -63.62 -46.73 84.42 Favored 'General case' 0 N--CA 1.45 -0.462 0 O-C-N 121.98 -0.718 . . . . 1.83 111.794 -179.367 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -59.23 -32.72 70.22 Favored 'General case' 0 N--CA 1.452 -0.342 0 CA-C-N 118.603 0.638 . . . . 0.57 109.352 -179.25 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 45.0 t -68.39 -41.57 83.53 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.267 0 C-N-CA 119.923 -0.711 . . . . 0.8 110.201 177.092 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 2.0 t70 . . . . . 0 C--O 1.23 0.07 0 CA-C-O 121.284 0.564 . . . . 2.16 110.974 173.86 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 6.6 t70 . . . . . 0 N--CA 1.465 0.292 0 N-CA-C 107.374 -1.343 . . . . 2.75 107.374 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 4.3 mm -54.28 -55.79 12.98 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.396 0 C-N-CA 126.038 1.735 . . . . 0.49 109.689 -179.894 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 30.4 t80 -62.28 -26.02 68.17 Favored 'General case' 0 C--O 1.225 -0.219 0 O-C-N 120.498 -1.376 . . . . 0.38 112.181 175.664 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 49' ' ' LYS . . . . . 0.486 ' HA ' ' HE2' ' A' ' 49' ' ' LYS . 10.9 mmpt? -70.15 -47.21 62.66 Favored 'General case' 0 N--CA 1.45 -0.433 0 O-C-N 120.164 -1.585 . . . . 0.99 110.877 -178.066 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 16.4 tp10 -89.25 -60.61 1.9 Allowed 'General case' 0 C--N 1.332 -0.179 0 CA-C-O 121.519 0.676 . . . . 2.48 109.449 -176.504 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 51' ' ' GLU . . . . . 0.443 ' OE2' ' HE2' ' A' ' 91' ' ' LYS . 29.3 mp0 -71.32 -26.99 63.08 Favored 'General case' 0 C--O 1.235 0.324 0 O-C-N 121.185 -0.947 . . . . 2.61 110.699 -174.534 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 52' ' ' GLY . . . . . 0.443 ' HA2' ' CD1' ' A' ' 66' ' ' PHE . . . -72.45 42.59 0.84 Allowed Glycine 0 CA--C 1.53 1.016 0 C-N-CA 124.152 0.882 . . . . 0.36 114.562 171.619 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 28.2 t -151.51 34.24 0.56 Allowed 'General case' 0 N--CA 1.451 -0.409 0 O-C-N 121.109 -1.23 . . . . 2.05 109.087 151.432 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 1.5 m-20 -132.25 -47.68 0.92 Allowed 'General case' 0 CA--C 1.519 -0.237 0 N-CA-C 112.246 0.462 . . . . 1.78 112.246 -172.238 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 25.0 mt -59.42 -36.89 76.72 Favored 'General case' 0 N--CA 1.464 0.26 0 CA-C-O 121.033 0.444 . . . . 0.42 111.411 -172.294 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -177.56 171.76 1.87 Allowed 'General case' 0 C--N 1.33 -0.245 0 N-CA-C 107.126 -1.435 . . . . 0.64 107.126 -175.871 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 31.2 m -63.15 -33.7 76.03 Favored 'General case' 0 CA--C 1.53 0.179 0 O-C-N 121.693 -0.629 . . . . 1.0 110.834 169.101 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 1.8 m-85 -65.63 -19.2 65.82 Favored 'General case' 0 N--CA 1.466 0.361 0 CA-C-N 119.191 0.905 . . . . 1.21 111.502 171.041 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -69.21 -9.81 61.28 Favored Glycine 0 N--CA 1.443 -0.845 0 CA-C-O 118.656 -1.08 . . . . 0.42 111.31 173.607 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 58.3 ttt180 -116.35 -11.5 11.21 Favored 'General case' 0 N--CA 1.454 -0.232 0 CA-C-N 119.211 1.506 . . . . 3.68 112.657 -174.33 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 32.4 p -72.85 -123.61 0.0 OUTLIER 'General case' 0 CA--C 1.533 0.317 0 C-N-CA 123.227 0.611 . . . . 1.12 109.724 -178.378 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 14.3 t30 -76.3 149.19 37.11 Favored 'General case' 0 N--CA 1.451 -0.405 0 O-C-N 120.215 -1.553 . . . . 1.98 107.537 177.219 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -57.12 -33.32 67.24 Favored 'General case' 0 CA--C 1.534 0.336 0 CA-C-O 121.79 0.805 . . . . 2.86 110.321 178.832 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -60.14 -34.81 74.05 Favored 'General case' 0 N--CA 1.45 -0.445 0 O-C-N 121.684 -0.635 . . . . 0.42 112.592 177.656 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 7.0 mt-10 -76.25 -42.29 46.22 Favored 'General case' 0 CA--C 1.516 -0.34 0 O-C-N 121.694 -0.628 . . . . 2.14 110.174 178.491 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 66' ' ' PHE . . . . . 0.443 ' CD1' ' HA2' ' A' ' 52' ' ' GLY . 36.8 t80 -48.94 -53.84 18.01 Favored 'General case' 0 N--CA 1.453 -0.289 0 C-N-CA 123.786 0.834 . . . . 0.34 111.183 171.626 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 72.3 t80 -61.79 -45.92 91.79 Favored 'General case' 0 CA--C 1.534 0.347 0 C-N-CA 123.028 0.531 . . . . 0.51 110.483 -179.988 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -60.54 -48.22 82.74 Favored 'General case' 0 CA--C 1.538 0.517 0 O-C-N 121.378 -0.826 . . . . 0.29 112.186 -177.226 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 5.7 mm-40 -57.47 -41.53 80.79 Favored 'General case' 0 N--CA 1.458 -0.067 0 C-N-CA 123.74 0.816 . . . . 4.15 110.095 172.256 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -57.48 -45.16 85.15 Favored 'General case' 0 N--CA 1.451 -0.401 0 CA-C-O 118.664 -0.684 . . . . 0.32 109.801 -179.92 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 50.1 t80 -55.99 -49.87 72.43 Favored 'General case' 0 N--CA 1.465 0.287 0 CA-C-N 119.167 0.894 . . . . 2.24 112.004 174.607 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 11.6 ttt180 -47.46 -61.35 1.96 Allowed 'General case' 0 CA--C 1.533 0.327 0 N-CA-C 109.107 -0.701 . . . . 2.1 109.107 175.405 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 73' ' ' LEU . . . . . 0.607 ' CB ' HG21 ' A' ' 85' ' ' VAL . 0.1 OUTLIER -65.36 -23.37 66.97 Favored 'General case' 0 C--N 1.328 -0.362 0 C-N-CA 124.414 1.086 . . . . 0.55 111.607 -173.411 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -65.05 -40.8 95.28 Favored 'General case' 0 C--N 1.326 -0.425 0 C-N-CA 122.933 0.493 . . . . 2.84 110.719 179.109 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 13.8 p80 -95.41 -18.68 20.53 Favored 'General case' 0 C--O 1.227 -0.083 0 CA-C-O 116.936 -1.506 . . . . 0.9 113.478 -178.603 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 7.6 m -25.67 118.04 0.06 Allowed 'General case' 0 CA--C 1.516 -0.342 0 C-N-CA 126.419 1.888 . . . . 1.05 113.59 -171.603 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 6.2 p -46.08 -44.19 15.3 Favored 'General case' 0 N--CA 1.451 -0.424 0 C-N-CA 125.746 1.619 . . . . 1.09 109.985 177.607 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 13.4 t0 -70.03 103.81 2.38 Favored 'General case' 0 N--CA 1.451 -0.408 0 CA-C-O 122.034 0.921 . . . . 1.92 109.738 166.274 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 1.4 p80 -45.49 -37.32 5.19 Favored 'General case' 0 CA--C 1.531 0.239 0 CA-C-N 115.569 -0.741 . . . . 4.65 112.746 172.017 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -65.22 -42.07 93.82 Favored 'General case' 0 N--CA 1.449 -0.477 0 CA-C-O 118.68 -0.676 . . . . 0.59 110.879 -178.699 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 1.2 tt0 -48.83 -41.41 32.84 Favored 'General case' 0 N--CA 1.463 0.188 0 CA-C-N 118.896 0.771 . . . . 2.99 109.794 174.377 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 14.9 mtp180 -65.01 -52.53 55.55 Favored 'General case' 0 CA--C 1.517 -0.317 0 N-CA-C 109.332 -0.618 . . . . 2.31 109.332 -179.714 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 1.4 mm? -62.5 -21.79 65.77 Favored 'General case' 0 C--O 1.222 -0.345 0 CA-C-O 118.315 -0.85 . . . . 0.5 112.838 177.752 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 30.4 mttt -67.45 -42.91 82.31 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 120.907 1.685 . . . . 1.75 108.424 174.467 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 85' ' ' VAL . . . . . 0.607 HG21 ' CB ' ' A' ' 73' ' ' LEU . 84.0 t -60.69 -64.9 0.53 Allowed 'Isoleucine or valine' 0 C--O 1.219 -0.503 0 CA-C-O 118.032 -0.985 . . . . 0.62 109.815 170.639 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -48.72 -42.67 35.9 Favored 'General case' 0 CA--C 1.533 0.309 0 CA-C-N 120.309 1.413 . . . . 2.1 112.31 -174.622 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 35.6 tttm -62.52 -49.35 75.69 Favored 'General case' 0 N--CA 1.448 -0.56 0 C-N-CA 123.933 0.893 . . . . 2.21 111.891 178.793 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 70.6 m-80 -84.79 -4.96 59.3 Favored 'General case' 0 CA--C 1.531 0.219 0 CA-C-N 118.332 0.515 . . . . 1.9 111.973 -179.465 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -162.02 62.78 1.44 Allowed Pre-proline 0 N--CA 1.448 -0.539 0 C-N-CA 124.274 1.029 . . . . 0.45 110.005 -166.343 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 30.2 Cg_endo -60.08 -35.07 93.95 Favored 'Trans proline' 0 N--CA 1.454 -0.836 0 C-N-CA 122.516 2.144 . . . . 2.43 110.446 -174.754 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 91' ' ' LYS . . . . . 0.443 ' HE2' ' OE2' ' A' ' 51' ' ' GLU . 0.2 OUTLIER -81.65 -39.55 24.23 Favored 'General case' 0 N--CA 1.451 -0.379 0 C-N-CA 124.813 1.245 . . . . 2.63 112.639 -177.525 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 3.5 m -60.96 -45.99 92.52 Favored 'General case' 0 N--CA 1.464 0.262 0 CA-C-N 120.303 1.411 . . . . 0.39 110.342 179.04 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 5.1 t80 -58.84 -47.96 83.01 Favored 'General case' 0 CA--C 1.51 -0.571 0 CA-C-O 121.068 0.461 . . . . 1.97 110.835 176.835 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 44.9 tt0 -56.22 -31.22 63.3 Favored 'General case' 0 N--CA 1.441 -0.887 0 CA-C-N 115.327 -0.851 . . . . 1.48 110.767 177.841 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 3.6 t80 -61.12 -58.78 6.96 Favored 'General case' 0 N--CA 1.455 -0.205 0 CA-C-N 118.702 0.683 . . . . 0.93 110.417 -176.07 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 3.3 mp -57.15 -41.58 78.1 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.206 0 N-CA-C 108.625 -0.88 . . . . 0.79 108.625 176.237 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 7.7 t-20 -59.65 -35.14 73.82 Favored 'General case' 0 CA--C 1.542 0.662 0 N-CA-C 112.342 0.497 . . . . 1.86 112.342 -177.726 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 21.0 t70 . . . . . 0 CA--C 1.516 -0.356 0 C-N-CA 125.214 1.406 . . . . 2.47 109.66 176.423 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 84.3 t80 . . . . . 0 CA--C 1.517 -0.319 0 N-CA-C 110.197 -0.298 . . . . 3.19 110.197 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -62.99 -33.72 62.26 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.407 0 O-C-N 121.755 -0.59 . . . . 0.51 112.194 -179.906 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 1.9 t60 -58.99 -57.51 12.75 Favored 'General case' 0 C--N 1.342 0.259 0 N-CA-C 107.303 -1.369 . . . . 0.61 107.303 175.954 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 44.0 mt-10 -55.64 -35.44 65.92 Favored 'General case' 0 C--O 1.222 -0.389 0 C-N-CA 124.262 1.025 . . . . 2.56 110.72 -179.805 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 6.2 t80 -58.64 -49.66 76.71 Favored 'General case' 0 N--CA 1.453 -0.292 0 C-N-CA 124.097 0.959 . . . . 2.78 109.8 177.521 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -48.52 -46.93 29.73 Favored Glycine 0 CA--C 1.527 0.837 0 N-CA-C 110.959 -0.856 . . . . 0.44 110.959 171.128 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 1.9 t-80 -62.5 -44.99 95.03 Favored 'General case' 0 N--CA 1.453 -0.299 0 O-C-N 121.516 -0.991 . . . . 1.88 111.742 -179.526 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -62.59 -29.56 70.69 Favored 'General case' 0 N--CA 1.451 -0.377 0 O-C-N 121.483 -0.761 . . . . 0.58 109.806 -179.695 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 90.1 t -66.29 -40.07 85.87 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.147 0 O-C-N 121.36 -0.838 . . . . 0.79 110.697 175.432 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 18.8 t0 . . . . . 0 C--N 1.332 -0.195 0 CA-C-O 121.785 0.802 . . . . 2.0 110.863 173.936 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 6.3 t70 . . . . . 0 N--CA 1.47 0.533 0 CA-C-O 121.775 0.798 . . . . 2.51 110.068 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 4.5 mm -54.8 -50.02 64.4 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.385 0 C-N-CA 124.901 1.28 . . . . 0.49 108.643 -176.418 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 36.1 t80 -66.92 -26.99 67.12 Favored 'General case' 0 N--CA 1.453 -0.314 0 O-C-N 121.617 -0.677 . . . . 0.67 112.724 177.067 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 49' ' ' LYS . . . . . 0.488 ' HA ' ' HE2' ' A' ' 49' ' ' LYS . 0.2 OUTLIER -68.44 -48.59 64.18 Favored 'General case' 0 N--CA 1.452 -0.367 0 O-C-N 120.591 -1.318 . . . . 1.31 111.047 -175.994 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 7.6 mm-40 -86.77 -62.17 1.57 Allowed 'General case' 0 C--N 1.33 -0.258 0 N-CA-C 109.059 -0.719 . . . . 2.65 109.059 179.155 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 4.2 mm-40 -69.9 -33.58 72.38 Favored 'General case' 0 CA--C 1.535 0.373 0 O-C-N 121.643 -0.661 . . . . 2.05 109.546 -167.719 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -68.92 34.97 0.29 Allowed Glycine 0 CA--C 1.53 0.997 0 C-N-CA 125.926 1.727 . . . . 0.38 114.213 169.041 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 23.0 t -146.9 35.94 0.93 Allowed 'General case' 0 N--CA 1.447 -0.601 0 O-C-N 120.917 -1.343 . . . . 1.79 108.845 157.433 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 1.1 t-20 -141.25 -43.58 0.37 Allowed 'General case' 0 CA--C 1.52 -0.204 0 N-CA-C 112.817 0.673 . . . . 1.79 112.817 -173.985 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 55' ' ' LEU . . . . . 0.524 HD21 ' HB2' ' A' ' 89' ' ' ALA . 17.0 mt -60.58 -37.04 80.04 Favored 'General case' 0 N--CA 1.461 0.124 0 CA-C-O 120.876 0.369 . . . . 0.35 111.385 -174.56 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER 178.93 168.86 0.93 Allowed 'General case' 0 C--N 1.33 -0.25 0 C-N-CA 125.386 1.474 . . . . 0.44 107.319 -178.21 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 18.7 m -60.43 -36.42 78.13 Favored 'General case' 0 N--CA 1.454 -0.24 0 O-C-N 121.742 -0.599 . . . . 1.11 110.569 168.701 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -67.81 -8.34 35.18 Favored 'General case' 0 N--CA 1.465 0.308 0 C-N-CA 122.806 0.443 . . . . 1.17 112.066 174.209 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -92.47 -0.39 70.03 Favored Glycine 0 N--CA 1.443 -0.846 0 CA-C-O 118.787 -1.007 . . . . 0.47 110.825 175.2 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 1.2 ttt180 -123.11 -2.93 8.57 Favored 'General case' 0 C--O 1.227 -0.087 0 CA-C-N 119.003 1.401 . . . . 2.28 112.175 -178.746 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 12.1 p -68.63 -106.72 0.0 OUTLIER 'General case' 0 N--CA 1.453 -0.275 0 C-N-CA 125.038 1.335 . . . . 1.51 109.644 175.877 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 2.2 t-20 -93.25 151.22 19.94 Favored 'General case' 0 N--CA 1.447 -0.599 0 N-CA-C 108.312 -0.995 . . . . 2.45 108.312 177.071 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 22.7 tt0 -61.23 -29.49 69.86 Favored 'General case' 0 CA--C 1.535 0.401 0 CA-C-N 118.769 0.713 . . . . 3.15 109.974 176.914 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -64.91 -36.43 84.33 Favored 'General case' 0 N--CA 1.452 -0.357 0 N-CA-C 112.797 0.666 . . . . 0.52 112.797 174.959 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 11.3 mt-10 -75.47 -37.75 60.07 Favored 'General case' 0 CA--C 1.511 -0.531 0 O-C-N 121.367 -0.833 . . . . 2.28 110.178 178.473 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 48.8 t80 -53.2 -51.54 61.79 Favored 'General case' 0 N--CA 1.447 -0.607 0 C-N-CA 123.604 0.762 . . . . 0.33 110.472 173.685 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 84.8 t80 -60.59 -46.71 89.22 Favored 'General case' 0 CA--C 1.534 0.35 0 CA-C-O 121.204 0.526 . . . . 0.47 111.121 177.512 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -60.81 -50.96 71.33 Favored 'General case' 0 CA--C 1.541 0.606 0 O-C-N 121.4 -0.813 . . . . 0.3 112.342 -176.553 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 24.8 mm-40 -54.01 -43.71 70.32 Favored 'General case' 0 CA--C 1.52 -0.192 0 C-N-CA 124.425 1.09 . . . . 4.35 110.487 169.6 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -56.36 -42.25 77.49 Favored 'General case' 0 N--CA 1.451 -0.413 0 CA-C-O 118.414 -0.803 . . . . 0.33 109.768 -178.649 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 22.9 t80 -58.09 -52.21 66.51 Favored 'General case' 0 N--CA 1.465 0.323 0 CA-C-N 119.233 0.924 . . . . 2.99 111.578 173.055 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 28.1 ttt180 -46.8 -51.2 16.95 Favored 'General case' 0 CA--C 1.533 0.303 0 C-N-CA 122.738 0.415 . . . . 2.21 110.148 177.584 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 73' ' ' LEU . . . . . 0.634 HD12 HG23 ' A' ' 85' ' ' VAL . 0.1 OUTLIER -72.51 -30.19 64.27 Favored 'General case' 0 C--N 1.327 -0.377 0 C-N-CA 124.698 1.199 . . . . 0.44 111.035 -176.132 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 4.0 tmm? -62.78 -37.91 88.52 Favored 'General case' 0 C--N 1.33 -0.245 0 C-N-CA 123.784 0.834 . . . . 2.63 111.015 -179.374 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 23.4 p80 -87.57 -47.59 8.59 Favored 'General case' 0 C--O 1.224 -0.278 0 CA-C-O 116.832 -1.556 . . . . 1.07 109.826 179.201 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 5.2 m -0.09 104.75 0.01 OUTLIER 'General case' 0 N--CA 1.47 0.557 0 C-N-CA 128.297 2.639 . . . . 1.05 113.624 -173.454 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 2.1 p -45.7 -41.62 10.71 Favored 'General case' 0 N--CA 1.452 -0.372 0 C-N-CA 125.685 1.594 . . . . 0.97 111.621 -177.086 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 59.4 t0 -69.48 103.5 2.06 Favored 'General case' 0 N--CA 1.455 -0.223 0 C-N-CA 118.589 -1.244 . . . . 2.11 109.129 167.381 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 1.7 p80 -42.03 -36.57 1.16 Allowed 'General case' 0 CA--C 1.53 0.177 0 C-N-CA 124.462 1.105 . . . . 4.42 112.63 172.581 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -58.1 -48.84 78.97 Favored 'General case' 0 N--CA 1.451 -0.38 0 C-N-CA 122.644 0.378 . . . . 0.65 111.011 178.91 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -53.62 -38.55 64.13 Favored 'General case' 0 C--O 1.232 0.181 0 C-N-CA 123.407 0.683 . . . . 3.85 110.964 179.073 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 3.3 mtp-105 -65.4 -51.4 60.65 Favored 'General case' 0 C--N 1.328 -0.334 0 C-N-CA 120.167 -0.613 . . . . 3.11 109.702 178.383 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 83' ' ' LEU . . . . . 0.415 HD13 ' HA ' ' A' ' 83' ' ' LEU . 0.8 OUTLIER -60.53 -26.7 67.07 Favored 'General case' 0 N--CA 1.452 -0.344 0 CA-C-O 118.656 -0.688 . . . . 0.51 112.695 177.752 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 37.6 mttt -65.14 -42.39 93.86 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 119.691 1.132 . . . . 1.6 108.489 175.814 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 85' ' ' VAL . . . . . 0.634 HG23 HD12 ' A' ' 73' ' ' LEU . 78.5 t -62.77 -60.34 2.91 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.485 0 CA-C-O 117.4 -1.286 . . . . 0.4 111.612 171.138 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 11.9 mt-30 -49.11 -46.55 45.01 Favored 'General case' 0 N--CA 1.468 0.446 0 CA-C-N 121.19 1.814 . . . . 1.94 111.619 -175.86 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 18.5 tttt -60.25 -52.33 65.73 Favored 'General case' 0 N--CA 1.449 -0.494 0 C-N-CA 123.737 0.815 . . . . 2.36 110.57 178.803 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 19.3 m-20 -84.25 5.38 26.86 Favored 'General case' 0 CA--C 1.533 0.293 0 C-N-CA 123.296 0.638 . . . . 1.07 111.516 -174.629 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 89' ' ' ALA . . . . . 0.524 ' HB2' HD21 ' A' ' 55' ' ' LEU . . . -164.47 77.93 1.47 Allowed Pre-proline 0 N--CA 1.448 -0.553 0 C-N-CA 125.324 1.45 . . . . 0.38 108.894 -177.696 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 96.8 Cg_endo -80.65 47.42 2.55 Favored 'Trans proline' 0 CA--C 1.539 0.76 0 C-N-CA 124.211 3.274 . . . . 1.81 111.624 -175.101 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 4.0 ptmt -169.06 -51.14 0.02 OUTLIER 'General case' 0 C--O 1.225 -0.233 0 C-N-CA 126.436 1.894 . . . . 2.44 109.643 -176.889 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 3.2 m -53.19 -45.61 68.66 Favored 'General case' 0 N--CA 1.464 0.231 0 CA-C-N 119.09 0.859 . . . . 0.32 111.817 179.913 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 9.1 t80 -60.2 -47.27 86.69 Favored 'General case' 0 CA--C 1.514 -0.408 0 CA-C-O 121.572 0.701 . . . . 2.49 110.039 178.527 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 2.0 tt0 -57.89 -30.14 65.62 Favored 'General case' 0 N--CA 1.442 -0.834 0 CA-C-N 114.746 -1.115 . . . . 1.93 110.471 179.253 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 3.9 t80 -64.49 -57.41 9.3 Favored 'General case' 0 N--CA 1.455 -0.196 0 C-N-CA 124.715 1.206 . . . . 0.96 109.917 -175.723 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 3.2 mp -58.79 -41.99 84.18 Favored 'Isoleucine or valine' 0 C--O 1.226 -0.136 0 N-CA-C 108.326 -0.99 . . . . 0.78 108.326 176.108 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 7.7 t30 -59.66 -31.34 69.45 Favored 'General case' 0 CA--C 1.536 0.44 0 N-CA-C 111.617 0.228 . . . . 1.42 111.617 -179.496 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 2.4 t0 . . . . . 0 C--N 1.338 0.095 0 C-N-CA 126.132 1.773 . . . . 2.31 108.829 175.672 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 39.8 t80 . . . . . 0 C--O 1.225 -0.197 0 N-CA-C 110.206 -0.294 . . . . 3.69 110.206 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 15' ' ' ILE . . . . . 0.419 HD12 ' CE1' ' A' ' 75' ' ' HIS . 0.7 OUTLIER -65.72 -31.93 55.92 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.21 0 O-C-N 121.761 -0.587 . . . . 0.38 112.111 -177.778 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 9.1 t60 -60.78 -54.74 41.46 Favored 'General case' 0 CA--C 1.532 0.254 0 N-CA-C 107.388 -1.338 . . . . 0.5 107.388 177.647 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 22.4 mt-10 -53.2 -39.37 63.65 Favored 'General case' 0 C--O 1.222 -0.353 0 C-N-CA 123.773 0.829 . . . . 2.14 110.639 174.977 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 5.1 t80 -58.05 -47.67 82.43 Favored 'General case' 0 CA--C 1.52 -0.182 0 C-N-CA 123.757 0.823 . . . . 2.84 110.259 -178.407 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -49.07 -48.73 31.29 Favored Glycine 0 CA--C 1.524 0.621 0 N-CA-C 110.508 -1.037 . . . . 0.43 110.508 171.068 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 5.6 t-80 -60.69 -45.53 93.84 Favored 'General case' 0 N--CA 1.451 -0.384 0 O-C-N 122.002 -0.705 . . . . 1.84 112.0 -178.4 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -66.32 -27.24 67.76 Favored 'General case' 0 N--CA 1.452 -0.354 0 O-C-N 121.606 -0.684 . . . . 0.62 110.032 -179.599 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 55.8 t -73.44 -37.83 51.7 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.185 0 C-N-CA 119.406 -0.918 . . . . 0.79 110.187 174.586 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 7.0 t0 . . . . . 0 N--CA 1.453 -0.319 0 C-N-CA 122.718 0.407 . . . . 1.89 110.954 174.464 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 10.2 t70 . . . . . 0 N--CA 1.466 0.373 0 CA-C-O 122.031 0.92 . . . . 2.56 110.451 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 2.9 mm -51.42 -48.16 34.55 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.226 0 C-N-CA 126.911 2.084 . . . . 0.44 109.526 176.78 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 48' ' ' PHE . . . . . 0.407 ' O ' ' HA3' ' A' ' 52' ' ' GLY . 20.0 t80 -63.42 -31.92 73.21 Favored 'General case' 0 N--CA 1.45 -0.436 0 O-C-N 121.039 -1.038 . . . . 0.51 112.229 177.917 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 49' ' ' LYS . . . . . 0.51 ' HA ' ' HE2' ' A' ' 49' ' ' LYS . 10.8 mmpt? -69.97 -45.52 67.18 Favored 'General case' 0 C--N 1.33 -0.265 0 O-C-N 119.662 -1.899 . . . . 1.11 110.543 -177.954 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 7.2 mm-40 -79.95 -65.76 0.96 Allowed 'General case' 0 N--CA 1.452 -0.344 0 CA-C-O 121.901 0.858 . . . . 2.32 109.526 -176.906 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 14.0 mp0 -73.53 -28.32 61.82 Favored 'General case' 0 CA--C 1.533 0.314 0 O-C-N 121.492 -0.755 . . . . 2.65 110.64 -172.33 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 52' ' ' GLY . . . . . 0.407 ' HA3' ' O ' ' A' ' 48' ' ' PHE . . . -68.99 33.5 0.29 Allowed Glycine 0 CA--C 1.533 1.158 0 C-N-CA 124.944 1.259 . . . . 0.34 114.498 168.285 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 32.6 t -149.61 44.16 0.93 Allowed 'General case' 0 N--CA 1.447 -0.58 0 O-C-N 120.79 -1.418 . . . . 1.58 107.56 158.84 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -148.48 -42.41 0.16 Allowed 'General case' 0 CA--C 1.516 -0.334 0 N-CA-C 114.003 1.112 . . . . 2.1 114.003 -176.078 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 19.0 mt -61.89 -38.69 89.27 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-O 120.954 0.407 . . . . 0.41 110.778 -176.737 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 1.2 t 178.63 172.76 0.73 Allowed 'General case' 0 CA--C 1.531 0.236 0 C-N-CA 125.41 1.484 . . . . 0.48 107.678 -176.325 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 10.7 m -60.86 -34.66 74.94 Favored 'General case' 0 N--CA 1.453 -0.303 0 O-C-N 121.671 -0.643 . . . . 0.96 110.408 168.45 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 1.6 m-85 -67.5 -10.82 55.25 Favored 'General case' 0 N--CA 1.464 0.242 0 N-CA-C 112.332 0.493 . . . . 1.45 112.332 173.831 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -83.1 -9.37 84.25 Favored Glycine 0 N--CA 1.443 -0.879 0 N-CA-C 110.825 -0.91 . . . . 0.39 110.825 173.775 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 3.4 tmt_? -120.96 -6.39 9.54 Favored 'General case' 0 CA--C 1.526 0.03 0 CA-C-N 118.994 1.397 . . . . 2.55 112.767 -173.81 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 19.5 p -67.56 -145.32 0.01 OUTLIER 'General case' 0 CA--C 1.54 0.575 0 C-N-CA 124.689 1.196 . . . . 0.75 108.947 169.277 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 32.5 m-80 -62.36 148.75 44.27 Favored 'General case' 0 N--CA 1.456 -0.158 0 O-C-N 119.318 -2.114 . . . . 2.21 109.261 178.269 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 58.2 tt0 -60.37 -27.86 67.74 Favored 'General case' 0 CA--C 1.537 0.449 0 CA-C-O 121.819 0.819 . . . . 2.78 111.065 -179.565 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -59.32 -40.92 87.79 Favored 'General case' 0 N--CA 1.452 -0.362 0 C-N-CA 124.643 1.177 . . . . 0.5 112.507 171.564 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 10.4 mt-10 -70.41 -47.09 62.42 Favored 'General case' 0 N--CA 1.446 -0.631 0 CA-C-O 118.211 -0.899 . . . . 2.04 109.828 176.927 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 48.7 t80 -45.86 -51.92 12.21 Favored 'General case' 0 N--CA 1.454 -0.249 0 C-N-CA 124.042 0.937 . . . . 0.34 111.576 175.23 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 60.1 t80 -65.11 -43.81 90.81 Favored 'General case' 0 CA--C 1.538 0.5 0 O-C-N 121.426 -0.796 . . . . 0.38 110.98 178.27 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -62.73 -53.89 47.47 Favored 'General case' 0 CA--C 1.541 0.611 0 O-C-N 121.023 -1.048 . . . . 0.28 113.156 -176.23 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -57.78 -40.15 79.14 Favored 'General case' 0 C--N 1.332 -0.154 0 O-C-N 120.435 -1.416 . . . . 3.83 110.738 171.388 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -56.76 -39.41 73.95 Favored 'General case' 0 N--CA 1.451 -0.378 0 CA-C-O 118.282 -0.866 . . . . 0.46 110.951 176.899 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 58.6 t80 -57.61 -49.82 75.18 Favored 'General case' 0 N--CA 1.465 0.299 0 CA-C-N 120.195 1.361 . . . . 3.85 111.05 172.375 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 38.0 ttp85 -49.5 -57.7 6.55 Favored 'General case' 0 C--N 1.341 0.218 0 N-CA-C 109.235 -0.654 . . . . 3.27 109.235 178.256 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 73' ' ' LEU . . . . . 0.592 ' HB3' HG21 ' A' ' 85' ' ' VAL . 0.1 OUTLIER -64.09 -29.6 70.72 Favored 'General case' 0 N--CA 1.451 -0.409 0 C-N-CA 124.34 1.056 . . . . 0.5 110.834 -174.704 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 1.4 ttp -60.7 -41.44 95.19 Favored 'General case' 0 C--O 1.234 0.271 0 C-N-CA 123.042 0.537 . . . . 2.4 110.116 -179.582 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 75' ' ' HIS . . . . . 0.419 ' CE1' HD12 ' A' ' 15' ' ' ILE . 5.8 p80 -97.48 -9.79 26.53 Favored 'General case' 0 N--CA 1.454 -0.266 0 CA-C-O 116.238 -1.839 . . . . 0.88 113.97 -177.598 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 8.0 m -36.19 123.78 0.75 Allowed 'General case' 0 CA--C 1.516 -0.363 0 CA-C-N 120.363 1.438 . . . . 1.08 111.505 -169.026 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 2.1 p -48.95 -42.82 38.75 Favored 'General case' 0 N--CA 1.45 -0.467 0 CA-C-N 113.318 -1.765 . . . . 1.07 109.068 -179.791 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 14.9 t0 -70.52 104.19 2.7 Favored 'General case' 0 N--CA 1.445 -0.705 0 CA-C-O 122.439 1.114 . . . . 1.78 109.764 165.879 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 18.1 p-80 -45.39 -38.84 6.29 Favored 'General case' 0 N--CA 1.453 -0.284 0 CA-C-N 115.064 -0.971 . . . . 4.34 112.763 170.909 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -63.35 -44.64 94.26 Favored 'General case' 0 N--CA 1.451 -0.391 0 O-C-N 121.537 -0.727 . . . . 0.71 110.179 -177.82 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 1.8 tt0 -47.61 -43.16 25.54 Favored 'General case' 0 C--O 1.231 0.127 0 C-N-CA 123.948 0.899 . . . . 2.76 110.389 175.185 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 4.5 mtp180 -62.79 -51.0 68.78 Favored 'General case' 0 CA--C 1.516 -0.359 0 N-CA-C 108.774 -0.824 . . . . 2.7 108.774 -179.405 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 1.6 mm? -63.68 -18.62 64.17 Favored 'General case' 0 N--CA 1.455 -0.211 0 CA-C-O 118.194 -0.907 . . . . 0.45 113.355 176.664 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 1.9 mptm? -65.93 -47.46 74.65 Favored 'General case' 0 CA--C 1.521 -0.164 0 CA-C-N 120.856 1.662 . . . . 1.8 107.998 169.234 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 85' ' ' VAL . . . . . 0.592 HG21 ' HB3' ' A' ' 73' ' ' LEU . 84.8 t -60.58 -59.07 4.74 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.6 0 CA-C-O 118.401 -0.809 . . . . 0.45 110.206 175.19 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -52.69 -48.62 66.42 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 120.075 1.307 . . . . 2.32 111.959 -175.803 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 18.5 pttt -65.19 -41.07 94.91 Favored 'General case' 0 CA--C 1.533 0.32 0 O-C-N 120.931 -1.106 . . . . 2.66 110.676 -177.975 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 37.8 m-20 -74.81 -20.68 59.67 Favored 'General case' 0 CA--C 1.534 0.335 0 C-N-CA 122.712 0.405 . . . . 0.91 111.013 -179.208 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -157.43 67.11 3.88 Favored Pre-proline 0 N--CA 1.45 -0.459 0 C-N-CA 125.932 1.693 . . . . 0.5 108.959 -163.549 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 25.4 Cg_endo -60.33 -28.84 87.6 Favored 'Trans proline' 0 N--CA 1.455 -0.786 0 C-N-CA 122.255 1.97 . . . . 2.56 110.919 -173.486 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -89.31 -43.8 10.69 Favored 'General case' 0 N--CA 1.451 -0.387 0 C-N-CA 126.215 1.806 . . . . 2.25 111.941 -174.561 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 4.9 m -56.86 -44.52 82.26 Favored 'General case' 0 N--CA 1.465 0.28 0 CA-C-N 120.168 1.349 . . . . 0.39 110.909 178.791 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 13.5 t80 -55.39 -49.42 72.39 Favored 'General case' 0 CA--C 1.512 -0.498 0 C-N-CA 120.123 -0.631 . . . . 1.84 110.631 176.008 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 9.8 tt0 -59.22 -30.09 67.98 Favored 'General case' 0 N--CA 1.445 -0.693 0 CA-C-N 115.594 -0.73 . . . . 2.23 110.894 -179.508 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 4.6 t80 -61.46 -57.86 10.47 Favored 'General case' 0 C--O 1.231 0.12 0 C-N-CA 123.781 0.833 . . . . 1.16 109.047 -176.687 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 3.4 mp -58.45 -42.48 84.39 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.254 0 N-CA-C 108.681 -0.859 . . . . 0.88 108.681 175.983 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -57.44 -35.69 70.44 Favored 'General case' 0 CA--C 1.532 0.266 0 CA-C-N 118.445 0.566 . . . . 1.97 111.515 -177.73 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 CA--C 1.532 0.253 0 C-N-CA 123.509 0.724 . . . . 2.09 109.416 179.263 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 N--CA 1.454 -0.271 0 CA-C-O 120.874 0.368 . . . . 3.03 110.312 . . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 15' ' ' ILE . . . . . 0.456 HD12 ' CE1' ' A' ' 75' ' ' HIS . 0.4 OUTLIER -66.91 -31.59 54.14 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.336 0 O-C-N 121.265 -0.897 . . . . 0.67 111.849 -176.933 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 2.5 t-160 -63.32 -57.64 9.74 Favored 'General case' 0 N--CA 1.45 -0.46 0 N-CA-C 106.878 -1.527 . . . . 0.77 106.878 -179.411 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 42.4 mt-10 -57.88 -32.51 67.77 Favored 'General case' 0 N--CA 1.446 -0.641 0 C-N-CA 124.573 1.149 . . . . 2.96 110.552 177.408 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 4.3 t80 -55.95 -49.75 72.67 Favored 'General case' 0 C--N 1.332 -0.161 0 CA-C-N 120.388 1.449 . . . . 3.21 110.02 174.481 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -51.95 -47.11 54.74 Favored Glycine 0 CA--C 1.526 0.749 0 N-CA-C 111.308 -0.717 . . . . 0.76 111.308 173.499 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 3.4 t-80 -65.89 -50.66 63.68 Favored 'General case' 0 N--CA 1.452 -0.348 0 O-C-N 121.608 -0.936 . . . . 1.96 111.69 -174.374 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -57.54 -31.2 65.86 Favored 'General case' 0 N--CA 1.446 -0.647 0 C-N-CA 124.672 1.189 . . . . 0.68 109.624 -179.184 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 71.4 t -67.69 -45.84 83.9 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.238 0 C-N-CA 118.663 -1.215 . . . . 1.05 110.944 173.439 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 2.2 t70 . . . . . 0 C--N 1.329 -0.315 0 CA-C-O 121.136 0.494 . . . . 2.18 111.57 175.217 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 19.7 t70 . . . . . 0 N--CA 1.464 0.26 0 N-CA-C 110.367 -0.235 . . . . 2.14 110.367 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 2.3 mm -45.52 -49.04 4.0 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.546 0 CA-C-O 122.749 1.262 . . . . 0.62 109.671 169.277 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 28.7 t80 -65.76 -28.36 68.97 Favored 'General case' 0 N--CA 1.452 -0.356 0 O-C-N 120.397 -1.439 . . . . 0.45 112.386 -179.754 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 49' ' ' LYS . . . . . 0.458 ' HA ' ' HE2' ' A' ' 49' ' ' LYS . 0.6 OUTLIER -65.04 -55.29 19.78 Favored 'General case' 0 N--CA 1.454 -0.263 0 O-C-N 120.049 -1.657 . . . . 0.92 109.801 174.764 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 6.4 mm-40 -74.0 -70.74 0.37 Allowed 'General case' 0 N--CA 1.451 -0.421 0 N-CA-C 108.687 -0.857 . . . . 2.24 108.687 -173.337 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 51' ' ' GLU . . . . . 0.546 ' OE2' ' HE2' ' A' ' 91' ' ' LYS . 18.5 mp0 -70.21 -31.36 68.75 Favored 'General case' 0 C--O 1.235 0.32 0 O-C-N 121.544 -0.722 . . . . 2.56 110.693 -171.577 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 52' ' ' GLY . . . . . 0.451 ' HA2' ' CD1' ' A' ' 66' ' ' PHE . . . -69.92 35.96 0.39 Allowed Glycine 0 CA--C 1.53 1.0 0 C-N-CA 124.59 1.09 . . . . 0.3 114.155 170.341 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 33.2 p -142.39 20.14 2.05 Favored 'General case' 0 N--CA 1.449 -0.517 0 O-C-N 120.81 -1.406 . . . . 2.01 111.535 157.915 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -134.04 -35.16 0.96 Allowed 'General case' 0 C--N 1.342 0.24 0 N-CA-C 112.871 0.693 . . . . 2.58 112.871 -171.629 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 29.4 mt -61.89 -39.18 91.06 Favored 'General case' 0 N--CA 1.465 0.293 0 CA-C-N 119.302 0.955 . . . . 0.41 110.927 -175.817 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 1.2 t 178.2 173.65 0.62 Allowed 'General case' 0 CA--C 1.531 0.233 0 C-N-CA 125.463 1.505 . . . . 0.5 107.564 -179.146 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 14.7 m -58.64 -36.39 74.02 Favored 'General case' 0 N--CA 1.453 -0.306 0 O-C-N 121.712 -0.617 . . . . 0.92 110.819 168.526 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -68.54 -12.43 61.26 Favored 'General case' 0 N--CA 1.467 0.381 0 CA-C-N 118.401 0.546 . . . . 1.02 112.191 175.001 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -86.45 -4.98 82.82 Favored Glycine 0 N--CA 1.444 -0.783 0 CA-C-O 118.596 -1.113 . . . . 0.36 110.927 173.047 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -120.4 1.95 10.74 Favored 'General case' 0 CA--C 1.529 0.169 0 CA-C-N 119.402 1.601 . . . . 3.16 112.129 -178.447 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 14.9 p -76.18 -145.99 0.03 OUTLIER 'General case' 0 CA--C 1.539 0.543 0 N-CA-C 108.605 -0.887 . . . . 0.79 108.605 170.759 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 1.6 m120 -58.16 149.57 23.53 Favored 'General case' 0 C--N 1.34 0.19 0 CA-C-N 120.532 1.515 . . . . 1.75 109.087 177.224 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -58.55 -34.42 71.0 Favored 'General case' 0 CA--C 1.533 0.317 0 CA-C-O 121.739 0.78 . . . . 2.89 110.366 178.479 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -59.31 -34.0 71.78 Favored 'General case' 0 N--CA 1.451 -0.42 0 O-C-N 121.536 -0.728 . . . . 0.52 112.922 175.277 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 12.5 mt-10 -74.19 -42.62 59.54 Favored 'General case' 0 N--CA 1.45 -0.427 0 O-C-N 121.278 -0.889 . . . . 1.85 110.408 174.932 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 66' ' ' PHE . . . . . 0.451 ' CD1' ' HA2' ' A' ' 52' ' ' GLY . 57.9 t80 -49.91 -50.45 46.1 Favored 'General case' 0 N--CA 1.455 -0.206 0 C-N-CA 123.173 0.589 . . . . 0.47 111.115 173.709 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 76.3 t80 -63.42 -42.44 98.72 Favored 'General case' 0 CA--C 1.537 0.448 0 O-C-N 121.589 -0.694 . . . . 0.6 111.28 178.291 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -70.97 -39.55 72.47 Favored 'General case' 0 CA--C 1.535 0.396 0 O-C-N 121.095 -1.003 . . . . 0.42 111.802 -172.616 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -76.71 -31.72 57.37 Favored 'General case' 0 N--CA 1.449 -0.484 0 O-C-N 121.281 -0.887 . . . . 3.27 109.232 179.121 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -55.02 -47.28 74.92 Favored 'General case' 0 C--O 1.222 -0.355 0 O-C-N 121.684 -0.635 . . . . 0.5 109.394 167.944 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -50.47 -47.41 57.03 Favored 'General case' 0 N--CA 1.468 0.442 0 CA-C-N 119.289 0.95 . . . . 3.54 112.212 172.098 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 49.5 ttp85 -53.35 -52.17 60.1 Favored 'General case' 0 CA--C 1.534 0.345 0 CA-C-N 118.71 0.687 . . . . 3.03 109.95 176.659 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 73' ' ' LEU . . . . . 0.576 ' CB ' HG21 ' A' ' 85' ' ' VAL . 0.2 OUTLIER -71.44 -25.36 62.28 Favored 'General case' 0 C--N 1.327 -0.372 0 C-N-CA 123.88 0.872 . . . . 0.59 111.717 -173.888 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 38.9 mmm -62.16 -39.74 93.67 Favored 'General case' 0 C--O 1.234 0.265 0 C-N-CA 124.751 1.22 . . . . 3.09 110.537 178.829 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 75' ' ' HIS . . . . . 0.456 ' CE1' HD12 ' A' ' 15' ' ' ILE . 8.7 p80 -96.87 -8.56 30.58 Favored 'General case' 0 N--CA 1.455 -0.185 0 CA-C-O 116.24 -1.838 . . . . 1.14 113.151 -177.857 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 3.2 m -33.71 119.74 0.39 Allowed 'General case' 0 C--N 1.344 0.343 0 C-N-CA 124.763 1.225 . . . . 1.19 111.089 -170.476 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 1.3 p -51.02 -42.26 60.32 Favored 'General case' 0 N--CA 1.45 -0.43 0 CA-C-N 113.481 -1.691 . . . . 1.21 108.863 -177.938 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 78' ' ' ASP . . . . . 0.483 ' OD2' ' HB3' ' A' ' 80' ' ' ALA . 12.6 t0 -71.4 110.06 5.78 Favored 'General case' 0 N--CA 1.447 -0.613 0 CA-C-O 121.998 0.904 . . . . 1.91 109.344 164.578 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 6.9 p80 -50.41 -37.43 37.76 Favored 'General case' 0 N--CA 1.452 -0.347 0 CA-C-N 115.867 -0.606 . . . . 4.55 111.866 172.719 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 80' ' ' ALA . . . . . 0.483 ' HB3' ' OD2' ' A' ' 78' ' ' ASP . . . -60.17 -47.73 84.69 Favored 'General case' 0 N--CA 1.454 -0.255 0 CA-C-N 118.413 0.551 . . . . 0.83 110.224 -177.327 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 13.6 mt-10 -47.95 -41.29 24.59 Favored 'General case' 0 N--CA 1.453 -0.278 0 C-N-CA 124.057 0.943 . . . . 2.87 111.212 175.748 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 4.2 mtp180 -63.4 -48.16 79.01 Favored 'General case' 0 C--N 1.329 -0.317 0 N-CA-C 108.968 -0.753 . . . . 2.62 108.968 178.623 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 1.5 mm? -62.37 -23.71 66.96 Favored 'General case' 0 N--CA 1.452 -0.334 0 CA-C-O 117.513 -1.232 . . . . 0.67 112.932 175.88 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -63.42 -43.19 98.17 Favored 'General case' 0 N--CA 1.462 0.156 0 CA-C-N 121.678 2.035 . . . . 1.51 108.122 171.407 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 85' ' ' VAL . . . . . 0.576 HG21 ' CB ' ' A' ' 73' ' ' LEU . 86.5 t -62.22 -62.29 1.22 Allowed 'Isoleucine or valine' 0 C--O 1.218 -0.579 0 CA-C-O 117.405 -1.283 . . . . 0.59 110.629 173.696 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 1.9 mt-30 -48.86 -49.78 37.87 Favored 'General case' 0 N--CA 1.464 0.264 0 CA-C-N 120.946 1.703 . . . . 1.95 111.464 -175.628 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 51.9 tttt -55.41 -51.78 65.74 Favored 'General case' 0 N--CA 1.445 -0.707 0 C-N-CA 123.422 0.689 . . . . 2.14 111.138 178.769 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 85.7 m-20 -80.39 -5.79 57.01 Favored 'General case' 0 CA--C 1.531 0.239 0 CA-C-O 119.481 -0.295 . . . . 1.13 111.703 -176.722 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -163.92 68.0 1.57 Allowed Pre-proline 0 N--CA 1.448 -0.545 0 C-N-CA 124.223 1.009 . . . . 0.38 110.418 -167.364 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 59.5 Cg_endo -70.57 0.33 6.41 Favored 'Trans proline' 0 N--CA 1.457 -0.648 0 C-N-CA 123.057 2.504 . . . . 1.7 112.76 -174.629 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 91' ' ' LYS . . . . . 0.546 ' HE2' ' OE2' ' A' ' 51' ' ' GLU . 0.4 OUTLIER -115.81 -41.97 3.15 Favored 'General case' 0 N--CA 1.453 -0.315 0 C-N-CA 125.248 1.419 . . . . 2.95 110.15 -178.812 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 2.5 m -57.6 -44.77 85.66 Favored 'General case' 0 C--O 1.226 -0.14 0 CA-C-N 119.591 1.087 . . . . 0.49 110.74 174.66 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 9.0 t80 -60.64 -48.33 82.28 Favored 'General case' 0 CA--C 1.511 -0.556 0 CA-C-O 121.75 0.786 . . . . 1.96 110.655 179.526 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 30.3 tt0 -54.93 -34.52 63.28 Favored 'General case' 0 N--CA 1.44 -0.936 0 CA-C-N 114.762 -1.108 . . . . 1.57 110.369 177.313 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 5.5 t80 -59.82 -59.65 5.1 Favored 'General case' 0 N--CA 1.454 -0.235 0 C-N-CA 124.363 1.065 . . . . 1.0 110.573 -174.157 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 3.7 mp -60.81 -38.54 79.21 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.231 0 N-CA-C 109.04 -0.726 . . . . 0.91 109.04 176.653 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 4.3 t30 -60.46 -28.67 68.5 Favored 'General case' 0 CA--C 1.533 0.291 0 O-C-N 121.781 -0.575 . . . . 1.41 111.66 -178.965 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.456 -0.146 0 C-N-CA 124.725 1.21 . . . . 2.21 109.076 174.976 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.457 -0.097 0 CA-C-O 121.79 0.805 . . . . 3.38 109.081 . . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER -67.71 -27.69 39.0 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.25 0 O-C-N 121.656 -0.652 . . . . 0.49 111.588 179.316 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 6.6 t60 -60.79 -47.9 84.24 Favored 'General case' 0 CA--C 1.534 0.351 0 N-CA-C 107.369 -1.345 . . . . 0.68 107.369 175.36 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 32.7 mt-10 -59.42 -40.7 87.55 Favored 'General case' 0 CA--C 1.528 0.111 0 O-C-N 121.254 -0.904 . . . . 2.03 111.186 177.439 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 2.4 m-85 -50.73 -47.33 59.31 Favored 'General case' 0 CA--C 1.519 -0.229 0 CA-C-N 118.938 0.79 . . . . 3.44 110.764 173.478 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -48.81 -43.68 30.35 Favored Glycine 0 CA--C 1.533 1.192 0 CA-C-N 118.352 0.524 . . . . 0.79 111.88 176.71 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 58.0 m-70 -62.12 -49.52 75.56 Favored 'General case' 0 C--O 1.226 -0.169 0 O-C-N 121.435 -1.038 . . . . 3.56 111.768 174.481 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -59.17 -27.39 65.64 Favored 'General case' 0 CA--C 1.533 0.319 0 O-C-N 122.043 -0.41 . . . . 0.58 111.214 -178.758 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 71.4 t -68.07 -42.96 85.57 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.19 0 O-C-N 121.029 -1.044 . . . . 1.06 110.477 175.311 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 4.3 m-20 . . . . . 0 N--CA 1.462 0.17 0 N-CA-C 111.747 0.277 . . . . 1.96 111.747 173.489 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 28.8 t0 . . . . . 0 N--CA 1.464 0.249 0 N-CA-C 109.057 -0.719 . . . . 2.29 109.057 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 8.2 mm -52.13 -54.17 15.3 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.413 0 C-N-CA 125.404 1.482 . . . . 0.56 109.5 177.966 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 36.5 t80 -64.0 -24.8 67.85 Favored 'General case' 0 N--CA 1.453 -0.305 0 O-C-N 121.346 -0.847 . . . . 0.51 113.206 178.372 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 49' ' ' LYS . . . . . 0.47 ' CA ' ' HE2' ' A' ' 49' ' ' LYS . 1.0 OUTLIER -66.77 -53.66 30.78 Favored 'General case' 0 N--CA 1.456 -0.168 0 C-N-CA 118.186 -1.406 . . . . 1.08 109.304 -178.85 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -84.49 -59.78 2.27 Favored 'General case' 0 N--CA 1.451 -0.385 0 N-CA-C 108.734 -0.839 . . . . 2.45 108.734 -172.812 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 51' ' ' GLU . . . . . 0.462 ' OE2' ' HE2' ' A' ' 91' ' ' LYS . 18.1 mm-40 -71.15 -31.24 67.45 Favored 'General case' 0 C--O 1.235 0.306 0 O-C-N 122.058 -0.401 . . . . 2.31 110.268 -170.44 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 52' ' ' GLY . . . . . 0.436 ' HA2' ' CD1' ' A' ' 66' ' ' PHE . . . -68.08 40.52 0.26 Allowed Glycine 0 CA--C 1.528 0.864 0 C-N-CA 126.644 2.069 . . . . 0.36 114.464 171.318 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 9.3 p -156.61 34.83 0.31 Allowed 'General case' 0 N--CA 1.449 -0.504 0 O-C-N 120.806 -1.409 . . . . 1.5 109.901 155.725 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 35.9 t-20 -135.6 -46.83 0.68 Allowed 'General case' 0 CA--C 1.521 -0.147 0 O-C-N 122.174 -0.329 . . . . 1.65 111.722 -169.74 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 55' ' ' LEU . . . . . 0.525 HD21 ' HB2' ' A' ' 89' ' ' ALA . 17.8 mt -55.85 -40.47 72.91 Favored 'General case' 0 CA--C 1.53 0.18 0 CA-C-O 120.825 0.345 . . . . 0.47 111.196 -178.873 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 2.8 t 178.07 173.76 0.6 Allowed 'General case' 0 CA--C 1.533 0.301 0 C-N-CA 125.67 1.588 . . . . 0.57 107.766 -174.483 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 9.6 p -61.75 -36.29 80.59 Favored 'General case' 0 N--CA 1.456 -0.173 0 C-N-CA 123.499 0.72 . . . . 2.57 109.959 170.307 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -62.16 -14.4 36.94 Favored 'General case' 0 CA--C 1.537 0.446 0 N-CA-C 112.332 0.493 . . . . 1.13 112.332 174.342 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -87.12 -13.25 66.52 Favored Glycine 0 N--CA 1.446 -0.693 0 CA-C-O 118.802 -0.999 . . . . 0.39 111.603 177.649 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 71.5 ttt-85 -101.94 -17.7 16.01 Favored 'General case' 0 N--CA 1.461 0.077 0 CA-C-N 119.23 1.515 . . . . 2.29 112.252 176.985 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 1.4 p -60.01 -170.01 0.01 OUTLIER 'General case' 0 CA--C 1.538 0.489 0 C-N-CA 123.064 0.546 . . . . 0.89 110.529 168.736 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 83.6 m-20 -48.89 148.28 2.32 Favored 'General case' 0 N--CA 1.464 0.227 0 O-C-N 121.428 -0.795 . . . . 2.22 110.529 -174.751 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -60.34 -31.23 70.11 Favored 'General case' 0 C--O 1.224 -0.273 0 C-N-CA 120.526 -0.47 . . . . 2.93 110.7 -174.056 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -54.64 -38.35 66.76 Favored 'General case' 0 N--CA 1.453 -0.297 0 N-CA-C 113.013 0.745 . . . . 0.45 113.013 173.675 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 1.6 mt-10 -74.56 -44.79 49.3 Favored 'General case' 0 CA--C 1.505 -0.784 0 CA-C-O 118.622 -0.704 . . . . 2.22 110.148 178.569 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 66' ' ' PHE . . . . . 0.436 ' CD1' ' HA2' ' A' ' 52' ' ' GLY . 49.1 t80 -50.22 -47.33 54.93 Favored 'General case' 0 N--CA 1.45 -0.457 0 O-C-N 123.896 0.748 . . . . 0.34 111.594 174.397 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 67' ' ' PHE . . . . . 0.427 ' O ' ' HB3' ' A' ' 70' ' ' ALA . 76.8 t80 -64.75 -45.01 88.21 Favored 'General case' 0 N--CA 1.452 -0.327 0 O-C-N 121.421 -0.799 . . . . 0.38 110.355 175.605 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -64.83 -54.44 31.0 Favored 'General case' 0 CA--C 1.537 0.456 0 O-C-N 121.446 -0.784 . . . . 0.36 112.619 -172.023 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -55.1 -36.62 65.88 Favored 'General case' 0 N--CA 1.456 -0.126 0 C-N-CA 124.207 1.003 . . . . 3.59 111.071 169.534 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 70' ' ' ALA . . . . . 0.427 ' HB3' ' O ' ' A' ' 67' ' ' PHE . . . -53.18 -52.12 59.87 Favored 'General case' 0 C--O 1.22 -0.496 0 CA-C-N 118.913 0.779 . . . . 0.46 109.644 170.635 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 4.7 t80 -51.71 -49.81 61.73 Favored 'General case' 0 C--O 1.233 0.209 0 CA-C-N 119.764 1.165 . . . . 2.53 111.682 179.981 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 25.1 ttt180 -46.89 -58.66 3.71 Favored 'General case' 0 CA--C 1.536 0.434 0 CA-C-N 118.005 0.366 . . . . 1.88 110.341 172.389 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 73' ' ' LEU . . . . . 0.589 HD12 ' CG2' ' A' ' 85' ' ' VAL . 0.1 OUTLIER -67.31 -33.24 74.85 Favored 'General case' 0 C--N 1.329 -0.293 0 C-N-CA 123.607 0.763 . . . . 0.46 110.565 -170.317 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 74' ' ' MET . . . . . 0.558 ' CE ' HG11 ' A' ' 85' ' ' VAL . 0.0 OUTLIER -61.5 -39.74 92.08 Favored 'General case' 0 CA--C 1.52 -0.199 0 C-N-CA 124.853 1.261 . . . . 6.34 109.939 -178.865 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 14.1 p80 -88.45 -33.29 17.9 Favored 'General case' 0 N--CA 1.453 -0.294 0 CA-C-O 116.702 -1.618 . . . . 1.05 110.991 -177.458 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 17.5 m -14.45 116.62 0.02 OUTLIER 'General case' 0 C--N 1.345 0.403 0 C-N-CA 128.561 2.744 . . . . 1.13 113.537 -167.204 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 7.7 p -45.29 -44.37 11.38 Favored 'General case' 0 N--CA 1.452 -0.365 0 C-N-CA 126.172 1.789 . . . . 1.21 110.017 -179.657 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 11.0 t0 -70.68 108.2 4.29 Favored 'General case' 0 N--CA 1.447 -0.624 0 CA-C-O 121.822 0.82 . . . . 2.03 109.614 168.054 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 57.8 m80 -52.27 -32.68 38.35 Favored 'General case' 0 N--CA 1.456 -0.155 0 CA-C-N 115.936 -0.574 . . . . 5.86 111.519 174.676 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -61.64 -51.19 69.49 Favored 'General case' 0 N--CA 1.449 -0.478 0 CA-C-O 118.325 -0.845 . . . . 0.81 110.37 177.935 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 1.9 mt-10 -47.26 -40.92 17.63 Favored 'General case' 0 N--CA 1.464 0.264 0 CA-C-N 119.331 0.969 . . . . 3.03 110.419 178.049 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -62.91 -52.57 62.53 Favored 'General case' 0 CA--C 1.515 -0.386 0 C-N-CA 120.108 -0.637 . . . . 3.13 110.145 178.581 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -61.98 -24.59 67.11 Favored 'General case' 0 N--CA 1.453 -0.319 0 CA-C-O 117.49 -1.243 . . . . 0.5 112.677 177.491 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 1.1 mptm? -61.29 -42.46 98.69 Favored 'General case' 0 C--O 1.225 -0.232 0 CA-C-N 121.166 1.803 . . . . 1.27 107.567 172.517 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 85' ' ' VAL . . . . . 0.589 ' CG2' HD12 ' A' ' 73' ' ' LEU . 93.0 t -69.26 -55.36 15.62 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.473 0 CA-C-O 118.21 -0.9 . . . . 0.43 112.308 176.19 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -50.8 -41.38 57.16 Favored 'General case' 0 CA--C 1.531 0.243 0 CA-C-N 120.676 1.58 . . . . 2.16 111.237 -178.013 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 34.9 tttt -62.88 -60.62 3.22 Favored 'General case' 0 N--CA 1.448 -0.54 0 C-N-CA 124.747 1.219 . . . . 1.94 110.919 175.67 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 3.0 m120 -76.7 0.34 20.78 Favored 'General case' 0 CA--C 1.53 0.187 0 C-N-CA 123.539 0.735 . . . . 1.21 112.075 -174.069 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 89' ' ' ALA . . . . . 0.525 ' HB2' HD21 ' A' ' 55' ' ' LEU . . . -158.33 68.58 3.68 Favored Pre-proline 0 N--CA 1.448 -0.53 0 C-N-CA 124.443 1.097 . . . . 0.53 108.7 -171.434 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 89.2 Cg_endo -80.3 56.64 6.15 Favored 'Trans proline' 0 CA--C 1.536 0.58 0 C-N-CA 124.378 3.386 . . . . 2.0 110.568 -173.3 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 91' ' ' LYS . . . . . 0.462 ' HE2' ' OE2' ' A' ' 51' ' ' GLU . 0.0 OUTLIER 176.18 -53.76 0.01 OUTLIER 'General case' 0 C--O 1.227 -0.127 0 C-N-CA 126.681 1.992 . . . . 2.6 109.669 -168.626 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 2.7 m -55.19 -46.51 75.84 Favored 'General case' 0 CA--C 1.518 -0.272 0 CA-C-N 118.855 0.752 . . . . 0.39 110.486 179.138 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 3.0 t80 -57.76 -49.02 77.97 Favored 'General case' 0 CA--C 1.506 -0.72 0 N-CA-C 109.677 -0.49 . . . . 2.27 109.677 178.246 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 3.8 tt0 -53.92 -33.78 57.67 Favored 'General case' 0 N--CA 1.443 -0.789 0 O-C-N 124.072 0.857 . . . . 2.25 110.694 -177.631 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 4.6 t80 -60.56 -56.25 23.56 Favored 'General case' 0 CA--C 1.529 0.173 0 C-N-CA 123.355 0.662 . . . . 0.92 109.945 -175.865 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 2.3 mp -61.67 -41.28 89.79 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.293 0 N-CA-C 108.853 -0.795 . . . . 0.91 108.853 176.817 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 11.7 t30 -58.7 -36.34 74.08 Favored 'General case' 0 CA--C 1.533 0.304 0 C-N-CA 123.143 0.577 . . . . 1.69 110.953 -175.896 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 CA--C 1.529 0.171 0 C-N-CA 126.588 1.955 . . . . 2.73 109.128 175.865 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 CA--C 1.528 0.124 0 CA-C-O 121.42 0.629 . . . . 3.56 110.82 . . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 1.1 pt -70.67 -27.14 29.85 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.283 0 O-C-N 121.613 -0.679 . . . . 0.81 112.479 -178.322 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 1.1 t-160 -58.31 -57.76 11.48 Favored 'General case' 0 CA--C 1.529 0.163 0 N-CA-C 105.894 -1.891 . . . . 0.62 105.894 174.015 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 43.5 mt-10 -55.4 -43.35 75.14 Favored 'General case' 0 N--CA 1.456 -0.158 0 C-N-CA 123.967 0.907 . . . . 2.47 110.663 -178.859 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 16.1 t80 -53.53 -51.49 62.67 Favored 'General case' 0 N--CA 1.455 -0.176 0 C-N-CA 123.493 0.717 . . . . 2.23 110.533 177.273 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -48.64 -43.56 29.02 Favored Glycine 0 CA--C 1.525 0.676 0 N-CA-C 111.347 -0.701 . . . . 0.73 111.347 174.889 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 20' ' ' HIS . . . . . 0.435 ' CE1' ' HB1' ' A' ' 64' ' ' ALA . 3.5 t-80 -61.18 -48.94 79.22 Favored 'General case' 0 N--CA 1.45 -0.466 0 O-C-N 121.967 -0.726 . . . . 1.86 111.047 178.299 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -58.63 -32.41 69.01 Favored 'General case' 0 N--CA 1.454 -0.232 0 CA-C-N 118.279 0.49 . . . . 1.19 110.346 177.802 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 41.4 t -67.6 -33.83 64.46 Favored 'Isoleucine or valine' 0 N--CA 1.46 0.059 0 O-C-N 121.256 -0.902 . . . . 1.21 111.537 179.13 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 12.1 t0 . . . . . 0 CA--C 1.533 0.295 0 CA-C-O 122.082 0.944 . . . . 1.96 110.688 174.309 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 19.8 t70 . . . . . 0 N--CA 1.465 0.319 0 CA-C-O 120.72 0.295 . . . . 2.11 110.784 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 5.9 mm -56.53 -46.49 82.45 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.315 0 CA-C-O 122.943 1.354 . . . . 0.69 109.102 175.873 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 24.7 t80 -63.62 -23.14 67.26 Favored 'General case' 0 N--CA 1.451 -0.401 0 O-C-N 120.561 -1.337 . . . . 0.59 112.187 177.085 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 49' ' ' LYS . . . . . 0.485 ' HA ' ' CE ' ' A' ' 49' ' ' LYS . 0.9 OUTLIER -71.85 -48.96 42.38 Favored 'General case' 0 N--CA 1.448 -0.549 0 O-C-N 120.053 -1.655 . . . . 1.43 110.343 -179.653 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 21.8 tp10 -90.31 -55.82 3.45 Favored 'General case' 0 C--N 1.331 -0.208 0 O-C-N 123.541 0.526 . . . . 2.48 109.619 -173.04 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 33.0 mp0 -75.67 -28.43 58.7 Favored 'General case' 0 C--O 1.236 0.359 0 O-C-N 121.25 -0.906 . . . . 2.6 110.904 -176.261 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 52' ' ' GLY . . . . . 0.475 ' HA2' ' CD1' ' A' ' 66' ' ' PHE . . . -70.92 45.72 0.71 Allowed Glycine 0 CA--C 1.531 1.055 0 C-N-CA 125.805 1.669 . . . . 0.38 114.843 169.935 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 46.8 t -162.66 46.13 0.14 Allowed 'General case' 0 N--CA 1.449 -0.476 0 N-CA-C 107.182 -1.414 . . . . 2.07 107.182 157.636 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 4.8 t-20 -147.45 -50.85 0.19 Allowed 'General case' 0 CA--C 1.519 -0.243 0 N-CA-C 111.746 0.276 . . . . 1.49 111.746 -170.116 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 28.0 mt -59.97 -37.07 78.55 Favored 'General case' 0 N--CA 1.462 0.14 0 CA-C-O 120.885 0.374 . . . . 0.46 111.048 -176.907 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -178.0 170.52 1.85 Allowed 'General case' 0 C--N 1.33 -0.277 0 N-CA-C 107.81 -1.181 . . . . 0.43 107.81 -175.982 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 11.6 t -63.02 -35.23 79.52 Favored 'General case' 0 CA--C 1.533 0.312 0 C-N-CA 123.195 0.598 . . . . 1.99 109.713 170.184 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -67.1 -9.52 40.43 Favored 'General case' 0 N--CA 1.466 0.342 0 O-C-N 121.737 -0.602 . . . . 1.23 112.237 172.811 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -85.58 -5.08 84.94 Favored Glycine 0 C--O 1.22 -0.745 0 CA-C-O 118.797 -1.002 . . . . 0.51 111.287 173.195 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -114.11 -16.66 12.07 Favored 'General case' 0 C--N 1.334 -0.07 0 CA-C-N 119.291 1.546 . . . . 2.71 112.239 -175.583 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 24.1 p -64.45 -149.72 0.01 OUTLIER 'General case' 0 CA--C 1.54 0.565 0 C-N-CA 125.629 1.571 . . . . 0.93 109.881 176.299 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 15.9 m120 -58.3 143.8 43.48 Favored 'General case' 0 N--CA 1.455 -0.184 0 O-C-N 119.298 -2.126 . . . . 2.96 109.212 177.307 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 66.3 tt0 -56.55 -29.03 61.5 Favored 'General case' 0 CA--C 1.534 0.335 0 CA-C-O 121.785 0.802 . . . . 3.11 111.466 -178.52 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 64' ' ' ALA . . . . . 0.435 ' HB1' ' CE1' ' A' ' 20' ' ' HIS . . . -60.23 -39.82 88.03 Favored 'General case' 0 N--CA 1.449 -0.49 0 C-N-CA 123.349 0.659 . . . . 0.72 112.224 175.126 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 9.6 mt-10 -70.91 -42.0 70.52 Favored 'General case' 0 N--CA 1.451 -0.384 0 O-C-N 121.365 -0.834 . . . . 2.37 110.757 176.443 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 66' ' ' PHE . . . . . 0.475 ' CD1' ' HA2' ' A' ' 52' ' ' GLY . 49.8 t80 -49.98 -52.5 33.32 Favored 'General case' 0 N--CA 1.454 -0.23 0 C-N-CA 122.858 0.463 . . . . 0.53 110.861 174.753 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 75.9 t80 -60.92 -41.81 96.88 Favored 'General case' 0 CA--C 1.534 0.346 0 C-N-CA 122.508 0.323 . . . . 0.77 110.827 177.716 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -63.95 -45.67 88.14 Favored 'General case' 0 CA--C 1.54 0.577 0 O-C-N 121.209 -0.932 . . . . 0.49 111.838 -176.109 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 18.8 mm-40 -58.42 -43.9 88.84 Favored 'General case' 0 CA--C 1.521 -0.143 0 C-N-CA 124.447 1.099 . . . . 4.28 110.187 171.38 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -52.07 -54.5 29.54 Favored 'General case' 0 N--CA 1.454 -0.257 0 N-CA-C 108.359 -0.978 . . . . 0.42 108.359 178.021 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 39.4 t80 -50.45 -51.13 49.58 Favored 'General case' 0 N--CA 1.456 -0.173 0 C-N-CA 123.551 0.74 . . . . 2.15 111.986 179.616 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 13.6 ttt180 -47.55 -57.93 4.84 Favored 'General case' 0 CA--C 1.534 0.354 0 CA-C-N 118.62 0.646 . . . . 2.05 110.094 176.154 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 73' ' ' LEU . . . . . 0.626 HD12 HG23 ' A' ' 85' ' ' VAL . 0.1 OUTLIER -67.4 -24.47 65.67 Favored 'General case' 0 C--O 1.222 -0.355 0 C-N-CA 125.132 1.373 . . . . 0.61 110.984 -172.505 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 74' ' ' MET . . . . . 0.442 ' HG3' HG21 ' A' ' 96' ' ' ILE . 33.4 mmt -57.0 -45.72 82.8 Favored 'General case' 0 N--CA 1.468 0.437 0 CA-C-N 119.041 0.837 . . . . 5.59 111.486 178.409 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 6.6 p80 -95.94 -29.36 14.21 Favored 'General case' 0 C--N 1.334 -0.102 0 CA-C-O 116.388 -1.768 . . . . 2.68 113.556 -175.589 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 81.3 p -13.18 117.08 0.02 OUTLIER 'General case' 0 C--N 1.344 0.337 0 C-N-CA 127.87 2.468 . . . . 2.18 113.672 -173.047 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 1.9 p -44.93 -42.39 8.07 Favored 'General case' 0 C--N 1.33 -0.276 0 C-N-CA 125.173 1.389 . . . . 1.14 110.87 176.994 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 11.1 t0 -66.98 103.03 1.06 Allowed 'General case' 0 N--CA 1.452 -0.374 0 N-CA-C 108.857 -0.794 . . . . 2.32 108.857 166.206 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 4.6 t-80 -59.87 -23.05 63.11 Favored 'General case' 0 CA--C 1.531 0.237 0 O-C-N 121.522 -0.736 . . . . 5.71 111.679 179.896 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -66.09 -46.17 78.63 Favored 'General case' 0 N--CA 1.451 -0.41 0 CA-C-O 118.525 -0.75 . . . . 0.78 110.918 176.493 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 1.1 mt-10 -47.77 -38.85 16.46 Favored 'General case' 0 N--CA 1.465 0.306 0 CA-C-N 119.025 0.829 . . . . 3.25 109.908 177.655 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 11.3 mtp180 -62.19 -54.54 39.52 Favored 'General case' 0 CA--C 1.517 -0.32 0 N-CA-C 108.822 -0.807 . . . . 2.65 108.822 -178.439 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 1.5 mm? -65.36 -19.08 65.79 Favored 'General case' 0 N--CA 1.451 -0.409 0 CA-C-O 118.095 -0.955 . . . . 0.61 112.726 178.2 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 24.3 mttt -68.73 -43.6 75.59 Favored 'General case' 0 CA--C 1.517 -0.302 0 CA-C-N 120.885 1.675 . . . . 1.57 108.317 172.351 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 85' ' ' VAL . . . . . 0.626 HG23 HD12 ' A' ' 73' ' ' LEU . 92.8 t -61.23 -62.34 1.16 Allowed 'Isoleucine or valine' 0 C--O 1.217 -0.633 0 CA-C-O 118.413 -0.803 . . . . 0.37 109.893 171.584 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -50.09 -46.13 53.27 Favored 'General case' 0 C--O 1.224 -0.249 0 CA-C-N 120.213 1.37 . . . . 2.34 112.082 -175.084 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 41.7 tttt -58.91 -53.37 59.18 Favored 'General case' 0 N--CA 1.448 -0.529 0 O-C-N 121.459 -0.776 . . . . 2.13 110.879 177.299 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 64.4 m-20 -79.82 -7.15 58.52 Favored 'General case' 0 C--N 1.33 -0.258 0 C-N-CA 122.386 0.274 . . . . 0.91 111.486 -174.449 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -164.88 62.94 0.96 Allowed Pre-proline 0 N--CA 1.447 -0.576 0 C-N-CA 124.558 1.143 . . . . 0.52 109.624 -163.709 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 20.8 Cg_endo -57.6 -41.13 74.4 Favored 'Trans proline' 0 N--CA 1.454 -0.813 0 C-N-CA 122.54 2.16 . . . . 2.58 109.884 -173.123 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 1.2 ptpt -74.29 -43.13 58.11 Favored 'General case' 0 N--CA 1.453 -0.325 0 C-N-CA 126.584 1.954 . . . . 2.32 113.222 -178.789 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 3.7 m -59.04 -45.74 89.99 Favored 'General case' 0 CA--C 1.517 -0.296 0 CA-C-N 119.924 1.238 . . . . 0.4 110.048 179.967 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 2.5 t80 -59.27 -46.39 88.65 Favored 'General case' 0 CA--C 1.512 -0.502 0 C-N-CA 120.123 -0.631 . . . . 1.92 110.162 175.577 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 2.8 tt0 -52.36 -32.72 39.75 Favored 'General case' 0 N--CA 1.448 -0.552 0 CA-C-N 115.532 -0.758 . . . . 1.6 111.066 179.942 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 2.3 t80 -58.15 -62.56 1.74 Allowed 'General case' 0 N--CA 1.456 -0.166 0 C-N-CA 124.091 0.956 . . . . 1.21 110.191 -178.269 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 96' ' ' ILE . . . . . 0.442 HG21 ' HG3' ' A' ' 74' ' ' MET . 3.5 mp -63.05 -36.08 74.35 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.286 0 N-CA-C 109.218 -0.66 . . . . 1.11 109.218 -179.762 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 7.3 t-20 -57.96 -39.0 77.05 Favored 'General case' 0 CA--C 1.536 0.426 0 CA-C-N 117.953 0.342 . . . . 2.11 110.743 -179.486 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 6.9 t0 . . . . . 0 N--CA 1.463 0.197 0 C-N-CA 125.225 1.41 . . . . 2.19 110.141 177.327 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 2.9 t80 . . . . . 0 N--CA 1.454 -0.273 0 CA-C-O 121.078 0.466 . . . . 2.85 110.699 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 0.7 OUTLIER -67.26 -36.31 76.36 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.499 0 O-C-N 121.229 -0.919 . . . . 0.61 112.184 -178.859 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 3.0 t60 -57.34 -53.7 55.1 Favored 'General case' 0 CA--C 1.531 0.213 0 N-CA-C 107.228 -1.397 . . . . 0.87 107.228 176.383 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 45.8 mt-10 -64.99 -32.21 73.82 Favored 'General case' 0 N--CA 1.449 -0.487 0 C-N-CA 125.105 1.362 . . . . 2.36 111.131 -175.333 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 1.1 m-85 -54.39 -53.84 48.66 Favored 'General case' 0 CA--C 1.517 -0.318 0 CA-C-N 119.56 1.073 . . . . 2.91 110.129 167.762 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -49.76 -47.91 37.65 Favored Glycine 0 CA--C 1.526 0.742 0 N-CA-C 110.825 -0.91 . . . . 0.69 110.825 176.857 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 15.9 t-80 -62.28 -43.7 98.21 Favored 'General case' 0 N--CA 1.447 -0.592 0 O-C-N 122.058 -0.672 . . . . 1.99 112.017 -178.661 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -61.84 -32.28 72.6 Favored 'General case' 0 N--CA 1.451 -0.394 0 N-CA-C 109.224 -0.658 . . . . 0.91 109.224 -178.863 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 84.8 t -71.46 -40.83 72.75 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.164 0 C-N-CA 119.314 -0.954 . . . . 1.0 111.086 176.967 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 15.1 t0 . . . . . 0 C--N 1.328 -0.338 0 CA-C-O 121.807 0.813 . . . . 1.97 110.981 172.182 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 30.3 t70 . . . . . 0 N--CA 1.465 0.289 0 CA-C-O 122.057 0.932 . . . . 2.38 110.232 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 3.4 mm -52.06 -51.2 31.62 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.19 0 C-N-CA 124.739 1.216 . . . . 0.64 109.932 175.948 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 25.7 t80 -61.29 -32.74 72.58 Favored 'General case' 0 C--O 1.224 -0.268 0 O-C-N 121.781 -0.575 . . . . 0.89 111.895 175.88 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 49' ' ' LYS . . . . . 0.461 ' HA ' ' HE2' ' A' ' 49' ' ' LYS . 7.6 mmpt? -67.74 -44.05 78.48 Favored 'General case' 0 N--CA 1.451 -0.403 0 O-C-N 120.544 -1.347 . . . . 1.39 110.728 -176.668 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 18.5 mm-40 -82.31 -64.67 1.13 Allowed 'General case' 0 CA--C 1.532 0.274 0 CA-C-O 122.294 1.045 . . . . 3.09 109.749 -179.738 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 21.1 mm-40 -74.18 -28.28 61.21 Favored 'General case' 0 C--O 1.235 0.338 0 C-N-CA 123.281 0.632 . . . . 2.22 110.829 -169.084 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 52' ' ' GLY . . . . . 0.403 ' HA2' ' CD1' ' A' ' 66' ' ' PHE . . . -71.46 38.21 0.58 Allowed Glycine 0 CA--C 1.533 1.165 0 C-N-CA 124.295 0.95 . . . . 0.39 113.287 170.184 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -148.61 33.16 0.78 Allowed 'General case' 0 N--CA 1.451 -0.414 0 C-N-CA 124.518 1.127 . . . . 2.53 108.75 163.195 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 11.3 t-20 -144.37 -43.27 0.25 Allowed 'General case' 0 C--N 1.339 0.14 0 N-CA-C 112.331 0.493 . . . . 1.65 112.331 -169.402 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 18.6 mt -62.64 -36.5 83.0 Favored 'General case' 0 N--CA 1.462 0.133 0 O-C-N 121.753 -0.592 . . . . 0.46 111.239 -176.347 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER 175.06 169.84 0.29 Allowed 'General case' 0 CA--C 1.531 0.23 0 C-N-CA 125.989 1.716 . . . . 0.67 107.48 -177.338 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 14.5 m -61.13 -36.46 79.81 Favored 'General case' 0 N--CA 1.455 -0.2 0 C-N-CA 123.092 0.557 . . . . 1.22 110.557 169.497 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 1.6 m-85 -68.08 -9.23 44.57 Favored 'General case' 0 N--CA 1.466 0.34 0 O-C-N 121.927 -0.483 . . . . 2.23 112.182 173.473 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -90.25 2.41 81.15 Favored Glycine 0 N--CA 1.443 -0.845 0 CA-C-O 118.828 -0.985 . . . . 0.44 111.06 173.54 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 3.2 tmt_? -125.91 -13.79 6.26 Favored 'General case' 0 C--O 1.226 -0.136 0 CA-C-N 119.157 1.479 . . . . 2.52 112.925 -176.888 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 3.6 p -59.67 -104.09 0.0 OUTLIER 'General case' 0 C--N 1.333 -0.148 0 C-N-CA 126.656 1.982 . . . . 1.47 110.583 177.175 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 4.5 t30 -93.53 152.23 19.19 Favored 'General case' 0 N--CA 1.45 -0.462 0 N-CA-C 107.681 -1.229 . . . . 2.08 107.681 175.594 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 1.6 tm-20 -58.58 -35.72 72.85 Favored 'General case' 0 CA--C 1.532 0.271 0 CA-C-O 121.422 0.629 . . . . 3.48 109.737 176.205 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -61.43 -31.64 71.58 Favored 'General case' 0 N--CA 1.453 -0.298 0 N-CA-C 113.785 1.032 . . . . 0.68 113.785 176.315 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 10.0 mt-10 -76.47 -41.16 48.19 Favored 'General case' 0 CA--C 1.513 -0.446 0 O-C-N 121.546 -0.721 . . . . 2.25 109.534 176.548 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 66' ' ' PHE . . . . . 0.403 ' CD1' ' HA2' ' A' ' 52' ' ' GLY . 49.4 t80 -53.34 -51.63 61.82 Favored 'General case' 0 N--CA 1.451 -0.394 0 C-N-CA 123.027 0.531 . . . . 0.42 111.251 173.804 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 71.2 t80 -64.94 -49.8 68.95 Favored 'General case' 0 N--CA 1.45 -0.468 0 C-N-CA 122.768 0.427 . . . . 0.46 110.425 -178.283 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -60.11 -47.52 85.54 Favored 'General case' 0 CA--C 1.54 0.581 0 O-C-N 121.607 -0.683 . . . . 0.39 112.274 -177.347 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 6.2 mm-40 -59.68 -41.54 90.9 Favored 'General case' 0 C--N 1.332 -0.167 0 C-N-CA 124.425 1.09 . . . . 4.43 110.468 172.823 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -58.28 -41.84 85.23 Favored 'General case' 0 N--CA 1.453 -0.301 0 O-C-N 121.413 -0.804 . . . . 0.39 109.373 179.67 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -54.59 -52.37 62.35 Favored 'General case' 0 C--O 1.232 0.149 0 C-N-CA 124.678 1.191 . . . . 3.21 111.488 172.016 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 7.6 ttt180 -48.58 -61.35 2.07 Favored 'General case' 0 CA--C 1.529 0.173 0 N-CA-C 109.432 -0.581 . . . . 2.32 109.432 177.151 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 73' ' ' LEU . . . . . 0.564 ' CB ' HG21 ' A' ' 85' ' ' VAL . 0.1 OUTLIER -61.06 -28.04 68.78 Favored 'General case' 0 C--N 1.327 -0.411 0 C-N-CA 125.127 1.371 . . . . 0.53 111.233 -176.18 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER -62.64 -40.71 97.87 Favored 'General case' 0 C--O 1.234 0.255 0 CA-C-N 118.745 0.702 . . . . 2.51 110.744 -179.273 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 15.4 p80 -95.96 -20.48 18.7 Favored 'General case' 0 C--O 1.228 -0.067 0 CA-C-O 116.628 -1.653 . . . . 1.01 113.259 -179.109 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 33.2 m -31.92 115.22 0.16 Allowed 'General case' 0 C--O 1.221 -0.425 0 C-N-CA 125.776 1.63 . . . . 1.17 111.823 -172.085 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 1.2 p -45.83 -39.58 8.66 Favored 'General case' 0 C--N 1.329 -0.291 0 C-N-CA 125.908 1.683 . . . . 1.15 110.994 -177.367 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 12.6 t0 -63.48 104.87 0.68 Allowed 'General case' 0 N--CA 1.449 -0.514 0 CA-C-O 121.912 0.863 . . . . 2.48 109.872 167.402 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 9.1 m-70 -52.07 -33.87 41.06 Favored 'General case' 0 N--CA 1.457 -0.118 0 CA-C-O 118.596 -0.716 . . . . 4.67 111.613 175.438 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -59.06 -54.11 50.72 Favored 'General case' 0 N--CA 1.448 -0.534 0 CA-C-O 118.04 -0.981 . . . . 1.05 109.957 178.988 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 4.4 mt-10 -42.73 -46.31 5.07 Favored 'General case' 0 CA--C 1.516 -0.352 0 C-N-CA 124.593 1.157 . . . . 2.71 111.055 178.561 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 12.4 mtp-105 -64.24 -51.2 64.79 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.162 -0.927 . . . . 3.27 109.423 -176.532 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 1.2 mm? -66.39 -18.88 65.62 Favored 'General case' 0 N--CA 1.451 -0.39 0 CA-C-O 117.674 -1.155 . . . . 0.52 113.054 176.708 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -67.37 -44.19 79.56 Favored 'General case' 0 C--O 1.221 -0.445 0 CA-C-N 121.377 1.899 . . . . 1.86 107.106 168.893 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 85' ' ' VAL . . . . . 0.564 HG21 ' CB ' ' A' ' 73' ' ' LEU . 93.8 t -63.95 -46.08 95.05 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.564 0 CA-C-O 117.559 -1.21 . . . . 0.47 111.556 177.069 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 7.2 mt-30 -63.03 -49.62 73.9 Favored 'General case' 0 N--CA 1.463 0.217 0 CA-C-N 121.864 2.12 . . . . 1.72 111.737 178.636 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 44.9 tttt -57.83 -52.26 66.19 Favored 'General case' 0 N--CA 1.449 -0.497 0 O-C-N 121.769 -0.582 . . . . 2.15 110.325 -176.523 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 8.0 m-20 -67.22 -33.3 75.07 Favored 'General case' 0 N--CA 1.453 -0.315 0 C-N-CA 123.704 0.802 . . . . 1.04 110.394 -179.147 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -136.04 84.24 31.54 Favored Pre-proline 0 C--O 1.236 0.373 0 C-N-CA 125.984 1.714 . . . . 0.43 110.233 -173.728 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 97.4 Cg_endo -81.48 48.78 2.98 Favored 'Trans proline' 0 CA--C 1.538 0.683 0 C-N-CA 123.567 2.845 . . . . 1.64 111.333 -175.791 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 2.3 ptmt -168.5 -53.55 0.02 OUTLIER 'General case' 0 N--CA 1.454 -0.231 0 C-N-CA 125.813 1.645 . . . . 2.35 110.173 -174.025 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 6.6 m -51.21 -46.6 62.27 Favored 'General case' 0 N--CA 1.464 0.274 0 CA-C-N 118.874 0.761 . . . . 0.44 111.674 179.404 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 7.6 t80 -57.47 -47.07 82.85 Favored 'General case' 0 CA--C 1.511 -0.544 0 CA-C-O 121.486 0.66 . . . . 1.91 111.149 178.678 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 12.6 tt0 -61.06 -31.1 70.77 Favored 'General case' 0 N--CA 1.441 -0.889 0 CA-C-N 115.052 -0.976 . . . . 1.85 110.185 -179.41 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -60.69 -60.21 4.16 Favored 'General case' 0 N--CA 1.46 0.047 0 C-N-CA 123.663 0.785 . . . . 1.05 109.09 -176.64 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 3.0 mp -53.81 -44.21 59.09 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.302 0 N-CA-C 108.783 -0.821 . . . . 0.79 108.783 175.964 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 52.6 t30 -60.34 -37.58 81.07 Favored 'General case' 0 CA--C 1.535 0.401 0 C-N-CA 120.336 -0.546 . . . . 1.64 112.137 -177.306 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 . . . . . 0 CA--C 1.533 0.317 0 C-N-CA 126.878 2.071 . . . . 3.15 108.946 -179.999 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.451 -0.407 0 CA-C-O 122.266 1.031 . . . . 3.7 108.441 . . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 0.6 OUTLIER -69.41 -24.88 28.01 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.306 0 CA-C-N 115.815 -0.63 . . . . 0.64 112.317 179.631 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 1.0 OUTLIER -59.41 -54.14 50.13 Favored 'General case' 0 N--CA 1.455 -0.215 0 N-CA-C 106.753 -1.573 . . . . 0.48 106.753 175.28 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 2.6 mt-10 -59.45 -35.56 74.27 Favored 'General case' 0 CA--C 1.516 -0.348 0 CA-C-O 118.254 -0.879 . . . . 3.58 111.189 179.22 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 10.0 t80 -52.43 -47.47 66.35 Favored 'General case' 0 C--N 1.333 -0.146 0 CA-C-N 119.001 0.819 . . . . 3.17 110.815 173.984 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -49.75 -48.8 36.03 Favored Glycine 0 CA--C 1.525 0.658 0 N-CA-C 111.478 -0.649 . . . . 0.43 111.478 172.148 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 20' ' ' HIS . . . . . 0.513 ' CE1' ' HB1' ' A' ' 64' ' ' ALA . 1.8 t-160 -63.01 -41.74 99.64 Favored 'General case' 0 N--CA 1.454 -0.274 0 O-C-N 121.66 -0.906 . . . . 1.94 111.663 -178.504 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -62.14 -32.98 73.64 Favored 'General case' 0 N--CA 1.449 -0.482 0 N-CA-C 109.684 -0.487 . . . . 0.72 109.684 178.817 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 93.9 t -67.44 -40.35 84.38 Favored 'Isoleucine or valine' 0 C--O 1.233 0.209 0 C-N-CA 119.611 -0.836 . . . . 0.77 110.121 175.112 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 CA--C 1.527 0.088 0 CA-C-O 119.46 -0.305 . . . . 2.2 111.292 176.145 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 10.0 t0 . . . . . 0 N--CA 1.465 0.278 0 CA-C-O 121.951 0.881 . . . . 2.19 109.608 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 9.4 mm -51.4 -51.8 22.82 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.481 0 C-N-CA 125.711 1.604 . . . . 0.45 108.651 173.79 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 32.5 t80 -62.5 -32.4 73.3 Favored 'General case' 0 N--CA 1.45 -0.448 0 O-C-N 120.422 -1.424 . . . . 0.41 113.357 175.728 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -63.42 -50.93 67.85 Favored 'General case' 0 N--CA 1.455 -0.186 0 C-N-CA 118.209 -1.396 . . . . 1.42 110.116 -176.135 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 31.3 mt-10 -79.94 -66.59 0.86 Allowed 'General case' 0 N--CA 1.454 -0.275 0 N-CA-C 108.669 -0.863 . . . . 3.71 108.669 -178.699 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 17.1 mp0 -71.83 -28.44 63.57 Favored 'General case' 0 C--O 1.236 0.384 0 O-C-N 121.865 -0.522 . . . . 2.63 110.589 -165.808 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 52' ' ' GLY . . . . . 0.401 ' HA2' ' CD1' ' A' ' 66' ' ' PHE . . . -70.6 38.74 0.48 Allowed Glycine 0 CA--C 1.529 0.91 0 C-N-CA 124.874 1.226 . . . . 0.35 113.686 169.603 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 36.1 p -148.88 29.94 0.81 Allowed 'General case' 0 N--CA 1.446 -0.645 0 O-C-N 120.832 -1.393 . . . . 1.79 109.983 158.328 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 2.7 t-20 -141.04 -42.1 0.39 Allowed 'General case' 0 CA--C 1.52 -0.199 0 N-CA-C 113.005 0.743 . . . . 1.95 113.005 -170.946 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 31.1 mt -59.18 -38.05 78.89 Favored 'General case' 0 N--CA 1.463 0.199 0 CA-C-O 120.874 0.369 . . . . 0.65 111.2 -175.66 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -179.12 171.1 1.38 Allowed 'General case' 0 CA--C 1.533 0.312 0 C-N-CA 125.356 1.462 . . . . 0.78 107.35 -179.585 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 13.3 m -61.63 -36.41 80.69 Favored 'General case' 0 CA--C 1.53 0.209 0 O-C-N 121.648 -0.657 . . . . 0.97 110.506 169.413 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -69.13 -4.31 16.87 Favored 'General case' 0 CA--C 1.533 0.321 0 N-CA-C 112.346 0.499 . . . . 1.32 112.346 172.82 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -91.87 -7.88 64.02 Favored Glycine 0 N--CA 1.444 -0.817 0 CA-C-O 118.66 -1.078 . . . . 0.52 111.071 173.632 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 4.1 tmt_? -111.8 -12.86 13.77 Favored 'General case' 0 C--N 1.338 0.082 0 CA-C-N 119.095 1.447 . . . . 2.92 112.162 -178.656 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 17.6 p -64.57 -161.09 0.01 OUTLIER 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 124.372 1.069 . . . . 0.84 109.542 168.439 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 85.8 m-20 -51.87 147.51 6.88 Favored 'General case' 0 C--N 1.34 0.165 0 O-C-N 120.699 -1.251 . . . . 1.59 111.162 -176.651 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 28.6 tt0 -60.74 -25.0 66.15 Favored 'General case' 0 CA--C 1.536 0.415 0 CA-C-O 121.775 0.798 . . . . 3.32 111.094 -175.829 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 64' ' ' ALA . . . . . 0.513 ' HB1' ' CE1' ' A' ' 20' ' ' HIS . . . -58.39 -47.16 84.77 Favored 'General case' 0 N--CA 1.452 -0.374 0 C-N-CA 124.823 1.249 . . . . 0.48 112.829 169.86 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 12.3 mt-10 -69.48 -42.52 74.7 Favored 'General case' 0 CA--C 1.514 -0.409 0 O-C-N 121.466 -0.771 . . . . 2.08 110.258 179.148 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 66' ' ' PHE . . . . . 0.401 ' CD1' ' HA2' ' A' ' 52' ' ' GLY . 53.9 t80 -49.34 -52.54 27.37 Favored 'General case' 0 N--CA 1.453 -0.297 0 C-N-CA 123.288 0.635 . . . . 0.37 110.814 174.462 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 75.8 t80 -59.78 -43.65 94.3 Favored 'General case' 0 N--CA 1.451 -0.415 0 C-N-CA 122.581 0.352 . . . . 0.39 110.842 177.55 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -62.27 -45.62 92.46 Favored 'General case' 0 CA--C 1.54 0.572 0 O-C-N 121.404 -0.81 . . . . 0.29 111.762 -176.404 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 15.2 mm-40 -59.93 -43.43 94.95 Favored 'General case' 0 CA--C 1.521 -0.141 0 C-N-CA 123.505 0.722 . . . . 4.13 109.651 173.318 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -55.77 -43.51 76.81 Favored 'General case' 0 N--CA 1.451 -0.412 0 N-CA-C 109.791 -0.448 . . . . 0.52 109.791 -179.705 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 7.2 t80 -61.28 -50.4 73.16 Favored 'General case' 0 CA--C 1.531 0.232 0 C-N-CA 123.065 0.546 . . . . 2.61 111.578 178.332 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 17.2 ttt180 -46.76 -59.36 3.1 Favored 'General case' 0 N--CA 1.468 0.426 0 C-N-CA 124.225 1.01 . . . . 2.22 109.789 175.251 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 73' ' ' LEU . . . . . 0.665 HD12 HG23 ' A' ' 85' ' ' VAL . 0.2 OUTLIER -65.16 -27.78 68.95 Favored 'General case' 0 N--CA 1.451 -0.412 0 C-N-CA 124.729 1.212 . . . . 0.58 110.748 -175.351 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 2.0 ttp -58.43 -39.93 81.12 Favored 'General case' 0 C--O 1.234 0.272 0 CA-C-O 121.306 0.574 . . . . 2.59 111.552 -178.052 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 13.7 p-80 -94.46 -42.96 8.58 Favored 'General case' 0 C--O 1.223 -0.31 0 CA-C-O 116.063 -1.923 . . . . 2.15 112.561 178.283 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 53.6 p 3.56 112.58 0.0 OUTLIER 'General case' 0 N--CA 1.472 0.643 0 C-N-CA 128.617 2.767 . . . . 2.22 114.602 -171.288 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 2.3 p -41.05 -44.43 2.43 Favored 'General case' 0 N--CA 1.455 -0.209 0 C-N-CA 125.703 1.601 . . . . 1.19 111.678 178.677 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 57.1 t0 -76.56 106.31 8.13 Favored 'General case' 0 N--CA 1.452 -0.349 0 C-N-CA 117.072 -1.851 . . . . 2.11 108.649 166.886 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 5.3 p-80 -42.44 -35.63 1.09 Allowed 'General case' 0 N--CA 1.454 -0.258 0 C-N-CA 124.474 1.11 . . . . 4.38 112.758 171.415 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -56.61 -47.88 78.67 Favored 'General case' 0 N--CA 1.449 -0.485 0 C-N-CA 123.149 0.58 . . . . 0.97 110.415 -178.955 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -54.37 -34.36 61.02 Favored 'General case' 0 CA--C 1.515 -0.374 0 C-N-CA 122.489 0.316 . . . . 3.75 111.343 -179.286 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 3.5 mtp-105 -63.28 -51.97 63.96 Favored 'General case' 0 N--CA 1.447 -0.588 0 N-CA-C 108.642 -0.873 . . . . 3.43 108.642 177.937 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 83' ' ' LEU . . . . . 0.403 HD13 ' HA ' ' A' ' 83' ' ' LEU . 2.4 mm? -61.42 -25.81 67.45 Favored 'General case' 0 N--CA 1.453 -0.315 0 CA-C-O 118.092 -0.956 . . . . 0.67 112.276 177.908 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 2.4 mptm? -62.53 -46.0 90.42 Favored 'General case' 0 CA--C 1.52 -0.19 0 CA-C-N 120.37 1.441 . . . . 1.41 108.504 173.681 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 85' ' ' VAL . . . . . 0.665 HG23 HD12 ' A' ' 73' ' ' LEU . 86.3 t -62.66 -63.75 0.77 Allowed 'Isoleucine or valine' 0 C--O 1.217 -0.652 0 CA-C-O 118.356 -0.831 . . . . 0.56 109.795 174.712 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -47.82 -51.01 24.28 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 119.53 1.059 . . . . 1.85 111.514 -171.869 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 13.5 pttp -66.06 -40.08 90.63 Favored 'General case' 0 CA--C 1.532 0.276 0 O-C-N 121.991 -0.443 . . . . 3.65 110.722 -177.24 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 55.1 m-20 -82.07 -7.43 59.61 Favored 'General case' 0 CA--C 1.534 0.351 0 CA-C-N 118.178 0.445 . . . . 0.95 111.244 -179.776 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -158.57 74.51 3.65 Favored Pre-proline 0 N--CA 1.448 -0.553 0 C-N-CA 125.477 1.511 . . . . 0.35 108.907 -170.326 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 67.8 Cg_endo -81.6 44.17 1.68 Allowed 'Trans proline' 0 CA--C 1.537 0.641 0 C-N-CA 124.234 3.289 . . . . 1.59 111.254 -174.947 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -160.95 -56.31 0.05 Allowed 'General case' 0 N--CA 1.451 -0.382 0 C-N-CA 125.636 1.574 . . . . 2.57 108.66 -176.1 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 2.5 m -49.22 -48.6 45.35 Favored 'General case' 0 N--CA 1.464 0.256 0 C-N-CA 123.822 0.849 . . . . 0.34 111.359 176.603 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 6.5 t80 -59.55 -51.19 70.89 Favored 'General case' 0 CA--C 1.509 -0.61 0 CA-C-O 121.348 0.594 . . . . 2.07 110.561 -179.301 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 32.2 tt0 -59.93 -28.19 67.41 Favored 'General case' 0 N--CA 1.442 -0.847 0 CA-C-N 114.928 -1.033 . . . . 1.83 110.207 -178.315 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 8.4 t80 -65.35 -56.93 9.87 Favored 'General case' 0 N--CA 1.452 -0.333 0 C-N-CA 124.068 0.947 . . . . 1.6 109.423 -175.136 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 3.4 mp -59.06 -41.51 83.65 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.161 0 N-CA-C 108.924 -0.769 . . . . 0.89 108.924 174.832 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -60.13 -30.44 69.29 Favored 'General case' 0 CA--C 1.536 0.419 0 CA-C-N 118.03 0.377 . . . . 1.69 111.208 -178.85 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 10.3 t70 . . . . . 0 CA--C 1.522 -0.102 0 C-N-CA 123.771 0.828 . . . . 2.34 109.302 177.104 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 C--O 1.224 -0.277 0 N-CA-C 110.464 -0.198 . . . . 3.71 110.464 . . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 0.5 OUTLIER -61.92 -34.67 64.03 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.348 0 O-C-N 121.709 -0.619 . . . . 0.38 111.948 -176.505 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 6.6 t60 -60.05 -55.52 32.92 Favored 'General case' 0 CA--C 1.532 0.269 0 N-CA-C 107.207 -1.405 . . . . 0.55 107.207 178.051 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 31.7 mt-10 -56.87 -38.29 72.53 Favored 'General case' 0 N--CA 1.453 -0.301 0 C-N-CA 124.152 0.981 . . . . 1.94 111.832 178.654 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 1.7 m-85 -54.94 -49.17 72.01 Favored 'General case' 0 CA--C 1.517 -0.295 0 CA-C-N 119.42 1.009 . . . . 3.08 109.661 176.165 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -50.01 -45.87 41.75 Favored Glycine 0 CA--C 1.525 0.694 0 N-CA-C 110.804 -0.918 . . . . 0.42 110.804 174.866 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 4.0 t-80 -62.16 -45.6 92.69 Favored 'General case' 0 N--CA 1.451 -0.398 0 O-C-N 121.896 -0.767 . . . . 1.79 111.783 179.458 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -64.61 -28.0 69.33 Favored 'General case' 0 N--CA 1.454 -0.271 0 O-C-N 121.199 -0.938 . . . . 0.61 110.228 179.619 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 92.7 t -71.67 -37.45 63.04 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.168 0 O-C-N 120.921 -1.112 . . . . 0.72 109.682 176.242 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 8.6 t70 . . . . . 0 C--N 1.334 -0.101 0 CA-C-O 121.179 0.514 . . . . 2.23 111.136 172.895 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 6.8 m-20 . . . . . 0 N--CA 1.463 0.177 0 CA-C-O 121.077 0.465 . . . . 3.61 111.271 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 3.2 mm -53.13 -50.96 43.35 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.232 0 C-N-CA 124.268 1.027 . . . . 0.47 109.416 -176.259 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 24.6 t80 -64.07 -36.76 85.07 Favored 'General case' 0 N--CA 1.451 -0.378 0 O-C-N 121.614 -0.679 . . . . 0.38 111.396 177.15 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 49' ' ' LYS . . . . . 0.514 ' HA ' ' HE2' ' A' ' 49' ' ' LYS . 0.3 OUTLIER -60.3 -47.2 87.04 Favored 'General case' 0 C--N 1.33 -0.246 0 C-N-CA 118.791 -1.164 . . . . 1.09 111.615 -177.292 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 3.5 tp10 -86.42 -59.64 2.22 Favored 'General case' 0 CA--C 1.532 0.268 0 CA-C-O 121.871 0.843 . . . . 2.89 109.598 -176.27 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 19.2 mm-40 -73.57 -28.84 62.06 Favored 'General case' 0 CA--C 1.535 0.402 0 O-C-N 121.654 -0.654 . . . . 2.19 110.621 -170.131 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -68.06 40.57 0.26 Allowed Glycine 0 CA--C 1.531 1.05 0 C-N-CA 126.509 2.004 . . . . 0.33 114.715 172.332 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 20.9 t -146.45 22.59 1.31 Allowed 'General case' 0 N--CA 1.45 -0.432 0 O-C-N 120.778 -1.425 . . . . 1.9 110.019 156.679 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -135.53 -23.3 1.44 Allowed 'General case' 0 C--N 1.342 0.282 0 N-CA-C 113.712 1.005 . . . . 2.22 113.712 -167.539 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 22.0 mt -71.48 -41.65 69.09 Favored 'General case' 0 C--N 1.331 -0.233 0 O-C-N 121.404 -0.81 . . . . 0.42 109.919 175.99 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 1.7 t 179.13 175.16 0.67 Allowed 'General case' 0 CA--C 1.533 0.305 0 C-N-CA 125.408 1.483 . . . . 0.52 107.939 -174.741 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 39.4 t -60.88 -36.02 78.13 Favored 'General case' 0 CA--C 1.532 0.288 0 O-C-N 121.688 -0.632 . . . . 2.17 109.781 168.888 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -65.59 -11.64 46.05 Favored 'General case' 0 N--CA 1.465 0.285 0 N-CA-C 112.468 0.544 . . . . 1.01 112.468 174.581 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -88.61 -7.17 72.2 Favored Glycine 0 C--O 1.221 -0.688 0 CA-C-O 119.124 -0.82 . . . . 0.39 111.117 176.31 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 64.1 ttt180 -113.52 -14.1 12.72 Favored 'General case' 0 N--CA 1.458 -0.07 0 CA-C-N 118.875 1.337 . . . . 3.48 112.036 -178.672 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 19.9 p -64.48 -159.03 0.01 OUTLIER 'General case' 0 CA--C 1.539 0.536 0 C-N-CA 123.408 0.683 . . . . 0.78 109.432 168.582 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 3.8 t-20 -53.05 145.85 12.35 Favored 'General case' 0 CA--C 1.53 0.196 0 O-C-N 120.403 -1.436 . . . . 1.75 110.271 -176.305 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -59.56 -31.87 69.83 Favored 'General case' 0 CA--C 1.535 0.368 0 CA-C-O 121.461 0.648 . . . . 3.36 110.663 -176.278 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -58.59 -36.19 73.6 Favored 'General case' 0 N--CA 1.453 -0.311 0 N-CA-C 112.968 0.729 . . . . 0.41 112.968 174.531 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 8.1 mt-10 -70.93 -48.57 52.79 Favored 'General case' 0 CA--C 1.511 -0.533 0 CA-C-O 118.301 -0.857 . . . . 2.22 110.261 174.599 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 30.6 t80 -46.49 -47.05 19.42 Favored 'General case' 0 CA--C 1.533 0.305 0 C-N-CA 124.385 1.074 . . . . 0.28 111.448 175.145 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 78.9 t80 -65.33 -44.38 87.96 Favored 'General case' 0 CA--C 1.537 0.447 0 O-C-N 121.172 -0.955 . . . . 0.45 111.12 177.29 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -66.16 -51.34 58.77 Favored 'General case' 0 CA--C 1.539 0.554 0 C-N-CA 123.959 0.904 . . . . 0.28 112.668 -174.331 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -60.72 -40.06 90.92 Favored 'General case' 0 C--N 1.332 -0.186 0 O-C-N 120.858 -1.151 . . . . 3.59 110.618 172.451 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -56.18 -40.68 74.31 Favored 'General case' 0 C--O 1.222 -0.362 0 CA-C-N 118.727 0.694 . . . . 0.51 110.176 174.72 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -55.75 -49.89 71.88 Favored 'General case' 0 N--CA 1.465 0.298 0 C-N-CA 124.513 1.125 . . . . 3.45 111.833 172.137 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -50.8 -56.65 11.11 Favored 'General case' 0 CA--C 1.531 0.236 0 N-CA-C 109.222 -0.659 . . . . 3.93 109.222 176.739 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 73' ' ' LEU . . . . . 0.591 ' CB ' HG21 ' A' ' 85' ' ' VAL . 0.1 OUTLIER -66.4 -25.91 66.99 Favored 'General case' 0 C--N 1.327 -0.402 0 C-N-CA 124.346 1.059 . . . . 0.49 111.236 -175.511 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 74' ' ' MET . . . . . 0.403 ' HA ' ' CE2' ' A' ' 93' ' ' PHE . 0.2 OUTLIER -63.49 -39.16 93.71 Favored 'General case' 0 C--O 1.231 0.125 0 CA-C-N 118.646 0.657 . . . . 2.34 109.912 -179.42 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 7.1 p80 -97.62 -9.72 26.4 Favored 'General case' 0 CA--C 1.531 0.246 0 CA-C-O 116.277 -1.821 . . . . 0.97 114.191 179.331 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 5.1 m -36.2 114.88 0.31 Allowed 'General case' 0 CA--C 1.512 -0.511 0 CA-C-N 120.698 1.59 . . . . 1.12 111.162 -173.303 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -51.62 -37.25 49.3 Favored 'General case' 0 N--CA 1.448 -0.568 0 CA-C-N 114.259 -1.337 . . . . 1.04 110.7 -173.67 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 53.9 t0 -73.41 107.19 5.57 Favored 'General case' 0 N--CA 1.452 -0.365 0 C-N-CA 116.95 -1.9 . . . . 2.4 109.563 164.955 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 20.9 p-80 -38.97 -38.22 0.43 Allowed 'General case' 0 N--CA 1.454 -0.234 0 C-N-CA 125.247 1.419 . . . . 4.59 112.5 169.431 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -53.89 -54.67 35.48 Favored 'General case' 0 N--CA 1.449 -0.485 0 CA-C-N 118.197 0.453 . . . . 0.58 109.789 -179.23 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -57.06 -35.88 69.86 Favored 'General case' 0 CA--C 1.514 -0.431 0 C-N-CA 122.957 0.503 . . . . 4.58 111.852 -175.238 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 22.0 mtp180 -61.97 -50.03 73.74 Favored 'General case' 0 N--CA 1.449 -0.52 0 C-N-CA 119.744 -0.783 . . . . 2.26 109.397 175.987 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 1.6 mm? -67.24 -18.54 65.27 Favored 'General case' 0 N--CA 1.456 -0.17 0 CA-C-O 118.093 -0.956 . . . . 0.53 113.41 176.743 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 2.5 mptm? -65.44 -50.47 65.27 Favored 'General case' 0 CA--C 1.517 -0.294 0 CA-C-N 120.65 1.568 . . . . 1.41 107.413 169.827 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 85' ' ' VAL . . . . . 0.591 HG21 ' CB ' ' A' ' 73' ' ' LEU . 94.4 t -57.39 -50.17 77.81 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.528 0 CA-C-O 118.85 -0.595 . . . . 0.47 110.458 176.387 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -62.38 -52.56 63.13 Favored 'General case' 0 N--CA 1.45 -0.432 0 CA-C-N 119.472 1.033 . . . . 2.21 111.223 -173.518 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 29.5 pttt -63.58 -40.25 96.47 Favored 'General case' 0 CA--C 1.53 0.176 0 O-C-N 121.78 -0.575 . . . . 2.49 109.96 -175.531 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 50.8 m-20 -72.14 -28.47 63.28 Favored 'General case' 0 C--O 1.224 -0.249 0 C-N-CA 122.763 0.425 . . . . 0.99 110.635 -178.855 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -141.43 74.7 23.64 Favored Pre-proline 0 C--O 1.237 0.419 0 C-N-CA 125.901 1.68 . . . . 0.42 108.914 -170.559 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 85.5 Cg_endo -78.29 68.55 7.9 Favored 'Trans proline' 0 N--CA 1.457 -0.655 0 C-N-CA 123.874 3.05 . . . . 1.86 110.146 -171.307 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 1.2 ptmt 166.47 -55.23 0.0 OUTLIER 'General case' 0 C--O 1.224 -0.272 0 C-N-CA 126.432 1.893 . . . . 2.18 111.204 -167.083 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 6.0 m -56.47 -44.03 80.18 Favored 'General case' 0 CA--C 1.518 -0.265 0 CA-C-N 120.071 1.305 . . . . 0.48 110.514 -178.404 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 93' ' ' PHE . . . . . 0.403 ' CE2' ' HA ' ' A' ' 74' ' ' MET . 13.9 t80 -57.16 -48.87 77.65 Favored 'General case' 0 CA--C 1.513 -0.475 0 C-N-CA 120.073 -0.651 . . . . 2.01 110.68 175.865 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 19.3 tt0 -59.87 -28.97 67.99 Favored 'General case' 0 N--CA 1.443 -0.779 0 CA-C-N 114.93 -1.032 . . . . 1.64 110.844 -179.104 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 2.6 t80 -63.26 -57.02 11.81 Favored 'General case' 0 N--CA 1.457 -0.113 0 C-N-CA 124.258 1.023 . . . . 1.12 109.133 -176.213 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 3.3 mp -60.24 -42.69 91.35 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.302 0 N-CA-C 108.498 -0.927 . . . . 0.84 108.498 177.069 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 12.8 t-20 -56.89 -36.34 70.0 Favored 'General case' 0 CA--C 1.537 0.466 0 CA-C-N 117.836 0.289 . . . . 1.9 111.589 -177.892 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.462 0.144 0 C-N-CA 125.172 1.389 . . . . 2.13 109.399 175.756 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 CA--C 1.52 -0.175 0 CA-C-O 120.904 0.383 . . . . 3.68 110.638 . . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 0.7 OUTLIER -64.59 -38.88 83.77 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.303 0 N-CA-C 112.069 0.396 . . . . 0.45 112.069 179.354 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 12.4 t60 -59.29 -56.18 25.37 Favored 'General case' 0 CA--C 1.53 0.184 0 N-CA-C 107.741 -1.207 . . . . 0.54 107.741 -179.67 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 34.3 mt-10 -57.87 -37.55 74.13 Favored 'General case' 0 N--CA 1.451 -0.418 0 C-N-CA 124.406 1.083 . . . . 2.42 111.057 178.507 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -54.47 -52.15 62.77 Favored 'General case' 0 CA--C 1.521 -0.165 0 CA-C-N 119.457 1.026 . . . . 3.48 109.871 173.878 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -47.82 -46.37 25.23 Favored Glycine 0 CA--C 1.526 0.75 0 N-CA-C 110.696 -0.961 . . . . 0.58 110.696 173.849 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 8.1 t-80 -65.66 -45.97 80.9 Favored 'General case' 0 N--CA 1.454 -0.248 0 O-C-N 121.951 -0.735 . . . . 1.8 112.272 -177.883 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -61.78 -34.32 75.68 Favored 'General case' 0 N--CA 1.452 -0.353 0 O-C-N 120.925 -1.109 . . . . 1.1 109.123 179.298 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 94.2 t -76.77 -26.88 16.48 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.428 0 C-N-CA 120.233 -0.587 . . . . 1.63 110.284 179.509 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 34.7 t0 . . . . . 0 N--CA 1.456 -0.171 0 CA-C-O 121.953 0.883 . . . . 2.35 110.328 172.141 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 2.5 m-20 . . . . . 0 CA--C 1.521 -0.169 0 N-CA-C 109.072 -0.714 . . . . 3.28 109.072 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 11.3 mm -49.52 -56.6 2.81 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.229 0 C-N-CA 125.329 1.451 . . . . 0.69 108.922 -178.443 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 28.9 t80 -61.69 -37.5 84.37 Favored 'General case' 0 N--CA 1.453 -0.311 0 C-N-CA 124.614 1.166 . . . . 0.51 112.337 175.551 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 49' ' ' LYS . . . . . 0.464 ' HA ' ' HE2' ' A' ' 49' ' ' LYS . 0.2 OUTLIER -62.0 -45.17 94.77 Favored 'General case' 0 CA--C 1.519 -0.218 0 CA-C-N 119.652 1.115 . . . . 1.37 111.1 -175.502 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 2.9 tp10 -80.19 -67.51 0.76 Allowed 'General case' 0 N--CA 1.451 -0.425 0 CA-C-O 122.387 1.089 . . . . 2.62 108.962 179.074 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 51' ' ' GLU . . . . . 0.583 ' OE2' ' HE2' ' A' ' 91' ' ' LYS . 59.2 mm-40 -76.45 -19.69 57.8 Favored 'General case' 0 N--CA 1.453 -0.293 0 C-N-CA 123.389 0.675 . . . . 3.05 111.51 -164.773 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -68.83 36.31 0.28 Allowed Glycine 0 CA--C 1.532 1.145 0 C-N-CA 124.393 0.997 . . . . 0.6 113.12 167.684 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 59.9 p -148.84 23.63 0.97 Allowed 'General case' 0 N--CA 1.448 -0.532 0 O-C-N 120.444 -1.621 . . . . 1.8 110.855 161.488 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 58.7 t-20 -135.51 -43.52 0.69 Allowed 'General case' 0 CA--C 1.52 -0.209 0 CA-C-O 120.896 0.379 . . . . 2.33 111.444 -160.15 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 20.6 mt -66.14 -37.16 85.0 Favored 'General case' 0 C--N 1.331 -0.205 0 C-N-CA 120.445 -0.502 . . . . 0.48 110.674 -179.41 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 2.7 t 175.78 173.1 0.32 Allowed 'General case' 0 CA--C 1.533 0.301 0 C-N-CA 125.269 1.428 . . . . 0.61 108.193 -173.136 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 8.8 p -64.04 -36.3 83.54 Favored 'General case' 0 N--CA 1.455 -0.188 0 C-N-CA 123.889 0.876 . . . . 2.29 110.504 172.666 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -64.38 -14.8 58.52 Favored 'General case' 0 N--CA 1.464 0.266 0 N-CA-C 112.041 0.385 . . . . 1.02 112.041 172.247 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -75.57 -13.6 82.8 Favored Glycine 0 N--CA 1.443 -0.885 0 N-CA-C 110.848 -0.901 . . . . 0.43 110.848 174.339 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 3.6 tmt_? -113.75 -8.65 13.21 Favored 'General case' 0 CA--C 1.52 -0.174 0 CA-C-N 118.967 1.384 . . . . 2.8 113.028 -171.34 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 18.8 p -69.09 -115.21 0.0 OUTLIER 'General case' 0 C--N 1.327 -0.377 0 C-N-CA 124.368 1.067 . . . . 1.39 110.042 177.215 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 9.8 t-20 -86.94 154.1 21.07 Favored 'General case' 0 N--CA 1.454 -0.228 0 O-C-N 120.553 -1.342 . . . . 2.35 107.724 177.829 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 78.8 tt0 -58.68 -34.57 71.41 Favored 'General case' 0 CA--C 1.535 0.383 0 CA-C-N 118.87 0.759 . . . . 2.95 109.731 175.416 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -65.93 -29.04 69.39 Favored 'General case' 0 N--CA 1.455 -0.215 0 N-CA-C 113.128 0.788 . . . . 0.63 113.128 177.521 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 11.9 mt-10 -77.42 -45.68 25.05 Favored 'General case' 0 CA--C 1.513 -0.471 0 O-C-N 121.075 -1.016 . . . . 2.22 110.05 175.856 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 49.8 t80 -47.64 -48.71 28.55 Favored 'General case' 0 C--N 1.33 -0.271 0 C-N-CA 125.717 1.607 . . . . 0.56 111.27 172.19 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 56.5 t80 -63.26 -43.78 97.0 Favored 'General case' 0 CA--C 1.538 0.517 0 O-C-N 121.174 -0.954 . . . . 0.81 110.833 177.013 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -66.49 -52.33 47.22 Favored 'General case' 0 CA--C 1.539 0.534 0 O-C-N 121.114 -0.991 . . . . 0.47 112.851 -174.185 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -57.63 -39.8 77.75 Favored 'General case' 0 C--N 1.331 -0.215 0 O-C-N 120.701 -1.249 . . . . 4.0 111.017 170.382 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -56.71 -44.0 81.12 Favored 'General case' 0 N--CA 1.451 -0.416 0 CA-C-O 118.4 -0.81 . . . . 0.48 110.251 176.648 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 71.3 t80 -55.92 -49.98 71.95 Favored 'General case' 0 N--CA 1.466 0.371 0 CA-C-N 119.725 1.148 . . . . 3.07 111.672 173.517 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 64.1 ttt180 -47.98 -57.59 5.55 Favored 'General case' 0 CA--C 1.533 0.325 0 CA-C-N 118.568 0.622 . . . . 2.37 109.899 177.537 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 73' ' ' LEU . . . . . 0.601 ' CB ' HG21 ' A' ' 85' ' ' VAL . 0.1 OUTLIER -67.3 -27.6 67.31 Favored 'General case' 0 C--N 1.327 -0.385 0 C-N-CA 124.538 1.135 . . . . 0.52 111.263 -176.476 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 1.2 ttp -62.29 -38.32 88.91 Favored 'General case' 0 N--CA 1.454 -0.244 0 C-N-CA 122.814 0.445 . . . . 2.4 109.852 179.763 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 23.1 p80 -91.27 -36.61 13.8 Favored 'General case' 0 N--CA 1.452 -0.334 0 CA-C-O 115.886 -2.007 . . . . 1.01 111.572 -175.083 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 18.6 m -6.11 118.4 0.01 OUTLIER 'General case' 0 C--N 1.347 0.492 0 C-N-CA 128.493 2.717 . . . . 1.01 114.575 -174.655 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 4.9 p -46.21 -47.24 17.91 Favored 'General case' 0 N--CA 1.451 -0.376 0 C-N-CA 125.234 1.414 . . . . 0.97 109.638 175.136 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 12.9 t0 -70.36 114.18 8.23 Favored 'General case' 0 N--CA 1.451 -0.393 0 CA-C-O 122.13 0.967 . . . . 2.39 109.929 169.7 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 13.2 m170 -63.04 -29.41 70.8 Favored 'General case' 0 N--CA 1.451 -0.377 0 CA-C-N 115.779 -0.646 . . . . 6.1 111.189 176.964 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -63.21 -46.1 88.59 Favored 'General case' 0 N--CA 1.453 -0.29 0 CA-C-N 119.313 0.96 . . . . 1.25 110.07 179.369 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -48.66 -41.99 33.09 Favored 'General case' 0 C--O 1.231 0.13 0 C-N-CA 124.554 1.142 . . . . 4.23 110.771 175.105 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -64.35 -52.52 57.94 Favored 'General case' 0 C--N 1.33 -0.247 0 N-CA-C 109.417 -0.586 . . . . 3.16 109.417 179.39 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 83' ' ' LEU . . . . . 0.418 HD13 ' HA ' ' A' ' 83' ' ' LEU . 1.3 mm? -66.19 -16.88 64.36 Favored 'General case' 0 CA--C 1.522 -0.128 0 N-CA-C 112.861 0.689 . . . . 1.25 112.861 179.239 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 33.5 mttt -66.4 -51.24 59.04 Favored 'General case' 0 N--CA 1.45 -0.454 0 N-CA-C 106.953 -1.499 . . . . 2.14 106.953 168.865 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 85' ' ' VAL . . . . . 0.601 HG21 ' CB ' ' A' ' 73' ' ' LEU . 98.8 t -56.18 -46.3 81.17 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.449 0 CA-C-O 118.195 -0.907 . . . . 0.61 111.994 174.557 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 1.6 mt-30 -66.84 -49.89 64.27 Favored 'General case' 0 C--O 1.224 -0.252 0 CA-C-N 120.662 1.574 . . . . 2.21 112.183 -175.589 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 5.3 pttp -68.11 -38.39 82.22 Favored 'General case' 0 C--O 1.226 -0.161 0 O-C-N 121.178 -0.951 . . . . 3.96 109.978 -174.678 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 3.1 m120 -62.38 -45.42 93.24 Favored 'General case' 0 N--CA 1.453 -0.322 0 N-CA-C 108.866 -0.79 . . . . 1.34 108.866 175.883 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -128.53 86.19 58.35 Favored Pre-proline 0 N--CA 1.451 -0.385 0 C-N-CA 126.324 1.85 . . . . 0.52 109.755 -172.467 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 92.1 Cg_endo -80.46 46.18 2.18 Favored 'Trans proline' 0 CA--C 1.539 0.737 0 C-N-CA 123.361 2.707 . . . . 1.85 111.596 -176.899 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 91' ' ' LYS . . . . . 0.583 ' HE2' ' OE2' ' A' ' 51' ' ' GLU . 21.1 pttt -160.88 -53.2 0.05 OUTLIER 'General case' 0 N--CA 1.452 -0.339 0 C-N-CA 125.443 1.497 . . . . 2.61 110.743 177.27 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 3.4 m -50.43 -47.06 56.83 Favored 'General case' 0 N--CA 1.464 0.228 0 C-N-CA 123.649 0.78 . . . . 0.66 111.781 -178.135 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 12.2 t80 -57.47 -49.56 75.89 Favored 'General case' 0 CA--C 1.516 -0.343 0 CA-C-O 121.793 0.806 . . . . 2.39 110.883 178.845 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 1.4 mt-30 -59.69 -26.48 65.61 Favored 'General case' 0 N--CA 1.446 -0.634 0 CA-C-N 114.657 -1.156 . . . . 2.04 110.773 -179.027 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 3.6 t80 -66.93 -58.39 5.07 Favored 'General case' 0 N--CA 1.451 -0.383 0 C-N-CA 123.586 0.755 . . . . 1.05 110.227 -178.16 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 96' ' ' ILE . . . . . 0.402 HD12 ' H ' ' A' ' 96' ' ' ILE . 3.3 mp -55.63 -42.54 69.41 Favored 'Isoleucine or valine' 0 CA--C 1.528 0.098 0 N-CA-C 108.701 -0.852 . . . . 1.18 108.701 175.638 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 21.8 t-20 -55.8 -43.91 77.33 Favored 'General case' 0 CA--C 1.537 0.452 0 CA-C-O 120.886 0.374 . . . . 2.31 111.181 -179.869 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 CA--C 1.533 0.318 0 C-N-CA 124.44 1.096 . . . . 2.27 110.178 177.523 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 9.2 t80 . . . . . 0 C--O 1.219 -0.541 0 N-CA-C 108.71 -0.848 . . . . 2.73 108.71 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -59.19 -37.16 67.01 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.389 0 N-CA-C 113.087 0.773 . . . . 0.39 113.087 176.421 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 6.4 t60 -61.03 -54.01 50.09 Favored 'General case' 0 N--CA 1.465 0.277 0 N-CA-C 106.354 -1.721 . . . . 0.47 106.354 177.775 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 67.9 mt-10 -53.26 -40.64 64.8 Favored 'General case' 0 C--O 1.223 -0.333 0 C-N-CA 122.698 0.399 . . . . 2.55 110.512 176.988 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -60.84 -50.17 74.54 Favored 'General case' 0 CA--C 1.518 -0.251 0 C-N-CA 125.173 1.389 . . . . 2.06 109.379 -175.291 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -49.04 -46.33 33.11 Favored Glycine 0 CA--C 1.528 0.9 0 N-CA-C 110.447 -1.061 . . . . 0.43 110.447 173.161 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 6.5 t-80 -63.34 -42.15 98.93 Favored 'General case' 0 N--CA 1.451 -0.417 0 O-C-N 122.035 -0.685 . . . . 1.8 111.784 179.571 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -65.5 -30.42 71.18 Favored 'General case' 0 N--CA 1.452 -0.372 0 O-C-N 121.378 -0.826 . . . . 0.65 109.956 -179.938 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 82.5 t -70.01 -40.05 78.1 Favored 'Isoleucine or valine' 0 C--O 1.232 0.165 0 O-C-N 121.328 -0.857 . . . . 0.88 109.609 176.355 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 3.6 m-20 . . . . . 0 C--N 1.334 -0.099 0 N-CA-C 112.047 0.388 . . . . 2.5 112.047 172.375 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 12.8 t70 . . . . . 0 N--CA 1.465 0.308 0 CA-C-O 121.597 0.713 . . . . 2.37 111.032 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 47' ' ' ILE . . . . . 0.474 HD13 ' HE3' ' A' ' 91' ' ' LYS . 5.7 mm -50.63 -52.59 15.81 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.308 0 C-N-CA 124.559 1.144 . . . . 0.62 108.677 177.461 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 20.0 t80 -67.52 -33.7 75.6 Favored 'General case' 0 N--CA 1.452 -0.332 0 C-N-CA 123.403 0.681 . . . . 0.78 112.043 177.201 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 49' ' ' LYS . . . . . 0.508 ' HE2' ' N ' ' A' ' 49' ' ' LYS . 0.6 OUTLIER -61.93 -49.16 77.25 Favored 'General case' 0 CA--C 1.519 -0.235 0 CA-C-N 119.899 1.227 . . . . 1.83 109.195 -174.44 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 7.3 mm-40 -80.08 -66.17 0.91 Allowed 'General case' 0 N--CA 1.448 -0.563 0 CA-C-O 122.14 0.971 . . . . 2.79 109.089 -178.461 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 17.8 mm-40 -73.79 -21.52 60.14 Favored 'General case' 0 C--O 1.235 0.298 0 C-N-CA 123.442 0.697 . . . . 2.57 110.659 -164.791 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -68.2 37.52 0.25 Allowed Glycine 0 CA--C 1.531 1.064 0 C-N-CA 125.429 1.49 . . . . 0.35 113.454 169.073 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 61.5 p -148.94 23.25 0.97 Allowed 'General case' 0 N--CA 1.446 -0.663 0 O-C-N 120.673 -1.486 . . . . 2.04 110.839 163.388 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 3.2 t-20 -136.19 -39.84 0.67 Allowed 'General case' 0 CA--C 1.517 -0.301 0 N-CA-C 113.147 0.795 . . . . 1.56 113.147 -164.799 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 55' ' ' LEU . . . . . 0.643 HD22 HG22 ' A' ' 85' ' ' VAL . 16.2 mt -66.96 -36.86 83.15 Favored 'General case' 0 C--N 1.332 -0.194 0 C-N-CA 120.214 -0.594 . . . . 0.36 110.473 -178.533 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 1.2 t 178.83 170.3 0.87 Allowed 'General case' 0 C--N 1.331 -0.206 0 C-N-CA 125.451 1.5 . . . . 0.49 107.637 -178.581 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 9.6 m -57.56 -35.35 70.22 Favored 'General case' 0 N--CA 1.453 -0.279 0 C-N-CA 123.175 0.59 . . . . 0.92 110.554 170.056 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -58.5 -33.84 70.27 Favored 'General case' 0 C--N 1.34 0.154 0 CA-C-N 117.837 0.289 . . . . 1.17 110.418 173.842 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -63.96 -16.36 59.48 Favored Glycine 0 C--O 1.22 -0.74 0 CA-C-O 119.106 -0.83 . . . . 0.54 111.792 178.481 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 50.7 ttt-85 -104.6 -8.55 18.88 Favored 'General case' 0 N--CA 1.457 -0.111 0 CA-C-N 119.184 1.492 . . . . 2.13 113.735 178.942 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 44.0 p -67.65 -139.12 0.0 OUTLIER 'General case' 0 CA--C 1.54 0.596 0 CA-C-O 121.205 0.526 . . . . 0.98 110.585 174.567 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 1.1 t-20 -65.22 149.48 49.86 Favored 'General case' 0 N--CA 1.453 -0.307 0 O-C-N 120.067 -1.646 . . . . 1.95 108.703 178.473 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 3.4 tm-20 -60.58 -32.69 71.78 Favored 'General case' 0 CA--C 1.532 0.282 0 O-C-N 121.915 -0.491 . . . . 3.15 110.259 179.454 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -61.62 -29.76 70.26 Favored 'General case' 0 N--CA 1.454 -0.246 0 N-CA-C 113.798 1.036 . . . . 0.62 113.798 175.166 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 2.1 mt-10 -81.44 -41.03 22.44 Favored 'General case' 0 CA--C 1.508 -0.653 0 O-C-N 121.169 -0.957 . . . . 2.52 110.597 176.776 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 37.3 t80 -50.42 -47.7 56.52 Favored 'General case' 0 N--CA 1.45 -0.437 0 C-N-CA 124.194 0.997 . . . . 0.31 111.155 170.283 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 42.1 t80 -64.59 -46.02 84.48 Favored 'General case' 0 CA--C 1.538 0.504 0 O-C-N 121.34 -0.85 . . . . 0.68 109.98 176.979 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -61.28 -54.61 41.88 Favored 'General case' 0 CA--C 1.539 0.53 0 O-C-N 121.082 -1.011 . . . . 0.26 113.061 -174.297 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -57.28 -39.86 76.56 Favored 'General case' 0 C--N 1.331 -0.211 0 O-C-N 121.008 -1.057 . . . . 3.9 110.86 171.511 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -56.69 -42.18 78.64 Favored 'General case' 0 N--CA 1.453 -0.316 0 CA-C-N 119.15 0.886 . . . . 0.36 110.806 175.995 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 76.7 t80 -58.53 -49.66 76.59 Favored 'General case' 0 N--CA 1.464 0.261 0 CA-C-N 119.912 1.233 . . . . 3.07 111.633 172.821 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 22.8 ttp180 -47.84 -57.75 5.24 Favored 'General case' 0 N--CA 1.465 0.284 0 CA-C-N 119.238 0.926 . . . . 2.63 110.203 177.449 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -63.6 -30.15 71.3 Favored 'General case' 0 C--N 1.326 -0.414 0 C-N-CA 124.838 1.255 . . . . 0.45 111.104 -177.153 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 1.2 ttp -59.2 -42.23 90.45 Favored 'General case' 0 C--O 1.233 0.227 0 C-N-CA 122.756 0.422 . . . . 2.5 110.488 -179.938 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 8.9 p80 -96.7 -6.12 37.17 Favored 'General case' 0 N--CA 1.455 -0.183 0 CA-C-O 116.365 -1.779 . . . . 0.89 113.68 -177.181 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 16.6 m -36.94 126.93 0.91 Allowed 'General case' 0 N--CA 1.453 -0.29 0 CA-C-O 123.267 1.508 . . . . 1.02 111.905 -171.697 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 7.8 p -52.83 -44.95 67.08 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 112.849 -1.978 . . . . 1.18 108.207 177.133 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 13.0 t0 -65.68 107.52 1.78 Allowed 'General case' 0 N--CA 1.45 -0.459 0 CA-C-O 121.863 0.84 . . . . 2.14 108.91 166.687 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -57.58 -33.01 67.74 Favored 'General case' 0 N--CA 1.454 -0.266 0 CA-C-N 116.068 -0.515 . . . . 5.41 110.432 177.452 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -61.95 -47.4 85.06 Favored 'General case' 0 N--CA 1.451 -0.38 0 CA-C-N 118.567 0.621 . . . . 0.67 110.745 179.952 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 5.7 mt-10 -49.1 -41.44 35.66 Favored 'General case' 0 CA--C 1.519 -0.245 0 C-N-CA 123.943 0.897 . . . . 2.6 110.908 178.444 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 2.2 mtp180 -62.45 -50.2 72.4 Favored 'General case' 0 C--N 1.327 -0.396 0 N-CA-C 109.056 -0.72 . . . . 2.86 109.056 178.484 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 1.3 mm? -64.99 -18.18 65.06 Favored 'General case' 0 N--CA 1.451 -0.398 0 CA-C-O 117.682 -1.152 . . . . 0.45 113.487 176.51 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 6.6 mttt -69.32 -48.8 60.38 Favored 'General case' 0 C--O 1.224 -0.27 0 CA-C-N 121.404 1.911 . . . . 1.27 107.511 168.774 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 85' ' ' VAL . . . . . 0.643 HG22 HD22 ' A' ' 55' ' ' LEU . 33.4 t -58.57 -42.61 85.19 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.596 0 CA-C-O 118.112 -0.947 . . . . 0.47 111.449 176.237 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 1.3 mt-30 -69.44 -52.77 23.67 Favored 'General case' 0 C--O 1.224 -0.255 0 CA-C-N 121.253 1.842 . . . . 1.95 111.741 -179.949 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 35.6 tttt -51.96 -50.8 60.52 Favored 'General case' 0 N--CA 1.451 -0.393 0 C-N-CA 123.436 0.694 . . . . 2.2 110.075 -177.661 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 4.0 m-20 -65.93 -46.08 79.51 Favored 'General case' 0 N--CA 1.449 -0.479 0 C-N-CA 123.389 0.676 . . . . 1.52 109.565 179.276 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -130.63 78.1 74.55 Favored Pre-proline 0 C--O 1.238 0.45 0 C-N-CA 125.672 1.589 . . . . 0.43 110.847 -168.634 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 73.9 Cg_endo -74.7 15.9 0.66 Allowed 'Trans proline' 0 CA--C 1.536 0.594 0 C-N-CA 123.062 2.508 . . . . 1.51 112.683 -175.233 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 91' ' ' LYS . . . . . 0.474 ' HE3' HD13 ' A' ' 47' ' ' ILE . 7.9 ptmt -128.69 -46.43 1.29 Allowed 'General case' 0 N--CA 1.451 -0.421 0 C-N-CA 125.773 1.629 . . . . 2.66 109.526 -177.751 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 3.3 m -54.61 -49.4 70.56 Favored 'General case' 0 N--CA 1.464 0.242 0 CA-C-N 119.533 1.061 . . . . 0.33 111.067 176.227 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 22.5 t80 -59.01 -50.48 73.92 Favored 'General case' 0 CA--C 1.51 -0.583 0 C-N-CA 119.927 -0.709 . . . . 1.84 110.428 -179.724 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 22.4 tt0 -57.72 -29.63 64.89 Favored 'General case' 0 N--CA 1.444 -0.732 0 CA-C-N 114.69 -1.141 . . . . 2.42 110.1 -177.158 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 13.1 t80 -66.07 -58.42 5.52 Favored 'General case' 0 N--CA 1.45 -0.45 0 C-N-CA 123.358 0.663 . . . . 1.45 109.34 -177.882 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 3.2 mp -55.02 -41.99 62.03 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.217 0 N-CA-C 109.297 -0.631 . . . . 0.84 109.297 175.718 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 14.0 t-20 -60.98 -35.73 77.58 Favored 'General case' 0 N--CA 1.455 -0.187 0 C-N-CA 123.382 0.673 . . . . 2.29 111.772 -175.957 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 27.0 t70 . . . . . 0 CA--C 1.528 0.126 0 C-N-CA 123.585 0.754 . . . . 2.17 110.333 174.481 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 16.0 t80 . . . . . 0 C--O 1.223 -0.303 0 N-CA-C 109.504 -0.554 . . . . 3.37 109.504 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER -60.74 -33.9 56.86 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.328 0 O-C-N 121.724 -0.61 . . . . 0.61 111.708 -179.894 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 13.6 t60 -61.7 -51.56 67.88 Favored 'General case' 0 CA--C 1.536 0.442 0 N-CA-C 107.796 -1.186 . . . . 0.73 107.796 177.607 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 43.6 mt-10 -54.13 -40.69 67.61 Favored 'General case' 0 C--O 1.225 -0.22 0 O-C-N 121.013 -1.054 . . . . 2.29 110.668 175.173 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 1.3 t80 -58.23 -41.37 83.96 Favored 'General case' 0 N--CA 1.453 -0.314 0 C-N-CA 123.244 0.618 . . . . 2.37 109.931 178.752 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -49.87 -49.71 34.4 Favored Glycine 0 CA--C 1.529 0.927 0 N-CA-C 111.226 -0.75 . . . . 0.69 111.226 170.47 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 70.8 m-70 -57.15 -52.16 66.42 Favored 'General case' 0 C--O 1.227 -0.11 0 CA-C-N 117.93 0.865 . . . . 3.8 110.917 176.833 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -60.59 -27.42 67.71 Favored 'General case' 0 N--CA 1.454 -0.226 0 CA-C-N 117.802 0.273 . . . . 0.81 111.691 -177.904 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 54.2 t -71.83 -40.12 68.71 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.212 0 O-C-N 121.15 -0.969 . . . . 1.02 109.563 176.51 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 3.2 t0 . . . . . 0 N--CA 1.451 -0.419 0 N-CA-C 112.215 0.45 . . . . 2.49 112.215 179.837 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 94.7 m-20 . . . . . 0 N--CA 1.465 0.291 0 CA-C-O 120.431 0.158 . . . . 3.81 111.11 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 8.8 mm -47.65 -60.58 0.59 Allowed 'Isoleucine or valine' 0 CA--C 1.536 0.406 0 C-N-CA 125.692 1.597 . . . . 0.75 108.955 175.963 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 23.7 t80 -65.35 -30.6 71.45 Favored 'General case' 0 N--CA 1.454 -0.257 0 O-C-N 121.031 -1.043 . . . . 0.64 112.304 178.185 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -65.22 -49.55 69.26 Favored 'General case' 0 N--CA 1.454 -0.251 0 O-C-N 120.256 -1.527 . . . . 1.21 109.76 -176.942 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 26.8 mm-40 -85.94 -57.14 3.15 Favored 'General case' 0 N--CA 1.449 -0.499 0 CA-C-O 121.452 0.644 . . . . 4.33 109.557 -171.98 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 37.3 mt-10 -80.95 -23.32 38.92 Favored 'General case' 0 C--O 1.235 0.329 0 O-C-N 121.775 -0.578 . . . . 3.54 110.502 -171.692 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 52' ' ' GLY . . . . . 0.42 ' HA2' ' CD1' ' A' ' 66' ' ' PHE . . . -71.17 43.52 0.67 Allowed Glycine 0 CA--C 1.531 1.039 0 C-N-CA 125.791 1.662 . . . . 0.39 113.776 168.934 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 34.6 t -160.25 35.79 0.17 Allowed 'General case' 0 N--CA 1.447 -0.62 0 C-N-CA 125.022 1.329 . . . . 1.79 108.023 162.9 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 31.9 t30 -146.34 -34.76 0.29 Allowed 'General case' 0 C--N 1.341 0.228 0 N-CA-C 113.589 0.959 . . . . 1.87 113.589 -169.699 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 18.8 mt -64.01 -41.28 97.52 Favored 'General case' 0 CA--C 1.53 0.187 0 O-C-N 121.4 -0.813 . . . . 0.55 110.124 174.912 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 1.6 t 177.7 174.67 0.5 Allowed 'General case' 0 CA--C 1.534 0.337 0 C-N-CA 125.907 1.683 . . . . 0.65 107.67 -177.116 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 74.5 m -59.57 -31.5 69.49 Favored 'General case' 0 CA--C 1.529 0.166 0 O-C-N 121.584 -0.697 . . . . 0.97 110.472 166.935 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -64.65 -19.87 65.97 Favored 'General case' 0 CA--C 1.535 0.403 0 CA-C-N 118.066 0.394 . . . . 1.89 111.755 176.112 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -84.29 -11.9 77.21 Favored Glycine 0 N--CA 1.446 -0.642 0 CA-C-O 119.177 -0.791 . . . . 0.41 111.394 176.494 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 3.9 tmt_? -107.18 -13.85 15.05 Favored 'General case' 0 N--CA 1.455 -0.194 0 CA-C-N 118.29 1.045 . . . . 2.67 112.132 -178.106 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 1.1 p -62.73 -165.76 0.01 OUTLIER 'General case' 0 CA--C 1.538 0.501 0 C-N-CA 123.752 0.821 . . . . 1.07 110.162 164.987 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 14.6 m-20 -49.52 148.53 2.77 Favored 'General case' 0 CA--C 1.528 0.122 0 O-C-N 121.268 -0.895 . . . . 2.14 110.879 -178.679 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 60.4 tt0 -62.83 -27.86 69.61 Favored 'General case' 0 CA--C 1.533 0.322 0 CA-C-O 121.298 0.57 . . . . 2.64 111.117 -177.547 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -54.46 -40.43 68.42 Favored 'General case' 0 N--CA 1.455 -0.201 0 O-C-N 121.553 -0.717 . . . . 0.69 112.152 169.429 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 1.3 mt-10 -78.25 -39.37 40.39 Favored 'General case' 0 CA--C 1.507 -0.68 0 CA-C-O 118.418 -0.801 . . . . 2.85 110.022 -178.059 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 66' ' ' PHE . . . . . 0.42 ' CD1' ' HA2' ' A' ' 52' ' ' GLY . 56.5 t80 -51.47 -50.87 58.98 Favored 'General case' 0 N--CA 1.452 -0.354 0 C-N-CA 123.863 0.865 . . . . 0.47 111.354 171.735 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 79.1 t80 -62.89 -44.23 96.65 Favored 'General case' 0 CA--C 1.541 0.619 0 O-C-N 121.473 -0.767 . . . . 0.55 110.132 177.426 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -64.57 -55.54 19.79 Favored 'General case' 0 CA--C 1.537 0.448 0 N-CA-C 113.795 1.035 . . . . 0.3 113.795 -174.438 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -54.8 -39.44 68.47 Favored 'General case' 0 C--N 1.33 -0.244 0 O-C-N 120.665 -1.272 . . . . 3.85 111.404 169.047 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -59.02 -35.58 73.52 Favored 'General case' 0 CA--C 1.534 0.345 0 CA-C-N 119.63 1.104 . . . . 0.4 110.789 174.465 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -61.52 -53.33 57.87 Favored 'General case' 0 C--O 1.233 0.194 0 CA-C-N 119.085 0.857 . . . . 3.71 111.481 171.202 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 2.3 ttt180 -45.39 -64.53 0.7 Allowed 'General case' 0 CA--C 1.528 0.129 0 C-N-CA 123.202 0.601 . . . . 2.43 109.966 177.548 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 73' ' ' LEU . . . . . 0.427 HD12 HG23 ' A' ' 85' ' ' VAL . 0.2 OUTLIER -51.08 -53.51 33.4 Favored 'General case' 0 C--N 1.326 -0.448 0 C-N-CA 126.363 1.865 . . . . 0.85 110.063 -179.296 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -61.92 -30.15 70.7 Favored 'General case' 0 CA--C 1.535 0.37 0 O-C-N 121.742 -0.599 . . . . 2.88 112.238 -172.43 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 1.7 p80 -90.9 -18.71 24.3 Favored 'General case' 0 N--CA 1.463 0.201 0 CA-C-O 118.049 -0.977 . . . . 1.2 112.215 176.115 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 5.1 m -55.36 112.69 1.16 Allowed 'General case' 0 N--CA 1.446 -0.63 0 CA-C-N 119.82 1.191 . . . . 1.87 107.963 -173.989 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -44.74 -37.43 3.74 Favored 'General case' 0 C--N 1.325 -0.497 0 C-N-CA 125.684 1.593 . . . . 2.43 110.908 -178.051 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 19.1 t0 -55.33 99.23 0.03 OUTLIER 'General case' 0 N--CA 1.449 -0.493 0 CA-C-O 122.721 1.248 . . . . 2.14 111.439 168.348 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 14.2 p-80 -44.42 -36.73 3.01 Favored 'General case' 0 N--CA 1.449 -0.482 0 CA-C-N 114.467 -1.242 . . . . 4.9 112.558 171.251 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -63.23 -53.71 48.84 Favored 'General case' 0 N--CA 1.449 -0.507 0 CA-C-N 119.365 0.984 . . . . 0.88 110.746 -178.202 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -50.21 -44.37 53.16 Favored 'General case' 0 N--CA 1.465 0.276 0 CA-C-N 119.235 0.925 . . . . 3.56 109.525 178.287 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 44.0 mtp180 -62.59 -56.64 16.01 Favored 'General case' 0 N--CA 1.452 -0.327 0 CA-C-N 115.99 -0.55 . . . . 3.03 110.576 -177.812 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 1.1 mm? -63.72 -17.81 63.38 Favored 'General case' 0 N--CA 1.448 -0.538 0 C-N-CA 123.516 0.727 . . . . 0.68 112.634 179.491 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 45.5 mttt -70.09 -45.64 66.55 Favored 'General case' 0 CA--C 1.511 -0.552 0 CA-C-N 119.835 1.198 . . . . 1.17 108.567 170.51 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 85' ' ' VAL . . . . . 0.427 HG23 HD12 ' A' ' 73' ' ' LEU . 57.2 t -54.28 -51.52 47.38 Favored 'Isoleucine or valine' 0 C--O 1.214 -0.791 0 C-N-CA 119.538 -0.865 . . . . 0.62 109.241 170.062 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 4.2 tm0? -67.06 -51.59 52.71 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 119.583 1.083 . . . . 2.88 111.927 -167.598 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 7.8 ttmm -55.38 -44.81 76.45 Favored 'General case' 0 C--N 1.331 -0.22 0 C-N-CA 124.651 1.18 . . . . 2.6 110.828 175.427 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 15.9 m-20 -77.63 -22.45 50.72 Favored 'General case' 0 CA--C 1.532 0.266 0 C-N-CA 122.732 0.413 . . . . 0.95 111.458 -177.068 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -155.9 69.7 5.14 Favored Pre-proline 0 C--O 1.238 0.459 0 C-N-CA 125.492 1.517 . . . . 0.53 109.365 -165.367 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 30.8 Cg_endo -61.22 -34.82 87.83 Favored 'Trans proline' 0 N--CA 1.449 -1.126 0 C-N-CA 121.873 1.716 . . . . 2.2 109.911 -175.388 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 11.1 tttt -79.45 -44.05 22.1 Favored 'General case' 0 N--CA 1.448 -0.545 0 C-N-CA 124.974 1.31 . . . . 4.62 110.414 -174.375 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 7.2 m -58.16 -47.4 83.49 Favored 'General case' 0 N--CA 1.464 0.269 0 CA-C-N 119.217 0.917 . . . . 0.57 108.983 176.384 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 12.9 t80 -59.59 -45.39 92.01 Favored 'General case' 0 CA--C 1.501 -0.931 0 O-C-N 122.018 -0.426 . . . . 2.0 111.543 -178.265 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 46.8 tt0 -48.99 -44.26 40.97 Favored 'General case' 0 N--CA 1.443 -0.795 0 O-C-N 124.332 1.02 . . . . 3.03 109.333 176.511 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 4.0 t80 -61.99 -54.31 43.46 Favored 'General case' 0 CA--C 1.529 0.148 0 N-CA-C 109.695 -0.483 . . . . 1.63 109.695 -177.378 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 34.8 mm -59.72 -29.41 42.77 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.199 0 C-N-CA 123.518 0.727 . . . . 1.53 111.512 -178.361 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -78.36 -33.89 48.71 Favored 'General case' 0 N--CA 1.453 -0.282 0 O-C-N 121.195 -0.941 . . . . 1.67 110.324 178.863 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 CA--C 1.53 0.199 0 C-N-CA 124.747 1.219 . . . . 2.13 108.799 177.404 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 72.8 t80 . . . . . 0 N--CA 1.455 -0.22 0 CA-C-O 121.497 0.665 . . . . 2.42 110.31 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 15' ' ' ILE . . . . . 0.45 HD12 ' CE1' ' A' ' 75' ' ' HIS . 0.8 OUTLIER -66.29 -28.95 45.1 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.259 0 O-C-N 121.177 -0.952 . . . . 0.82 112.745 179.105 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 1.6 t-160 -58.82 -53.76 54.75 Favored 'General case' 0 C--N 1.342 0.248 0 N-CA-C 105.938 -1.875 . . . . 0.67 105.938 174.607 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 7.4 mt-10 -53.74 -43.01 68.77 Favored 'General case' 0 C--O 1.223 -0.308 0 CA-C-O 118.824 -0.607 . . . . 2.56 111.175 177.208 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 7.2 t80 -56.83 -44.94 82.58 Favored 'General case' 0 C--N 1.333 -0.137 0 CA-C-N 119.156 0.889 . . . . 2.11 111.228 178.498 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -51.49 -49.64 44.89 Favored Glycine 0 CA--C 1.524 0.645 0 N-CA-C 110.198 -1.161 . . . . 0.58 110.198 170.837 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 4.7 t-80 -59.28 -44.46 92.47 Favored 'General case' 0 N--CA 1.45 -0.473 0 O-C-N 121.59 -0.947 . . . . 1.75 111.641 -178.72 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -61.29 -32.56 72.4 Favored 'General case' 0 N--CA 1.452 -0.343 0 CA-C-N 118.398 0.544 . . . . 0.6 109.849 178.212 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 3.5 t -67.16 -38.66 81.53 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.213 0 O-C-N 121.191 -0.943 . . . . 1.01 111.501 175.122 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 6.8 t0 . . . . . 0 C--N 1.333 -0.149 0 CA-C-O 120.9 0.381 . . . . 1.99 110.702 175.02 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 5.8 t70 . . . . . 0 N--CA 1.47 0.561 0 CA-C-O 121.344 0.592 . . . . 2.32 109.483 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 47' ' ' ILE . . . . . 0.46 ' HA ' ' HE2' ' A' ' 91' ' ' LYS . 3.4 mm -50.99 -52.0 19.13 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.238 0 C-N-CA 124.989 1.316 . . . . 0.48 107.989 -179.967 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 28.5 t80 -61.82 -36.18 80.41 Favored 'General case' 0 N--CA 1.45 -0.469 0 C-N-CA 124.852 1.261 . . . . 0.4 113.665 173.845 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 49' ' ' LYS . . . . . 0.468 ' HA ' ' HE2' ' A' ' 49' ' ' LYS . 1.0 OUTLIER -59.54 -49.15 78.91 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 120.025 1.284 . . . . 1.0 110.926 -175.23 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 9.5 mm-40 -81.94 -64.02 1.27 Allowed 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 121.902 0.858 . . . . 2.34 109.302 178.708 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 25.6 mm-40 -75.04 -24.05 58.24 Favored 'General case' 0 C--O 1.235 0.341 0 O-C-N 121.703 -0.623 . . . . 2.82 111.208 -164.933 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -72.79 45.2 1.05 Allowed Glycine 0 N--CA 1.442 -0.956 0 C-N-CA 124.622 1.106 . . . . 0.35 112.551 168.716 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 22.2 t -153.2 32.9 0.47 Allowed 'General case' 0 N--CA 1.449 -0.492 0 O-C-N 121.147 -1.208 . . . . 2.32 109.058 151.89 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 2.2 t-20 -133.71 -45.56 0.81 Allowed 'General case' 0 CA--C 1.521 -0.171 0 CA-C-O 120.638 0.256 . . . . 1.58 111.276 -168.433 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 55' ' ' LEU . . . . . 0.535 HD22 HG22 ' A' ' 85' ' ' VAL . 21.2 mt -59.86 -37.22 78.69 Favored 'General case' 0 CA--C 1.529 0.147 0 O-C-N 122.128 -0.357 . . . . 0.67 111.273 -177.275 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER 178.27 173.15 0.66 Allowed 'General case' 0 CA--C 1.533 0.294 0 C-N-CA 126.031 1.733 . . . . 0.69 107.171 -177.889 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 15.5 m -61.94 -35.08 77.38 Favored 'General case' 0 N--CA 1.455 -0.188 0 O-C-N 121.6 -0.687 . . . . 0.93 110.719 169.178 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 1.1 m-85 -69.31 -8.05 42.68 Favored 'General case' 0 N--CA 1.467 0.401 0 O-C-N 121.804 -0.56 . . . . 1.23 112.096 172.32 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -80.65 -18.39 70.77 Favored Glycine 0 N--CA 1.445 -0.72 0 N-CA-C 110.693 -0.963 . . . . 0.45 110.693 170.544 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -104.09 -16.34 15.3 Favored 'General case' 0 CA--C 1.518 -0.254 0 CA-C-N 118.719 1.259 . . . . 2.45 113.128 -176.132 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 41.6 p -64.43 -161.17 0.01 OUTLIER 'General case' 0 CA--C 1.539 0.535 0 N-CA-C 108.972 -0.751 . . . . 0.89 108.972 169.925 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 39.6 m-80 -51.47 145.53 8.57 Favored 'General case' 0 CA--C 1.53 0.21 0 O-C-N 120.369 -1.457 . . . . 1.95 111.011 -176.867 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 47.4 tt0 -60.21 -19.37 53.98 Favored 'General case' 0 CA--C 1.541 0.623 0 C-N-CA 124.223 1.009 . . . . 2.95 111.938 -177.703 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -61.24 -47.92 83.84 Favored 'General case' 0 N--CA 1.453 -0.315 0 C-N-CA 125.973 1.709 . . . . 0.47 112.022 168.688 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 5.2 mt-10 -70.39 -42.23 71.99 Favored 'General case' 0 CA--C 1.51 -0.587 0 O-C-N 121.548 -0.72 . . . . 1.7 111.036 177.935 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 63.6 t80 -45.89 -53.26 10.12 Favored 'General case' 0 N--CA 1.45 -0.45 0 C-N-CA 123.397 0.679 . . . . 0.36 110.896 172.385 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 82.0 t80 -64.35 -41.14 96.9 Favored 'General case' 0 CA--C 1.534 0.332 0 O-C-N 122.131 -0.356 . . . . 0.97 111.62 176.523 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -61.38 -50.56 72.4 Favored 'General case' 0 CA--C 1.537 0.462 0 O-C-N 121.022 -1.049 . . . . 0.26 111.262 -174.935 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 5.4 mm-40 -53.69 -43.71 69.17 Favored 'General case' 0 CA--C 1.521 -0.157 0 C-N-CA 124.653 1.181 . . . . 4.17 110.466 168.524 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -55.87 -39.93 72.22 Favored 'General case' 0 N--CA 1.453 -0.3 0 CA-C-N 118.487 0.585 . . . . 0.53 110.214 179.437 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 2.7 t80 -65.04 -51.59 60.64 Favored 'General case' 0 CA--C 1.53 0.2 0 CA-C-N 119.239 0.927 . . . . 2.28 110.921 175.247 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 12.5 ttt180 -43.72 -56.87 3.52 Favored 'General case' 0 N--CA 1.469 0.499 0 C-N-CA 123.849 0.86 . . . . 2.49 110.558 177.134 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 73' ' ' LEU . . . . . 0.461 HD12 HG23 ' A' ' 85' ' ' VAL . 0.2 OUTLIER -59.67 -52.91 63.5 Favored 'General case' 0 N--CA 1.452 -0.371 0 C-N-CA 125.664 1.585 . . . . 1.16 109.819 179.679 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 0.6 OUTLIER -58.26 -37.57 75.22 Favored 'General case' 0 CA--C 1.531 0.22 0 CA-C-N 118.94 0.791 . . . . 2.67 111.899 -171.667 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 75' ' ' HIS . . . . . 0.45 ' CE1' HD12 ' A' ' 15' ' ' ILE . 2.6 p80 -85.49 -14.9 44.59 Favored 'General case' 0 N--CA 1.461 0.091 0 CA-C-O 118.356 -0.83 . . . . 1.6 111.735 -179.849 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 1.1 t -56.5 117.05 3.48 Favored 'General case' 0 N--CA 1.443 -0.809 0 N-CA-C 106.616 -1.624 . . . . 2.34 106.616 -174.65 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -53.39 -32.83 51.31 Favored 'General case' 0 C--N 1.319 -0.757 0 CA-C-N 115.351 -0.84 . . . . 2.66 110.997 -178.838 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 24.4 t0 -55.51 106.26 0.23 Allowed 'General case' 0 N--CA 1.447 -0.584 0 CA-C-O 122.73 1.252 . . . . 2.03 110.247 165.312 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 32.7 m80 -63.12 -29.31 70.7 Favored 'General case' 0 N--CA 1.449 -0.514 0 CA-C-N 115.151 -0.931 . . . . 5.5 110.189 178.985 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -59.81 -56.69 18.66 Favored 'General case' 0 N--CA 1.448 -0.557 0 CA-C-N 119.093 0.86 . . . . 0.78 109.714 177.323 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -43.47 -47.62 7.13 Favored 'General case' 0 C--O 1.232 0.15 0 C-N-CA 124.98 1.312 . . . . 2.78 110.778 179.13 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 35.8 mtp180 -63.83 -54.14 39.64 Favored 'General case' 0 N--CA 1.451 -0.407 0 CA-C-N 114.857 -1.065 . . . . 2.3 110.036 -177.721 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 83' ' ' LEU . . . . . 0.423 HD13 ' HA ' ' A' ' 83' ' ' LEU . 0.9 OUTLIER -63.35 -17.67 62.84 Favored 'General case' 0 N--CA 1.45 -0.46 0 CA-C-O 117.97 -1.014 . . . . 0.86 112.603 176.439 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 2.0 mptm? -66.39 -46.64 75.93 Favored 'General case' 0 CA--C 1.516 -0.329 0 CA-C-N 121.29 1.859 . . . . 1.33 107.731 169.066 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 85' ' ' VAL . . . . . 0.535 HG22 HD22 ' A' ' 55' ' ' LEU . 56.4 t -56.36 -50.93 69.62 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.657 0 CA-C-O 117.607 -1.187 . . . . 0.81 109.822 174.7 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 1.9 mt-30 -59.12 -57.23 13.96 Favored 'General case' 0 N--CA 1.466 0.374 0 CA-C-N 121.475 1.943 . . . . 2.25 112.304 -178.684 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 11.4 tttm -57.25 -38.27 73.6 Favored 'General case' 0 C--N 1.329 -0.292 0 C-N-CA 123.41 0.684 . . . . 2.47 111.602 -175.116 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 17.0 m-80 -84.51 -20.88 30.92 Favored 'General case' 0 C--O 1.222 -0.372 0 CA-C-O 118.476 -0.774 . . . . 1.98 110.705 179.387 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -144.68 81.48 10.93 Favored Pre-proline 0 C--O 1.237 0.403 0 C-N-CA 125.417 1.487 . . . . 0.54 109.907 -174.152 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 84.5 Cg_endo -78.53 35.35 0.54 Allowed 'Trans proline' 0 CA--C 1.54 0.805 0 C-N-CA 123.509 2.806 . . . . 1.82 112.476 -175.205 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 91' ' ' LYS . . . . . 0.46 ' HE2' ' HA ' ' A' ' 47' ' ' ILE . 14.4 ptmt -149.87 -52.41 0.15 Allowed 'General case' 0 N--CA 1.454 -0.232 0 C-N-CA 125.72 1.608 . . . . 2.79 109.628 -179.655 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 3.3 m -50.36 -47.21 56.17 Favored 'General case' 0 N--CA 1.462 0.149 0 O-C-N 121.419 -0.801 . . . . 0.51 111.379 178.2 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 16.6 t80 -58.64 -49.28 78.12 Favored 'General case' 0 CA--C 1.508 -0.659 0 C-N-CA 120.277 -0.569 . . . . 1.92 112.095 -177.901 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 39.8 tt0 -53.02 -36.57 60.66 Favored 'General case' 0 N--CA 1.446 -0.647 0 CA-C-N 115.115 -0.948 . . . . 1.46 109.507 -179.88 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -60.61 -59.87 4.7 Favored 'General case' 0 N--CA 1.45 -0.43 0 C-N-CA 123.296 0.639 . . . . 1.16 109.424 -178.455 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 23.4 mm -47.98 -46.59 12.61 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.249 0 C-N-CA 124.01 0.924 . . . . 1.5 110.428 175.728 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 1.4 t30 -61.21 -35.29 76.81 Favored 'General case' 0 CA--C 1.53 0.186 0 C-N-CA 123.413 0.685 . . . . 1.6 111.175 -176.969 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 35.7 t0 . . . . . 0 CA--C 1.52 -0.2 0 C-N-CA 124.152 0.981 . . . . 2.14 108.855 174.919 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 25.5 t80 . . . . . 0 N--CA 1.454 -0.239 0 CA-C-O 121.143 0.497 . . . . 2.3 111.487 . . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 15' ' ' ILE . . . . . 0.414 HD12 ' CE1' ' A' ' 75' ' ' HIS . 0.7 OUTLIER -66.02 -32.34 57.68 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.217 0 O-C-N 121.232 -0.918 . . . . 0.44 111.934 179.001 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 3.4 t60 -58.4 -52.28 66.29 Favored 'General case' 0 C--N 1.342 0.279 0 N-CA-C 106.993 -1.484 . . . . 0.49 106.993 176.064 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 44.7 mt-10 -57.47 -41.49 80.74 Favored 'General case' 0 N--CA 1.454 -0.258 0 CA-C-O 118.69 -0.671 . . . . 2.01 111.108 179.298 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -51.66 -47.29 63.84 Favored 'General case' 0 N--CA 1.464 0.269 0 CA-C-N 119.126 0.875 . . . . 3.04 111.72 175.396 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -48.0 -49.91 22.61 Favored Glycine 0 CA--C 1.528 0.895 0 N-CA-C 110.482 -1.047 . . . . 0.44 110.482 174.328 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 20' ' ' HIS . . . . . 0.429 ' CE1' ' HB1' ' A' ' 64' ' ' ALA . 2.4 t-80 -62.11 -40.64 96.59 Favored 'General case' 0 N--CA 1.451 -0.408 0 O-C-N 122.033 -0.687 . . . . 1.9 111.817 178.701 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -60.5 -32.5 71.5 Favored 'General case' 0 N--CA 1.454 -0.244 0 O-C-N 121.002 -1.061 . . . . 0.6 109.971 179.452 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 58.0 t -70.67 -34.43 56.84 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.222 0 O-C-N 121.293 -0.879 . . . . 0.81 111.142 178.041 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 80.0 m-20 . . . . . 0 N--CA 1.468 0.441 0 CA-C-N 118.744 0.702 . . . . 2.42 111.33 172.205 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 20.0 t70 . . . . . 0 N--CA 1.479 0.98 0 N-CA-C 112.517 0.562 . . . . 3.03 112.517 . . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 10.5 mm -38.05 -65.66 0.07 OUTLIER 'Isoleucine or valine' 0 N--CA 1.449 -0.521 0 C-N-CA 129.84 3.256 . . . . 0.98 109.912 173.453 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 24.2 t80 -64.74 -26.67 68.46 Favored 'General case' 0 N--CA 1.453 -0.3 0 O-C-N 120.98 -1.075 . . . . 0.46 112.363 179.775 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 49' ' ' LYS . . . . . 0.568 ' HA ' ' HE2' ' A' ' 49' ' ' LYS . 10.2 mmpt? -69.4 -47.79 63.1 Favored 'General case' 0 N--CA 1.452 -0.362 0 O-C-N 120.092 -1.63 . . . . 1.04 111.07 -176.195 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -89.31 -63.36 1.3 Allowed 'General case' 0 C--N 1.33 -0.274 0 N-CA-C 108.077 -1.082 . . . . 3.36 108.077 -177.721 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 7.8 mm-40 -67.16 -33.05 74.59 Favored 'General case' 0 CA--C 1.532 0.278 0 N-CA-C 109.193 -0.669 . . . . 2.2 109.193 -169.221 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -68.13 39.97 0.26 Allowed Glycine 0 CA--C 1.531 1.036 0 C-N-CA 125.836 1.684 . . . . 0.32 114.308 167.646 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 26.4 m -146.75 24.36 1.21 Allowed 'General case' 0 CA--C 1.533 0.29 0 O-C-N 120.771 -1.429 . . . . 2.11 110.66 154.026 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -131.14 -36.67 1.3 Allowed 'General case' 0 C--N 1.341 0.218 0 N-CA-C 113.283 0.845 . . . . 2.77 113.283 -170.81 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 55' ' ' LEU . . . . . 0.561 HD22 HG22 ' A' ' 85' ' ' VAL . 32.7 mt -66.23 -35.47 80.52 Favored 'General case' 0 N--CA 1.465 0.281 0 CA-C-N 119.383 0.992 . . . . 0.55 110.876 -176.873 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 1.3 t 177.98 172.87 0.62 Allowed 'General case' 0 CA--C 1.531 0.246 0 C-N-CA 125.403 1.481 . . . . 0.59 107.837 -178.438 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 6.4 m -57.91 -34.98 70.41 Favored 'General case' 0 N--CA 1.452 -0.34 0 C-N-CA 123.364 0.666 . . . . 0.94 110.544 166.851 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -65.89 -16.54 63.94 Favored 'General case' 0 CA--C 1.534 0.349 0 N-CA-C 112.253 0.464 . . . . 1.0 112.253 175.312 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -85.29 -11.48 75.44 Favored Glycine 0 N--CA 1.444 -0.776 0 N-CA-C 110.786 -0.926 . . . . 0.37 110.786 175.334 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 4.5 tmt_? -105.81 -19.88 13.62 Favored 'General case' 0 C--O 1.228 -0.062 0 CA-C-N 119.025 1.412 . . . . 3.34 112.112 179.556 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 1.6 p -59.46 -164.12 0.01 OUTLIER 'General case' 0 CA--C 1.536 0.442 0 C-N-CA 124.998 1.319 . . . . 0.8 110.723 170.88 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 50.9 t30 -54.46 149.58 10.2 Favored 'General case' 0 CA--C 1.529 0.172 0 O-C-N 120.635 -1.29 . . . . 2.16 110.158 -176.429 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 14.8 tm-20 -56.85 -39.46 74.32 Favored 'General case' 0 C--O 1.222 -0.348 0 CA-C-O 120.995 0.426 . . . . 3.57 110.24 -173.492 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 64' ' ' ALA . . . . . 0.429 ' HB1' ' CE1' ' A' ' 20' ' ' HIS . . . -56.83 -29.18 62.56 Favored 'General case' 0 C--N 1.328 -0.333 0 N-CA-C 113.421 0.897 . . . . 0.51 113.421 178.857 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 6.2 mt-10 -76.95 -42.87 37.39 Favored 'General case' 0 N--CA 1.452 -0.365 0 O-C-N 121.085 -1.009 . . . . 2.15 110.499 175.839 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 27.8 t80 -52.51 -49.63 64.4 Favored 'General case' 0 CA--C 1.532 0.261 0 C-N-CA 125.03 1.332 . . . . 0.28 111.299 172.585 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 47.8 t80 -64.65 -47.01 80.06 Favored 'General case' 0 CA--C 1.534 0.361 0 O-C-N 120.898 -1.126 . . . . 0.52 110.239 177.031 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -57.68 -56.14 25.73 Favored 'General case' 0 CA--C 1.536 0.412 0 O-C-N 121.243 -0.911 . . . . 0.3 111.927 -175.198 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -59.99 -34.0 72.74 Favored 'General case' 0 CA--C 1.53 0.208 0 C-N-CA 123.713 0.805 . . . . 3.7 111.7 174.384 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -56.27 -46.19 79.81 Favored 'General case' 0 C--O 1.221 -0.443 0 CA-C-N 119.155 0.889 . . . . 0.44 109.856 172.211 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 2.2 t80 -55.73 -49.02 74.18 Favored 'General case' 0 N--CA 1.463 0.202 0 CA-C-N 119.355 0.979 . . . . 2.85 111.371 179.539 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 32.6 ttt180 -47.93 -59.67 3.17 Favored 'General case' 0 N--CA 1.466 0.363 0 N-CA-C 109.419 -0.585 . . . . 2.23 109.419 174.04 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 73' ' ' LEU . . . . . 0.48 ' CB ' HG21 ' A' ' 85' ' ' VAL . 0.1 OUTLIER -63.1 -30.62 71.73 Favored 'General case' 0 C--N 1.33 -0.252 0 C-N-CA 124.594 1.158 . . . . 0.42 111.579 -175.043 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -62.92 -41.42 99.46 Favored 'General case' 0 C--N 1.328 -0.366 0 C-N-CA 124.416 1.086 . . . . 3.02 110.14 -175.282 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 75' ' ' HIS . . . . . 0.414 ' CE1' HD12 ' A' ' 15' ' ' ILE . 7.9 p80 -95.81 -4.11 44.42 Favored 'General case' 0 N--CA 1.452 -0.342 0 CA-C-O 116.312 -1.804 . . . . 0.88 112.928 -179.19 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 3.2 m -37.73 125.74 1.15 Allowed 'General case' 0 CA--C 1.516 -0.336 0 CA-C-N 120.296 1.407 . . . . 1.02 111.645 -166.781 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -51.94 -40.57 61.02 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 113.418 -1.719 . . . . 1.04 109.38 178.987 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 78' ' ' ASP . . . . . 0.515 ' OD2' ' HB3' ' A' ' 80' ' ' ALA . 14.6 t0 -72.19 110.44 6.64 Favored 'General case' 0 N--CA 1.446 -0.651 0 C-N-CA 119.357 -0.937 . . . . 1.82 109.448 163.793 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 1.8 p80 -47.44 -39.61 16.07 Favored 'General case' 0 N--CA 1.454 -0.246 0 CA-C-N 115.82 -0.627 . . . . 4.59 112.091 170.869 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 80' ' ' ALA . . . . . 0.515 ' HB3' ' OD2' ' A' ' 78' ' ' ASP . . . -61.6 -48.3 81.56 Favored 'General case' 0 N--CA 1.452 -0.374 0 CA-C-N 118.127 0.422 . . . . 0.6 110.036 -174.873 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 32.1 mt-10 -48.17 -39.39 20.67 Favored 'General case' 0 N--CA 1.452 -0.368 0 C-N-CA 124.22 1.008 . . . . 2.75 111.644 176.588 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 4.8 mtp180 -65.64 -47.26 76.19 Favored 'General case' 0 C--N 1.326 -0.415 0 C-N-CA 119.604 -0.838 . . . . 2.67 108.878 179.545 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 1.5 mm? -61.79 -26.57 68.17 Favored 'General case' 0 N--CA 1.453 -0.285 0 CA-C-O 117.674 -1.155 . . . . 0.55 112.321 174.779 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -62.77 -42.05 99.51 Favored 'General case' 0 C--O 1.224 -0.257 0 CA-C-N 121.231 1.832 . . . . 1.37 108.329 172.773 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 85' ' ' VAL . . . . . 0.561 HG22 HD22 ' A' ' 55' ' ' LEU . 56.0 t -63.41 -61.79 1.5 Allowed 'Isoleucine or valine' 0 C--O 1.22 -0.48 0 CA-C-O 117.425 -1.274 . . . . 0.39 111.148 173.273 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 3.9 mt-30 -49.33 -49.71 42.87 Favored 'General case' 0 N--CA 1.466 0.328 0 CA-C-N 121.024 1.738 . . . . 2.24 111.103 -175.258 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 37.1 tttt -56.85 -53.27 59.79 Favored 'General case' 0 N--CA 1.447 -0.606 0 C-N-CA 123.764 0.826 . . . . 1.95 111.192 178.243 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 56.1 m-20 -88.43 9.75 22.46 Favored 'General case' 0 C--N 1.332 -0.166 0 C-N-CA 122.696 0.398 . . . . 1.4 111.245 -172.986 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 89' ' ' ALA . . . . . 0.493 ' HB2' HD21 ' A' ' 55' ' ' LEU . . . -164.82 68.91 1.39 Allowed Pre-proline 0 N--CA 1.446 -0.642 0 C-N-CA 124.52 1.128 . . . . 0.5 109.013 -177.385 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 93.0 Cg_endo -80.86 57.51 6.57 Favored 'Trans proline' 0 CA--C 1.535 0.535 0 C-N-CA 124.737 3.625 . . . . 2.09 111.939 -170.556 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 5.0 ptmt 174.72 -47.48 0.01 OUTLIER 'General case' 0 CA--C 1.533 0.315 0 C-N-CA 128.299 2.639 . . . . 2.32 109.847 -170.268 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 13.8 m -55.56 -45.81 77.25 Favored 'General case' 0 N--CA 1.465 0.321 0 O-C-N 121.093 -1.004 . . . . 0.37 111.067 176.627 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 29.4 t80 -55.16 -47.24 75.41 Favored 'General case' 0 CA--C 1.513 -0.462 0 CA-C-O 121.584 0.707 . . . . 2.1 110.595 176.684 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 4.3 mt-30 -57.49 -29.2 64.07 Favored 'General case' 0 N--CA 1.443 -0.783 0 CA-C-N 114.427 -1.26 . . . . 2.42 111.443 178.787 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 8.3 t80 -62.91 -55.29 27.37 Favored 'General case' 0 CA--C 1.528 0.119 0 CA-C-N 118.939 0.791 . . . . 1.31 110.093 -179.468 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 3.6 mp -61.2 -41.47 89.64 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.186 0 N-CA-C 108.34 -0.985 . . . . 0.87 108.34 177.121 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 7.0 t30 -58.93 -37.78 77.48 Favored 'General case' 0 CA--C 1.532 0.255 0 N-CA-C 111.884 0.327 . . . . 2.08 111.884 -178.125 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--N 1.333 -0.143 0 C-N-CA 125.729 1.611 . . . . 2.73 109.04 175.045 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 8.5 t80 . . . . . 0 N--CA 1.452 -0.345 0 CA-C-O 120.756 0.312 . . . . 2.57 111.122 . . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 15' ' ' ILE . . . . . 0.467 HD12 ' CE1' ' A' ' 75' ' ' HIS . 0.5 OUTLIER -67.47 -33.69 63.92 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.314 0 O-C-N 121.538 -0.726 . . . . 0.49 112.205 -179.597 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 8.2 t60 -62.21 -55.89 24.06 Favored 'General case' 0 CA--C 1.53 0.183 0 N-CA-C 107.351 -1.351 . . . . 0.55 107.351 179.558 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 41.6 mt-10 -55.03 -39.33 69.03 Favored 'General case' 0 N--CA 1.449 -0.493 0 C-N-CA 126.051 1.74 . . . . 2.32 110.823 178.222 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 36.4 t80 -56.69 -52.41 65.03 Favored 'General case' 0 C--N 1.333 -0.144 0 CA-C-N 119.222 0.919 . . . . 2.89 109.813 175.828 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -48.15 -45.61 27.17 Favored Glycine 0 CA--C 1.526 0.756 0 N-CA-C 111.498 -0.641 . . . . 0.57 111.498 172.375 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 19.3 t-80 -61.67 -49.96 74.42 Favored 'General case' 0 N--CA 1.448 -0.56 0 O-C-N 121.631 -0.923 . . . . 1.91 111.456 -179.68 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -59.83 -31.7 69.97 Favored 'General case' 0 N--CA 1.449 -0.479 0 C-N-CA 123.825 0.85 . . . . 0.59 109.643 -176.592 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 93.3 t -62.88 -51.9 66.19 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.24 0 C-N-CA 120.309 -0.556 . . . . 0.73 109.844 177.409 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--N 1.328 -0.332 0 CA-C-N 116.361 -0.381 . . . . 3.15 111.376 179.072 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 6.8 m-20 . . . . . 0 N--CA 1.464 0.267 0 N-CA-C 108.374 -0.973 . . . . 3.25 108.374 . . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 11.9 mm -48.18 -52.97 6.64 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.243 0 C-N-CA 125.298 1.439 . . . . 0.45 109.292 -177.743 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 33.1 t80 -64.42 -33.98 77.14 Favored 'General case' 0 N--CA 1.449 -0.487 0 N-CA-C 112.821 0.674 . . . . 0.45 112.821 179.407 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 49' ' ' LYS . . . . . 0.554 ' HA ' ' HE2' ' A' ' 49' ' ' LYS . 9.4 mmpt? -67.85 -46.28 72.19 Favored 'General case' 0 C--N 1.331 -0.228 0 O-C-N 119.938 -1.726 . . . . 1.29 110.669 -177.994 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 11.8 mm-40 -82.27 -65.97 0.95 Allowed 'General case' 0 N--CA 1.452 -0.359 0 N-CA-C 108.429 -0.952 . . . . 3.93 108.429 -175.887 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 3.7 mm-40 -68.44 -35.37 77.51 Favored 'General case' 0 N--CA 1.451 -0.405 0 C-N-CA 123.935 0.894 . . . . 2.95 109.432 -169.567 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -67.29 38.23 0.21 Allowed Glycine 0 CA--C 1.532 1.136 0 C-N-CA 126.286 1.898 . . . . 0.44 114.035 170.231 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 60.6 p -146.62 22.43 1.29 Allowed 'General case' 0 N--CA 1.449 -0.503 0 O-C-N 120.342 -1.681 . . . . 2.17 112.07 159.747 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 36.2 t-20 -127.29 -46.17 1.5 Allowed 'General case' 0 CA--C 1.518 -0.267 0 CA-C-O 118.936 -0.554 . . . . 2.89 111.62 -176.558 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 29.2 mt -57.13 -35.97 70.11 Favored 'General case' 0 N--CA 1.467 0.395 0 CA-C-N 118.802 0.728 . . . . 0.45 110.896 -169.187 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER 179.53 175.72 0.7 Allowed 'General case' 0 C--O 1.233 0.221 0 C-N-CA 125.508 1.523 . . . . 0.51 107.203 175.233 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 7.9 m -55.86 -32.66 63.84 Favored 'General case' 0 N--CA 1.452 -0.326 0 O-C-N 121.597 -0.689 . . . . 0.93 110.582 165.15 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -63.28 -26.77 68.93 Favored 'General case' 0 C--N 1.342 0.271 0 CA-C-O 121.142 0.496 . . . . 1.22 111.828 175.304 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -75.32 -8.83 84.09 Favored Glycine 0 N--CA 1.442 -0.958 0 CA-C-O 118.24 -1.311 . . . . 0.51 111.465 176.704 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 10.9 ttt-85 -113.06 -17.21 12.48 Favored 'General case' 0 CA--C 1.522 -0.097 0 CA-C-N 119.564 1.682 . . . . 2.7 112.579 -177.493 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -61.27 -168.14 0.01 OUTLIER 'General case' 0 CA--C 1.534 0.358 0 C-N-CA 123.537 0.735 . . . . 1.12 110.115 163.503 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -47.51 148.78 1.3 Allowed 'General case' 0 N--CA 1.464 0.244 0 O-C-N 121.561 -0.712 . . . . 2.05 111.665 -174.311 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 5.0 mt-10 -55.56 -30.26 60.46 Favored 'General case' 0 CA--C 1.534 0.361 0 CA-C-O 121.285 0.564 . . . . 4.68 110.759 -179.862 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -66.18 -35.08 79.53 Favored 'General case' 0 N--CA 1.453 -0.281 0 C-N-CA 124.044 0.938 . . . . 0.63 113.056 176.484 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 6.4 mt-10 -76.27 -41.37 49.14 Favored 'General case' 0 CA--C 1.516 -0.331 0 O-C-N 121.48 -0.763 . . . . 1.89 110.626 176.943 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 50.4 t80 -50.41 -51.85 42.71 Favored 'General case' 0 N--CA 1.451 -0.395 0 C-N-CA 124.441 1.097 . . . . 0.5 110.68 170.024 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 58.0 t80 -65.79 -46.63 77.98 Favored 'General case' 0 CA--C 1.537 0.457 0 O-C-N 121.34 -0.85 . . . . 0.6 110.824 -179.472 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -61.27 -48.97 78.96 Favored 'General case' 0 CA--C 1.535 0.392 0 O-C-N 121.195 -0.94 . . . . 0.35 112.045 -175.345 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -61.96 -37.54 85.14 Favored 'General case' 0 N--CA 1.454 -0.245 0 O-C-N 121.346 -0.846 . . . . 3.58 110.58 173.487 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -55.26 -42.79 73.97 Favored 'General case' 0 C--O 1.22 -0.472 0 CA-C-N 119.009 0.822 . . . . 0.4 109.979 175.329 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -55.8 -51.11 68.57 Favored 'General case' 0 N--CA 1.466 0.339 0 CA-C-N 119.263 0.938 . . . . 3.56 112.147 172.464 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 23.3 ttt180 -50.88 -57.14 9.23 Favored 'General case' 0 CA--C 1.535 0.374 0 N-CA-C 109.409 -0.589 . . . . 2.26 109.409 179.007 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 73' ' ' LEU . . . . . 0.462 ' HB3' HG21 ' A' ' 85' ' ' VAL . 0.1 OUTLIER -66.37 -28.42 68.64 Favored 'General case' 0 C--N 1.326 -0.423 0 C-N-CA 125.128 1.371 . . . . 0.46 111.686 -177.197 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 2.1 ttp -64.66 -36.45 84.32 Favored 'General case' 0 N--CA 1.452 -0.372 0 O-C-N 121.98 -0.45 . . . . 2.98 109.971 -178.832 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 75' ' ' HIS . . . . . 0.467 ' CE1' HD12 ' A' ' 15' ' ' ILE . 26.2 p80 -88.04 -39.85 14.31 Favored 'General case' 0 N--CA 1.452 -0.369 0 CA-C-O 115.827 -2.035 . . . . 1.13 110.591 -178.977 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 21.9 m -5.51 113.37 0.01 OUTLIER 'General case' 0 C--N 1.346 0.443 0 C-N-CA 128.254 2.621 . . . . 1.03 114.361 -171.403 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 3.0 p -47.07 -44.61 21.09 Favored 'General case' 0 N--CA 1.451 -0.401 0 C-N-CA 124.975 1.31 . . . . 1.16 110.27 179.692 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 9.9 t0 -65.86 106.58 1.58 Allowed 'General case' 0 N--CA 1.449 -0.482 0 CA-C-O 121.827 0.822 . . . . 1.91 109.141 166.105 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 54.8 m170 -57.11 -33.04 66.93 Favored 'General case' 0 N--CA 1.454 -0.27 0 CA-C-O 118.974 -0.536 . . . . 5.31 111.04 177.667 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -59.65 -46.74 88.1 Favored 'General case' 0 N--CA 1.45 -0.451 0 CA-C-N 118.713 0.688 . . . . 0.78 110.397 -179.743 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 5.7 mt-10 -48.71 -41.64 32.47 Favored 'General case' 0 C--O 1.232 0.148 0 C-N-CA 123.901 0.88 . . . . 2.68 111.008 176.952 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -64.37 -47.52 78.97 Favored 'General case' 0 C--N 1.329 -0.31 0 N-CA-C 108.518 -0.919 . . . . 3.06 108.518 179.123 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 1.3 mm? -64.99 -18.9 65.69 Favored 'General case' 0 N--CA 1.453 -0.285 0 CA-C-O 117.119 -1.419 . . . . 0.49 113.087 175.573 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -63.69 -49.83 71.61 Favored 'General case' 0 CA--C 1.519 -0.24 0 CA-C-N 122.077 2.217 . . . . 1.6 107.034 167.516 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 85' ' ' VAL . . . . . 0.462 HG21 ' HB3' ' A' ' 73' ' ' LEU . 58.9 t -55.07 -41.33 58.75 Favored 'Isoleucine or valine' 0 C--O 1.214 -0.776 0 CA-C-O 118.486 -0.768 . . . . 0.44 110.846 175.747 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 2.2 tm0? -77.94 -47.61 18.2 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 120.434 1.47 . . . . 3.04 111.844 -171.027 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 20.8 ttmt -54.58 -49.29 70.75 Favored 'General case' 0 C--O 1.226 -0.137 0 O-C-N 121.6 -0.688 . . . . 2.31 109.905 175.721 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 55.1 m-80 -72.73 -41.3 65.32 Favored 'General case' 0 C--O 1.225 -0.213 0 CA-C-O 119.703 -0.189 . . . . 2.25 111.159 -177.728 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -129.56 75.62 79.64 Favored Pre-proline 0 C--O 1.238 0.478 0 C-N-CA 125.832 1.653 . . . . 0.36 110.236 -173.509 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 27.2 Cg_endo -59.58 -33.28 96.92 Favored 'Trans proline' 0 N--CA 1.446 -1.284 0 C-N-CA 121.341 1.361 . . . . 2.02 110.288 -177.244 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 9.1 tttp -80.44 -51.6 8.63 Favored 'General case' 0 N--CA 1.45 -0.47 0 C-N-CA 125.177 1.391 . . . . 5.15 111.13 -173.524 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 5.7 m -54.19 -42.77 70.09 Favored 'General case' 0 N--CA 1.469 0.523 0 CA-C-N 119.378 0.99 . . . . 0.51 110.801 -179.53 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 21.0 t80 -57.52 -47.14 82.78 Favored 'General case' 0 CA--C 1.509 -0.626 0 CA-C-O 121.19 0.519 . . . . 2.16 111.644 179.32 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 21.0 tt0 -56.03 -36.18 67.71 Favored 'General case' 0 N--CA 1.443 -0.798 0 CA-C-N 115.02 -0.991 . . . . 1.75 109.929 178.993 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 9.1 t80 -66.45 -53.59 33.74 Favored 'General case' 0 N--CA 1.455 -0.187 0 C-N-CA 124.158 0.983 . . . . 1.01 110.275 -176.175 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 44.3 mm -59.4 -42.19 86.79 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.209 0 O-C-N 121.828 -0.545 . . . . 1.46 109.78 179.083 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 9.2 m-20 -58.36 -36.19 73.09 Favored 'General case' 0 CA--C 1.528 0.127 0 O-C-N 122.128 -0.357 . . . . 2.35 111.306 177.96 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 1.6 t0 . . . . . 0 CA--C 1.53 0.188 0 CA-C-O 121.963 0.887 . . . . 2.01 109.327 177.466 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 N--CA 1.458 -0.071 0 CA-C-O 121.666 0.746 . . . . 3.07 110.884 . . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 15' ' ' ILE . . . . . 0.424 HD12 ' CE1' ' A' ' 75' ' ' HIS . 0.4 OUTLIER -67.09 -33.46 63.35 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.434 0 O-C-N 121.99 -0.443 . . . . 0.51 111.314 -176.733 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 9.0 t-80 -62.63 -52.95 61.35 Favored 'General case' 0 N--CA 1.45 -0.472 0 N-CA-C 107.584 -1.265 . . . . 0.96 107.584 -178.765 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 20.2 mt-10 -60.51 -34.51 74.19 Favored 'General case' 0 N--CA 1.45 -0.456 0 C-N-CA 124.244 1.018 . . . . 2.83 110.566 179.132 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -52.3 -54.03 36.61 Favored 'General case' 0 CA--C 1.517 -0.29 0 CA-C-N 119.288 0.949 . . . . 2.41 110.512 171.429 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -47.63 -50.29 19.63 Favored Glycine 0 C--N 1.336 0.535 0 N-CA-C 110.277 -1.129 . . . . 0.73 110.277 172.459 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 20' ' ' HIS . . . . . 0.544 ' CE1' ' HB1' ' A' ' 64' ' ' ALA . 1.8 t-160 -62.26 -35.96 80.57 Favored 'General case' 0 N--CA 1.452 -0.341 0 O-C-N 121.918 -0.754 . . . . 2.02 112.676 -177.555 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -65.68 -32.2 73.64 Favored 'General case' 0 N--CA 1.45 -0.475 0 CA-C-N 119.068 0.849 . . . . 1.34 109.194 178.291 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 17.6 t -66.08 -38.64 82.46 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.239 0 C-N-CA 118.14 -1.424 . . . . 1.49 111.417 173.975 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 11.7 t70 . . . . . 0 N--CA 1.464 0.267 0 CA-C-O 121.863 0.84 . . . . 2.54 110.647 173.689 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 5.0 t70 . . . . . 0 N--CA 1.464 0.271 0 CA-C-O 122.327 1.061 . . . . 2.31 111.445 . . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 6.1 mm -58.6 -54.42 33.57 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.402 0 CA-C-N 115.046 -0.979 . . . . 0.93 108.547 179.14 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 28.8 t80 -60.9 -28.95 69.28 Favored 'General case' 0 C--O 1.226 -0.182 0 C-N-CA 124.967 1.307 . . . . 0.51 111.86 176.758 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 49' ' ' LYS . . . . . 0.421 ' CA ' ' HE2' ' A' ' 49' ' ' LYS . 0.1 OUTLIER -66.48 -46.86 74.88 Favored 'General case' 0 N--CA 1.453 -0.324 0 O-C-N 120.854 -1.154 . . . . 1.16 110.191 -172.643 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 6.4 tp10 -84.0 -57.72 3.08 Favored 'General case' 0 N--CA 1.451 -0.412 0 CA-C-O 121.903 0.859 . . . . 2.31 108.984 -179.712 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 20.6 mm-40 -82.62 -20.83 35.62 Favored 'General case' 0 C--O 1.234 0.279 0 O-C-N 121.631 -0.668 . . . . 2.65 111.385 -165.132 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -73.13 41.97 0.93 Allowed Glycine 0 CA--C 1.529 0.953 0 C-N-CA 124.729 1.157 . . . . 0.42 113.365 172.116 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 27.9 m -152.69 33.93 0.49 Allowed 'General case' 0 N--CA 1.453 -0.318 0 C-N-CA 126.57 1.948 . . . . 1.83 107.789 160.508 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 9.7 t-20 -144.73 -38.72 0.27 Allowed 'General case' 0 C--N 1.341 0.213 0 N-CA-C 113.242 0.83 . . . . 2.36 113.242 -161.928 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 16.2 mt -72.01 -38.59 69.58 Favored 'General case' 0 C--N 1.33 -0.257 0 O-C-N 122.236 -0.29 . . . . 0.68 110.947 179.167 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 4.4 t 171.03 172.72 0.07 Allowed 'General case' 0 N--CA 1.467 0.377 0 C-N-CA 125.579 1.551 . . . . 0.91 108.709 -171.412 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 7.6 m -61.56 -36.49 80.78 Favored 'General case' 0 N--CA 1.455 -0.224 0 C-N-CA 124.228 1.011 . . . . 1.34 111.037 172.587 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -65.86 -17.8 64.9 Favored 'General case' 0 CA--C 1.535 0.377 0 CA-C-N 118.107 0.412 . . . . 1.13 111.456 173.818 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -78.8 -12.81 83.79 Favored Glycine 0 N--CA 1.443 -0.85 0 CA-C-O 118.938 -0.923 . . . . 0.44 111.31 174.512 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 4.2 tmt_? -110.08 -15.6 13.99 Favored 'General case' 0 CA--C 1.523 -0.092 0 CA-C-N 119.149 1.475 . . . . 2.66 112.661 -176.946 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 1.3 p -61.8 -168.38 0.01 OUTLIER 'General case' 0 CA--C 1.537 0.447 0 C-N-CA 123.397 0.679 . . . . 1.11 109.798 162.332 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 9.7 m-20 -48.17 145.75 3.03 Favored 'General case' 0 N--CA 1.463 0.222 0 O-C-N 121.359 -0.838 . . . . 2.19 110.882 -177.95 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -50.51 -31.99 16.99 Favored 'General case' 0 CA--C 1.534 0.349 0 C-N-CA 123.99 0.916 . . . . 5.56 111.884 175.177 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 64' ' ' ALA . . . . . 0.544 ' HB1' ' CE1' ' A' ' 20' ' ' HIS . . . -61.11 -42.06 97.83 Favored 'General case' 0 N--CA 1.451 -0.418 0 C-N-CA 124.263 1.025 . . . . 0.52 110.438 178.311 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 7.9 mt-10 -69.82 -45.26 68.24 Favored 'General case' 0 N--CA 1.448 -0.528 0 CA-C-O 117.921 -1.038 . . . . 1.89 110.477 177.073 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 35.7 t80 -51.45 -45.01 62.53 Favored 'General case' 0 CA--C 1.533 0.315 0 C-N-CA 126.041 1.737 . . . . 0.36 112.005 175.303 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 90.4 t80 -69.23 -45.81 68.87 Favored 'General case' 0 C--N 1.328 -0.349 0 O-C-N 120.859 -1.151 . . . . 0.46 109.847 178.267 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -65.02 -39.4 93.36 Favored 'General case' 0 CA--C 1.542 0.65 0 O-C-N 121.495 -0.753 . . . . 0.36 112.058 -174.806 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -72.15 -33.78 68.01 Favored 'General case' 0 C--N 1.333 -0.135 0 O-C-N 121.092 -1.005 . . . . 3.8 110.266 175.233 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -54.01 -42.42 69.06 Favored 'General case' 0 C--O 1.223 -0.313 0 CA-C-N 119.114 0.87 . . . . 0.38 110.419 171.706 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 47.4 t80 -56.65 -49.94 73.55 Favored 'General case' 0 N--CA 1.466 0.357 0 CA-C-N 119.954 1.252 . . . . 4.15 111.315 171.667 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -49.45 -58.77 4.55 Favored 'General case' 0 C--N 1.34 0.157 0 CA-C-N 118.649 0.659 . . . . 3.73 109.791 -179.98 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 73' ' ' LEU . . . . . 0.574 ' CB ' HG21 ' A' ' 85' ' ' VAL . 0.1 OUTLIER -63.78 -27.89 69.5 Favored 'General case' 0 N--CA 1.45 -0.454 0 C-N-CA 124.888 1.275 . . . . 0.54 110.997 -175.429 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 1.5 tmt? -68.64 -36.03 78.06 Favored 'General case' 0 N--CA 1.448 -0.558 0 C-N-CA 122.695 0.398 . . . . 2.62 111.725 -178.988 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 75' ' ' HIS . . . . . 0.424 ' CE1' HD12 ' A' ' 15' ' ' ILE . 10.8 p80 -93.94 -10.6 33.23 Favored 'General case' 0 C--O 1.231 0.08 0 CA-C-O 117.384 -1.293 . . . . 1.2 113.169 -179.535 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 60.1 m -39.01 126.9 1.63 Allowed 'General case' 0 N--CA 1.449 -0.505 0 CA-C-O 123.028 1.394 . . . . 1.01 112.554 -169.488 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 4.1 p -53.53 -44.48 69.22 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 113.254 -1.793 . . . . 1.33 108.588 176.404 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 12.3 t0 -65.8 107.23 1.74 Allowed 'General case' 0 N--CA 1.447 -0.612 0 N-CA-C 108.717 -0.846 . . . . 2.37 108.717 167.151 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -55.9 -33.19 64.42 Favored 'General case' 0 N--CA 1.454 -0.267 0 CA-C-N 116.028 -0.533 . . . . 5.19 110.626 176.304 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -61.06 -49.51 77.06 Favored 'General case' 0 N--CA 1.447 -0.615 0 CA-C-O 118.205 -0.902 . . . . 0.84 110.323 -179.831 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 1.2 mt-10 -46.58 -42.56 16.2 Favored 'General case' 0 C--N 1.34 0.185 0 CA-C-N 119.263 0.938 . . . . 2.74 110.061 179.371 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 2.2 mtp180 -64.87 -54.0 37.89 Favored 'General case' 0 CA--C 1.517 -0.314 0 CA-C-N 115.714 -0.675 . . . . 2.99 109.556 -179.268 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 1.4 mm? -65.68 -17.33 64.52 Favored 'General case' 0 N--CA 1.452 -0.344 0 CA-C-O 117.774 -1.108 . . . . 0.5 112.774 179.89 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 2.5 mptm? -67.54 -48.12 67.9 Favored 'General case' 0 CA--C 1.517 -0.297 0 CA-C-N 121.175 1.807 . . . . 1.56 107.407 168.49 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 85' ' ' VAL . . . . . 0.574 HG21 ' CB ' ' A' ' 73' ' ' LEU . 93.0 t -57.37 -45.62 85.38 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.692 0 C-N-CA 120.452 -0.499 . . . . 0.51 110.689 175.942 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -71.18 -48.76 49.78 Favored 'General case' 0 N--CA 1.45 -0.447 0 CA-C-N 119.667 1.122 . . . . 1.77 110.857 -172.487 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 51.2 tttt -55.41 -51.81 65.63 Favored 'General case' 0 N--CA 1.451 -0.384 0 C-N-CA 124.34 1.056 . . . . 2.6 110.506 177.92 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 12.2 m-20 -64.64 -40.42 95.42 Favored 'General case' 0 N--CA 1.454 -0.262 0 C-N-CA 123.174 0.59 . . . . 1.54 109.967 -179.813 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -137.83 74.21 45.23 Favored Pre-proline 0 C--O 1.238 0.498 0 C-N-CA 125.961 1.705 . . . . 0.47 111.173 -165.136 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 40.5 Cg_endo -64.24 -16.79 56.95 Favored 'Trans proline' 0 N--CA 1.453 -0.908 0 C-N-CA 122.315 2.01 . . . . 1.98 111.934 -175.547 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 22.5 pttt -95.48 -40.28 9.55 Favored 'General case' 0 CA--C 1.531 0.231 0 C-N-CA 123.203 0.601 . . . . 3.42 112.352 -179.125 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 3.3 m -62.46 -45.3 93.69 Favored 'General case' 0 CA--C 1.521 -0.135 0 O-C-N 120.739 -1.225 . . . . 0.36 110.628 -179.522 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 10.3 t80 -61.22 -45.37 94.86 Favored 'General case' 0 CA--C 1.508 -0.659 0 C-N-CA 119.965 -0.694 . . . . 1.85 110.946 -179.906 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 36.7 tt0 -53.88 -37.56 63.84 Favored 'General case' 0 N--CA 1.44 -0.938 0 CA-C-N 114.995 -1.002 . . . . 1.89 110.097 177.212 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 4.9 t80 -60.69 -56.99 14.67 Favored 'General case' 0 N--CA 1.453 -0.276 0 N-CA-C 109.135 -0.691 . . . . 1.25 109.135 -177.74 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 33.9 mm -53.4 -44.07 53.88 Favored 'Isoleucine or valine' 0 C--O 1.227 -0.118 0 O-C-N 121.992 -0.443 . . . . 1.52 110.201 178.05 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 14.7 t30 -62.36 -30.81 71.45 Favored 'General case' 0 CA--C 1.531 0.225 0 C-N-CA 122.886 0.474 . . . . 1.48 111.999 -178.075 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 26.9 t70 . . . . . 0 C--O 1.231 0.095 0 C-N-CA 123.124 0.57 . . . . 2.64 110.273 174.989 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 N--CA 1.454 -0.226 0 CA-C-O 122.038 0.923 . . . . 3.04 109.319 . . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 15' ' ' ILE . . . . . 0.479 HG13 ' CG ' ' A' ' 72' ' ' ARG . 0.7 OUTLIER -64.56 -32.28 57.15 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.302 0 O-C-N 121.334 -0.854 . . . . 0.37 111.768 177.807 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 5.0 t60 -59.96 -47.68 84.82 Favored 'General case' 0 CA--C 1.532 0.268 0 N-CA-C 107.828 -1.175 . . . . 0.57 107.828 176.353 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 20.3 mt-10 -60.8 -38.55 85.72 Favored 'General case' 0 N--CA 1.454 -0.248 0 C-N-CA 124.321 1.048 . . . . 2.59 110.157 179.527 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 1.3 t80 -53.07 -45.99 68.36 Favored 'General case' 0 C--N 1.332 -0.169 0 C-N-CA 123.155 0.582 . . . . 2.26 110.028 172.856 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -48.57 -50.3 25.16 Favored Glycine 0 CA--C 1.529 0.94 0 N-CA-C 111.473 -0.651 . . . . 0.5 111.473 171.923 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 40.6 m-70 -58.84 -50.49 73.78 Favored 'General case' 0 C--O 1.224 -0.247 0 O-C-N 121.148 -1.207 . . . . 3.23 112.205 176.931 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -59.78 -27.92 66.97 Favored 'General case' 0 N--CA 1.453 -0.286 0 CA-C-N 118.227 0.467 . . . . 0.74 110.854 -176.938 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 53.9 t -69.11 -45.18 80.26 Favored 'Isoleucine or valine' 0 C--O 1.232 0.153 0 O-C-N 121.208 -0.933 . . . . 0.78 109.935 174.042 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 1.9 t0 . . . . . 0 C--N 1.327 -0.38 0 C-N-CA 124.453 1.101 . . . . 1.86 111.78 178.0 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 4.5 t0 . . . . . 0 N--CA 1.473 0.714 0 N-CA-C 109.048 -0.723 . . . . 2.74 109.048 . . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 5.8 mm -53.75 -56.07 10.71 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.331 0 N-CA-C 108.108 -1.071 . . . . 0.49 108.108 -174.801 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 48' ' ' PHE . . . . . 0.538 ' CD2' ' HG2' ' A' ' 63' ' ' GLU . 29.2 t80 -57.73 -34.36 69.42 Favored 'General case' 0 N--CA 1.452 -0.364 0 N-CA-C 113.068 0.766 . . . . 0.41 113.068 174.21 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 49' ' ' LYS . . . . . 0.534 ' HA ' ' HE2' ' A' ' 49' ' ' LYS . 9.3 mmpt? -62.88 -48.33 79.46 Favored 'General case' 0 N--CA 1.454 -0.234 0 O-C-N 120.531 -1.355 . . . . 1.17 111.575 -172.465 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -88.32 -62.95 1.37 Allowed 'General case' 0 C--N 1.329 -0.316 0 N-CA-C 107.226 -1.398 . . . . 4.04 107.226 -177.806 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 13.9 mm-40 -66.21 -34.56 78.3 Favored 'General case' 0 C--O 1.235 0.31 0 CA-C-O 121.369 0.604 . . . . 2.48 109.869 -167.954 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -69.37 34.47 0.33 Allowed Glycine 0 CA--C 1.531 1.071 0 C-N-CA 125.447 1.498 . . . . 0.49 113.328 169.463 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 60.8 p -146.57 27.93 1.09 Allowed 'General case' 0 N--CA 1.451 -0.383 0 O-C-N 120.195 -1.768 . . . . 1.64 110.585 157.152 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 52.5 t-20 -134.48 -47.06 0.75 Allowed 'General case' 0 N--CA 1.453 -0.284 0 CA-C-O 120.725 0.298 . . . . 1.63 111.149 -165.83 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 14.5 mt -63.42 -35.06 79.18 Favored 'General case' 0 C--N 1.333 -0.142 0 O-C-N 121.865 -0.522 . . . . 0.46 111.125 -176.666 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 1.5 t 175.19 167.88 0.31 Allowed 'General case' 0 CA--C 1.531 0.237 0 C-N-CA 125.488 1.515 . . . . 0.55 108.148 -178.272 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 9.7 m -59.53 -33.63 71.63 Favored 'General case' 0 N--CA 1.453 -0.281 0 C-N-CA 123.44 0.696 . . . . 0.92 110.827 168.835 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -66.83 -14.23 62.46 Favored 'General case' 0 CA--C 1.535 0.377 0 C-N-CA 122.775 0.43 . . . . 2.46 111.672 175.842 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -90.26 -11.59 62.63 Favored Glycine 0 N--CA 1.445 -0.733 0 C-N-CA 124.415 1.007 . . . . 0.61 111.105 175.239 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -104.41 -13.93 15.91 Favored 'General case' 0 CA--C 1.521 -0.166 0 CA-C-N 118.711 1.255 . . . . 2.95 112.314 179.177 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 1.3 p -59.83 -173.1 0.02 OUTLIER 'General case' 0 CA--C 1.541 0.607 0 C-N-CA 123.205 0.602 . . . . 1.16 110.006 161.834 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 98.1 m-20 -49.59 153.05 1.24 Allowed 'General case' 0 N--CA 1.467 0.409 0 O-C-N 121.347 -0.846 . . . . 1.58 111.793 -172.8 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 63' ' ' GLU . . . . . 0.538 ' HG2' ' CD2' ' A' ' 48' ' ' PHE . 42.0 mt-10 -54.32 -34.24 60.59 Favored 'General case' 0 CA--C 1.533 0.321 0 O-C-N 122.299 -0.251 . . . . 3.13 111.34 -179.684 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -56.12 -39.36 72.11 Favored 'General case' 0 C--N 1.334 -0.078 0 O-C-N 121.552 -0.718 . . . . 0.62 112.558 176.058 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 1.8 mm-40 -80.19 -34.92 37.08 Favored 'General case' 0 CA--C 1.508 -0.65 0 CA-C-O 118.664 -0.684 . . . . 2.98 110.592 -178.203 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 62.7 t80 -55.15 -48.9 73.07 Favored 'General case' 0 N--CA 1.449 -0.51 0 C-N-CA 123.928 0.891 . . . . 0.51 111.13 170.929 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 82.5 t80 -63.13 -44.7 94.84 Favored 'General case' 0 CA--C 1.535 0.371 0 O-C-N 121.028 -1.045 . . . . 0.68 110.398 175.648 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -60.94 -52.53 64.65 Favored 'General case' 0 CA--C 1.539 0.543 0 O-C-N 121.077 -1.015 . . . . 0.37 112.58 -175.213 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 1.9 pp20? -63.41 -33.29 75.22 Favored 'General case' 0 C--N 1.331 -0.196 0 C-N-CA 124.426 1.09 . . . . 3.73 111.213 174.915 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -53.09 -58.74 5.99 Favored 'General case' 0 C--O 1.222 -0.37 0 CA-C-O 118.075 -0.964 . . . . 0.51 108.741 170.331 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 44.5 t80 -48.5 -48.01 38.33 Favored 'General case' 0 N--CA 1.468 0.445 0 CA-C-N 119.654 1.115 . . . . 2.3 112.01 179.454 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 72' ' ' ARG . . . . . 0.479 ' CG ' HG13 ' A' ' 15' ' ' ILE . 2.4 tmm_? -48.34 -51.46 26.11 Favored 'General case' 0 CA--C 1.539 0.522 0 C-N-CA 122.544 0.338 . . . . 3.24 110.238 176.331 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 73' ' ' LEU . . . . . 0.642 HD12 HG23 ' A' ' 85' ' ' VAL . 0.1 OUTLIER -75.7 -27.35 58.2 Favored 'General case' 0 C--O 1.225 -0.186 0 C-N-CA 124.5 1.12 . . . . 0.49 111.924 -176.711 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 34.0 mmt -58.52 -40.82 83.98 Favored 'General case' 0 CA--C 1.516 -0.349 0 CA-C-N 118.931 0.787 . . . . 5.8 109.627 -179.941 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 22.9 p80 -90.2 -39.6 12.71 Favored 'General case' 0 N--CA 1.449 -0.483 0 CA-C-O 115.815 -2.04 . . . . 1.07 110.758 -176.975 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 3.6 m -3.18 112.46 0.01 OUTLIER 'General case' 0 C--N 1.349 0.569 0 C-N-CA 128.156 2.582 . . . . 1.0 114.445 -172.636 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 2.6 p -46.64 -43.91 17.96 Favored 'General case' 0 N--CA 1.451 -0.396 0 C-N-CA 125.366 1.466 . . . . 0.94 110.836 178.713 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 61.9 t0 -72.35 108.1 5.29 Favored 'General case' 0 N--CA 1.453 -0.313 0 C-N-CA 119.055 -1.058 . . . . 1.91 108.629 167.708 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 92.8 m-70 -50.39 -34.08 22.99 Favored 'General case' 0 N--CA 1.453 -0.292 0 C-N-CA 123.478 0.711 . . . . 5.25 110.93 175.14 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -53.57 -48.94 68.71 Favored 'General case' 0 N--CA 1.45 -0.435 0 CA-C-O 119.205 -0.426 . . . . 0.64 111.039 176.659 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -56.17 -38.52 71.03 Favored 'General case' 0 CA--C 1.52 -0.188 0 CA-C-N 118.363 0.529 . . . . 3.74 110.641 -178.847 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -64.86 -50.32 67.08 Favored 'General case' 0 N--CA 1.452 -0.335 0 N-CA-C 109.068 -0.716 . . . . 3.15 109.068 179.111 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 1.2 mm? -65.11 -21.75 66.85 Favored 'General case' 0 N--CA 1.451 -0.378 0 CA-C-O 118.166 -0.921 . . . . 0.43 112.548 178.241 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 30.6 mttt -66.98 -46.62 74.05 Favored 'General case' 0 C--O 1.222 -0.387 0 N-CA-C 107.083 -1.451 . . . . 1.69 107.083 171.889 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 85' ' ' VAL . . . . . 0.642 HG23 HD12 ' A' ' 73' ' ' LEU . 86.8 t -59.87 -43.32 91.76 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.688 0 C-N-CA 119.541 -0.864 . . . . 0.49 112.183 173.965 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 86' ' ' GLN . . . . . 0.445 ' HG2' ' CG ' ' A' ' 93' ' ' PHE . 1.4 mm-40 -67.76 -53.13 29.75 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 120.554 1.525 . . . . 2.62 110.735 -174.994 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 18.6 tttm -52.82 -50.47 63.62 Favored 'General case' 0 N--CA 1.453 -0.279 0 C-N-CA 125.148 1.379 . . . . 2.07 110.431 177.606 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 5.8 m-20 -67.27 -36.03 80.74 Favored 'General case' 0 N--CA 1.452 -0.327 0 CA-C-O 118.894 -0.574 . . . . 1.1 110.501 -179.034 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -141.06 80.8 16.65 Favored Pre-proline 0 C--O 1.238 0.491 0 C-N-CA 126.266 1.826 . . . . 0.35 110.968 -168.686 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 92.6 Cg_endo -80.26 37.97 0.71 Allowed 'Trans proline' 0 CA--C 1.541 0.837 0 C-N-CA 123.525 2.817 . . . . 1.53 111.974 -176.498 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 2.0 ptmt -155.51 -47.88 0.08 Allowed 'General case' 0 CA--C 1.531 0.225 0 C-N-CA 125.431 1.492 . . . . 2.76 110.079 -175.34 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 3.6 m -53.94 -45.21 71.19 Favored 'General case' 0 N--CA 1.463 0.187 0 O-C-N 121.041 -1.037 . . . . 0.39 110.323 171.957 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 93' ' ' PHE . . . . . 0.445 ' CG ' ' HG2' ' A' ' 86' ' ' GLN . 7.8 t80 -56.82 -47.92 79.16 Favored 'General case' 0 CA--C 1.505 -0.755 0 C-N-CA 120.281 -0.568 . . . . 2.33 111.396 178.582 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 56.3 tt0 -51.27 -35.67 38.47 Favored 'General case' 0 N--CA 1.447 -0.624 0 CA-C-N 115.533 -0.758 . . . . 2.22 110.655 179.934 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 9.0 t80 -55.68 -59.6 4.63 Favored 'General case' 0 CA--C 1.532 0.252 0 CA-C-N 118.534 0.606 . . . . 1.64 110.83 -176.907 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 3.8 mp -69.43 -32.86 54.77 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.202 0 O-C-N 121.624 -0.673 . . . . 1.22 109.297 -178.846 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 47.2 t30 -60.37 -31.78 70.66 Favored 'General case' 0 N--CA 1.453 -0.284 0 O-C-N 121.807 -0.558 . . . . 2.15 110.606 -179.243 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 N--CA 1.456 -0.126 0 C-N-CA 124.688 1.195 . . . . 2.18 108.67 171.15 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 28.2 t80 . . . . . 0 C--O 1.226 -0.172 0 N-CA-C 108.813 -0.81 . . . . 3.36 108.813 . . . . . . . . . 0 0 . 1 . 021 nuclear build core ' A' A ' 15' ' ' ILE . . . . . 0.411 HD12 ' CE1' ' A' ' 75' ' ' HIS . 0.5 OUTLIER -64.19 -32.51 57.72 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.229 0 CA-C-O 118.832 -0.604 . . . . 0.42 112.456 178.705 . . . . . . . . 3 3 . 1 . 021 nuclear build core ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 3.7 t-80 -55.47 -57.91 9.95 Favored 'General case' 0 C--N 1.342 0.261 0 N-CA-C 106.78 -1.563 . . . . 0.46 106.78 176.23 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 6.5 mt-10 -58.84 -36.35 74.41 Favored 'General case' 0 C--O 1.223 -0.307 0 C-N-CA 124.078 0.951 . . . . 3.06 110.624 -178.619 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 1.8 t80 -56.81 -51.33 69.38 Favored 'General case' 0 CA--C 1.521 -0.158 0 C-N-CA 124.075 0.95 . . . . 1.98 110.386 176.907 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -51.79 -45.15 55.49 Favored Glycine 0 CA--C 1.526 0.746 0 N-CA-C 110.309 -1.116 . . . . 0.56 110.309 175.681 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 17.1 t-80 -62.35 -42.91 99.78 Favored 'General case' 0 N--CA 1.451 -0.384 0 O-C-N 122.075 -0.662 . . . . 1.79 111.401 179.445 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -65.42 -30.0 70.75 Favored 'General case' 0 N--CA 1.452 -0.339 0 O-C-N 121.242 -0.911 . . . . 0.79 110.02 179.175 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 71.2 t -71.92 -34.73 51.99 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.175 0 O-C-N 121.067 -1.021 . . . . 1.21 110.278 177.121 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 18.0 t70 . . . . . 0 C--O 1.233 0.203 0 CA-C-O 120.952 0.406 . . . . 1.84 111.581 172.787 . . . . . . . . 0 0 . 1 . 021 nuclear build core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 26.6 p-10 . . . . . 0 CA--C 1.533 0.322 0 CA-C-O 120.699 0.285 . . . . 3.94 110.584 . . . . . . . . . 0 0 . 1 . 021 nuclear build core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 4.6 mm -55.7 -49.97 70.68 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.416 0 C-N-CA 127.316 2.246 . . . . 0.55 107.504 176.138 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 26.5 t80 -60.58 -36.63 79.0 Favored 'General case' 0 N--CA 1.449 -0.498 0 C-N-CA 123.874 0.87 . . . . 0.54 112.866 174.155 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 49' ' ' LYS . . . . . 0.526 ' HA ' ' HE2' ' A' ' 49' ' ' LYS . 10.2 mmpt? -62.61 -46.8 86.62 Favored 'General case' 0 CA--C 1.519 -0.248 0 C-N-CA 118.576 -1.25 . . . . 1.03 110.542 -173.41 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 4.6 tp10 -85.05 -64.76 1.1 Allowed 'General case' 0 N--CA 1.449 -0.479 0 CA-C-O 121.916 0.865 . . . . 2.18 108.669 -177.825 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 14.2 mm-40 -72.52 -29.58 63.72 Favored 'General case' 0 CA--C 1.533 0.324 0 O-C-N 121.609 -0.682 . . . . 2.54 110.331 -167.835 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -70.57 37.8 0.47 Allowed Glycine 0 CA--C 1.528 0.902 0 C-N-CA 125.844 1.688 . . . . 0.37 113.869 169.487 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 63.8 p -142.41 23.89 1.96 Allowed 'General case' 0 N--CA 1.447 -0.624 0 O-C-N 121.085 -1.244 . . . . 1.85 110.152 157.497 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -134.26 -39.45 0.83 Allowed 'General case' 0 C--N 1.341 0.209 0 N-CA-C 112.842 0.682 . . . . 1.76 112.842 -164.541 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 55' ' ' LEU . . . . . 0.514 HD22 HG22 ' A' ' 85' ' ' VAL . 25.7 mt -65.91 -36.6 83.83 Favored 'General case' 0 N--CA 1.463 0.175 0 C-N-CA 120.118 -0.633 . . . . 0.42 110.495 -177.988 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER 178.23 169.65 0.77 Allowed 'General case' 0 CA--C 1.533 0.32 0 C-N-CA 125.622 1.569 . . . . 0.49 107.908 -178.762 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 16.4 m -59.19 -37.88 78.5 Favored 'General case' 0 CA--C 1.529 0.15 0 C-N-CA 124.026 0.93 . . . . 0.91 110.994 171.628 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -60.13 -32.92 71.46 Favored 'General case' 0 C--O 1.223 -0.34 0 C-N-CA 123.784 0.834 . . . . 1.54 109.175 172.53 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -64.06 -6.16 18.05 Favored Glycine 0 CA--C 1.524 0.594 0 O-C-N 121.196 -0.94 . . . . 0.39 112.442 176.46 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -121.57 0.88 10.0 Favored 'General case' 0 N--CA 1.454 -0.27 0 CA-C-N 119.01 1.405 . . . . 4.36 112.491 -177.49 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 58.9 p -73.92 -127.58 0.01 OUTLIER 'General case' 0 CA--C 1.534 0.359 0 N-CA-C 108.881 -0.785 . . . . 0.93 108.881 174.834 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 1.7 m120 -74.63 150.91 39.43 Favored 'General case' 0 CA--C 1.531 0.23 0 O-C-N 120.072 -1.642 . . . . 1.68 108.822 176.484 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 31.0 tt0 -62.41 -24.23 67.28 Favored 'General case' 0 CA--C 1.539 0.523 0 O-C-N 121.596 -0.69 . . . . 3.34 111.191 179.615 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -67.33 -33.89 76.19 Favored 'General case' 0 N--CA 1.454 -0.241 0 C-N-CA 124.15 0.98 . . . . 0.77 112.132 173.364 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 3.3 mt-10 -75.97 -49.61 17.22 Favored 'General case' 0 C--O 1.219 -0.525 0 N-CA-C 108.23 -1.026 . . . . 2.07 108.23 177.778 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 59.8 t80 -40.06 -51.31 2.59 Favored 'General case' 0 CA--C 1.537 0.464 0 C-N-CA 123.885 0.874 . . . . 0.37 111.874 170.932 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 62.9 t80 -60.82 -43.89 97.61 Favored 'General case' 0 CA--C 1.539 0.54 0 O-C-N 121.705 -0.622 . . . . 0.47 111.887 174.927 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -62.11 -52.07 65.34 Favored 'General case' 0 CA--C 1.535 0.368 0 C-N-CA 124.647 1.179 . . . . 0.33 112.352 -177.951 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 4.5 mp0 -57.29 -43.69 83.38 Favored 'General case' 0 CA--C 1.515 -0.402 0 O-C-N 121.075 -1.015 . . . . 4.46 109.89 172.56 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -57.49 -34.57 69.19 Favored 'General case' 0 N--CA 1.451 -0.396 0 CA-C-N 118.286 0.494 . . . . 0.5 110.421 -179.544 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -60.51 -55.67 30.58 Favored 'General case' 0 CA--C 1.534 0.363 0 C-N-CA 124.057 0.943 . . . . 2.99 111.385 169.917 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -48.92 -53.8 18.1 Favored 'General case' 0 CA--C 1.536 0.408 0 O-C-N 121.513 -0.742 . . . . 3.89 110.407 178.61 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -68.69 -49.16 61.14 Favored 'General case' 0 N--CA 1.449 -0.521 0 C-N-CA 126.465 1.906 . . . . 0.52 109.586 -171.509 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -63.16 -26.5 68.84 Favored 'General case' 0 CA--C 1.529 0.158 0 O-C-N 120.719 -1.238 . . . . 2.67 111.895 -178.506 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 75' ' ' HIS . . . . . 0.411 ' CE1' HD12 ' A' ' 15' ' ' ILE . 0.3 OUTLIER -91.23 -13.97 31.8 Favored 'General case' 0 C--N 1.338 0.106 0 CA-C-O 117.627 -1.177 . . . . 1.01 111.736 175.974 . . . . . . . . 3 3 . 1 . 021 nuclear build core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 73.5 p -46.61 123.72 5.27 Favored 'General case' 0 N--CA 1.447 -0.585 0 CA-C-O 122.819 1.295 . . . . 2.17 108.611 -168.666 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -52.82 -39.75 62.7 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 113.604 -1.635 . . . . 1.36 109.206 -179.254 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 78' ' ' ASP . . . . . 0.417 ' OD2' ' HB3' ' A' ' 80' ' ' ALA . 17.3 t0 -68.1 104.45 1.79 Allowed 'General case' 0 N--CA 1.444 -0.759 0 CA-C-O 122.411 1.1 . . . . 2.03 110.466 167.816 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 9.0 p-80 -39.46 -40.9 0.9 Allowed 'General case' 0 N--CA 1.453 -0.299 0 CA-C-N 114.904 -1.044 . . . . 4.52 113.362 168.609 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 80' ' ' ALA . . . . . 0.417 ' HB3' ' OD2' ' A' ' 78' ' ' ASP . . . -65.15 -48.23 74.26 Favored 'General case' 0 N--CA 1.45 -0.469 0 CA-C-N 119.159 0.891 . . . . 0.64 110.273 -176.001 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 3.6 mt-10 -50.28 -38.14 39.65 Favored 'General case' 0 N--CA 1.454 -0.256 0 CA-C-N 118.884 0.766 . . . . 2.88 110.949 175.631 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 2.6 mtp180 -63.97 -52.51 59.32 Favored 'General case' 0 CA--C 1.516 -0.33 0 C-N-CA 119.156 -1.018 . . . . 2.44 109.733 177.8 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 1.3 mm? -60.19 -23.68 64.18 Favored 'General case' 0 N--CA 1.452 -0.356 0 CA-C-O 117.819 -1.086 . . . . 0.52 112.267 178.778 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 2.7 mptm? -61.46 -43.9 98.05 Favored 'General case' 0 C--O 1.224 -0.283 0 CA-C-N 120.811 1.641 . . . . 1.3 108.791 172.061 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 85' ' ' VAL . . . . . 0.514 HG22 HD22 ' A' ' 55' ' ' LEU . 61.7 t -62.22 -61.83 1.44 Allowed 'Isoleucine or valine' 0 C--O 1.221 -0.431 0 CA-C-N 118.898 0.772 . . . . 0.55 109.745 171.321 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -55.12 -30.55 59.98 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 119.046 0.839 . . . . 2.67 113.073 -168.274 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 43.1 tttt -75.98 -60.17 2.44 Favored 'General case' 0 N--CA 1.451 -0.402 0 C-N-CA 125.526 1.531 . . . . 2.32 109.932 173.117 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 10.0 m-20 -76.79 6.51 5.96 Favored 'General case' 0 CA--C 1.533 0.303 0 C-N-CA 123.776 0.83 . . . . 1.25 111.917 -172.798 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 89' ' ' ALA . . . . . 0.509 ' HB2' HD21 ' A' ' 55' ' ' LEU . . . -162.21 73.66 2.26 Favored Pre-proline 0 N--CA 1.445 -0.724 0 C-N-CA 125.657 1.583 . . . . 0.41 108.625 -176.85 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 68.7 Cg_endo -81.82 49.85 3.3 Favored 'Trans proline' 0 CA--C 1.539 0.749 0 C-N-CA 124.041 3.161 . . . . 2.04 111.513 -172.726 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 1.2 ptmt -175.01 -49.99 0.01 OUTLIER 'General case' 0 C--O 1.225 -0.229 0 C-N-CA 126.972 2.109 . . . . 2.42 109.407 -173.783 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 3.2 m -53.2 -41.97 65.83 Favored 'General case' 0 N--CA 1.462 0.163 0 O-C-N 121.293 -0.879 . . . . 0.41 111.448 176.694 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 34.2 t80 -57.88 -52.46 65.4 Favored 'General case' 0 CA--C 1.503 -0.854 0 C-N-CA 120.127 -0.629 . . . . 2.36 110.971 177.251 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 32.2 tt0 -53.22 -34.11 55.67 Favored 'General case' 0 N--CA 1.444 -0.764 0 CA-C-N 115.148 -0.933 . . . . 1.89 110.043 178.152 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 6.0 t80 -61.7 -58.13 9.23 Favored 'General case' 0 N--CA 1.451 -0.408 0 C-N-CA 123.138 0.575 . . . . 1.05 110.393 -176.711 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 4.2 mp -63.21 -33.87 63.58 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.195 0 O-C-N 120.912 -1.117 . . . . 0.89 109.695 176.912 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -60.89 -33.06 72.54 Favored 'General case' 0 CA--C 1.535 0.382 0 CA-C-N 118.814 0.734 . . . . 1.71 110.839 -178.592 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 28.0 t70 . . . . . 0 N--CA 1.464 0.257 0 C-N-CA 124.542 1.137 . . . . 2.98 110.009 172.794 . . . . . . . . 0 0 . 1 . 022 nuclear build core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 1.1 t80 . . . . . 0 N--CA 1.455 -0.176 0 N-CA-C 109.139 -0.689 . . . . 2.61 109.139 . . . . . . . . . 0 0 . 1 . 022 nuclear build core ' A' A ' 15' ' ' ILE . . . . . 0.405 HD12 ' CE1' ' A' ' 75' ' ' HIS . 1.1 pt -62.11 -36.37 73.9 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.301 0 CA-C-O 119.12 -0.467 . . . . 0.4 112.057 175.625 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 3.5 t60 -58.25 -54.52 46.05 Favored 'General case' 0 CA--C 1.534 0.363 0 N-CA-C 107.286 -1.376 . . . . 0.46 107.286 176.99 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 5.6 mt-10 -50.14 -49.05 53.28 Favored 'General case' 0 C--O 1.224 -0.255 0 C-N-CA 124.755 1.222 . . . . 3.03 109.38 176.673 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -53.72 -47.98 70.05 Favored 'General case' 0 CA--C 1.518 -0.265 0 C-N-CA 124.829 1.252 . . . . 2.29 110.933 -178.931 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -49.06 -49.65 29.48 Favored Glycine 0 CA--C 1.524 0.617 0 N-CA-C 110.393 -1.083 . . . . 0.43 110.393 173.614 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 20' ' ' HIS . . . . . 0.576 ' CE1' ' HB1' ' A' ' 64' ' ' ALA . 2.1 t-160 -61.33 -43.25 99.19 Favored 'General case' 0 N--CA 1.452 -0.331 0 O-C-N 121.901 -0.764 . . . . 1.95 111.413 178.041 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -61.94 -29.6 70.34 Favored 'General case' 0 N--CA 1.45 -0.464 0 O-C-N 120.909 -1.12 . . . . 0.62 110.396 -179.474 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 90.2 t -68.01 -41.11 84.25 Favored 'Isoleucine or valine' 0 CA--C 1.52 -0.201 0 O-C-N 121.332 -0.855 . . . . 0.81 110.07 174.594 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 17.0 t0 . . . . . 0 C--O 1.234 0.263 0 CA-C-O 121.779 0.8 . . . . 2.1 111.087 173.9 . . . . . . . . 0 0 . 1 . 022 nuclear build core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 2.9 t70 . . . . . 0 C--O 1.225 -0.203 0 N-CA-C 109.319 -0.623 . . . . 2.31 109.319 . . . . . . . . . 0 0 . 1 . 022 nuclear build core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 7.9 mm -44.78 -57.19 0.75 Allowed 'Isoleucine or valine' 0 CA--C 1.539 0.53 0 C-N-CA 125.53 1.532 . . . . 0.67 109.075 169.799 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 18.0 t80 -60.2 -32.44 71.1 Favored 'General case' 0 C--O 1.222 -0.36 0 O-C-N 120.219 -1.551 . . . . 0.44 112.778 176.253 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 49' ' ' LYS . . . . . 0.537 ' HA ' ' HE2' ' A' ' 49' ' ' LYS . 7.0 mmpt? -66.17 -48.57 70.29 Favored 'General case' 0 C--N 1.327 -0.401 0 O-C-N 119.964 -1.71 . . . . 1.06 111.227 -177.259 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 6.2 tp10 -86.96 -62.96 1.39 Allowed 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 108.117 -1.068 . . . . 2.41 108.117 -175.162 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 29.8 mp0 -68.45 -30.3 69.13 Favored 'General case' 0 C--O 1.235 0.338 0 O-C-N 121.701 -0.624 . . . . 2.38 111.041 -173.361 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -70.37 44.67 0.59 Allowed Glycine 0 CA--C 1.529 0.948 0 C-N-CA 125.154 1.359 . . . . 0.4 113.927 169.123 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 52.3 p -150.72 31.77 0.63 Allowed 'General case' 0 N--CA 1.448 -0.563 0 O-C-N 120.879 -1.365 . . . . 1.86 109.942 159.962 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 3.4 t-20 -143.85 -44.28 0.27 Allowed 'General case' 0 N--CA 1.454 -0.269 0 N-CA-C 112.4 0.519 . . . . 1.68 112.4 -166.151 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 55' ' ' LEU . . . . . 0.59 HD21 ' HB2' ' A' ' 89' ' ' ALA . 15.4 mt -59.96 -35.62 75.36 Favored 'General case' 0 N--CA 1.464 0.235 0 O-C-N 122.324 -0.235 . . . . 0.5 111.124 -176.714 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER 178.15 171.61 0.7 Allowed 'General case' 0 CA--C 1.532 0.257 0 C-N-CA 126.148 1.779 . . . . 0.53 106.886 179.961 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 13.2 m -61.24 -35.15 76.47 Favored 'General case' 0 N--CA 1.455 -0.214 0 O-C-N 121.599 -0.688 . . . . 0.94 110.442 168.391 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -69.3 -4.06 16.51 Favored 'General case' 0 CA--C 1.535 0.383 0 N-CA-C 112.315 0.487 . . . . 1.41 112.315 173.182 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -93.73 -6.97 61.86 Favored Glycine 0 N--CA 1.446 -0.681 0 CA-C-O 118.771 -1.016 . . . . 0.42 111.084 173.131 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 54.1 ttt180 -111.15 -17.52 13.2 Favored 'General case' 0 C--O 1.23 0.076 0 CA-C-N 119.14 1.47 . . . . 3.38 111.832 179.555 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 21.7 p -61.56 -163.95 0.01 OUTLIER 'General case' 0 CA--C 1.54 0.57 0 C-N-CA 123.532 0.733 . . . . 0.84 109.73 167.976 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 2.8 m-20 -46.37 144.2 2.2 Favored 'General case' 0 CA--C 1.53 0.189 0 O-C-N 120.682 -1.262 . . . . 1.56 111.455 -176.951 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -55.38 -32.1 62.33 Favored 'General case' 0 CA--C 1.532 0.267 0 CA-C-O 121.811 0.815 . . . . 2.83 110.493 -179.604 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 64' ' ' ALA . . . . . 0.576 ' HB1' ' CE1' ' A' ' 20' ' ' HIS . . . -59.1 -39.68 82.95 Favored 'General case' 0 N--CA 1.448 -0.572 0 C-N-CA 123.74 0.816 . . . . 0.56 112.382 176.538 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 9.3 mt-10 -71.81 -43.02 66.35 Favored 'General case' 0 C--O 1.223 -0.315 0 O-C-N 121.306 -0.871 . . . . 2.21 110.618 175.67 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 53.3 t80 -50.01 -50.36 47.57 Favored 'General case' 0 CA--C 1.531 0.215 0 C-N-CA 123.524 0.73 . . . . 0.46 110.764 175.125 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 72.2 t80 -62.91 -45.05 94.33 Favored 'General case' 0 N--CA 1.451 -0.418 0 C-N-CA 123.738 0.815 . . . . 0.46 110.928 177.298 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -61.31 -48.89 79.29 Favored 'General case' 0 CA--C 1.537 0.455 0 O-C-N 121.078 -1.013 . . . . 0.31 111.464 -176.051 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 6.4 mm-40 -56.02 -44.12 78.41 Favored 'General case' 0 CA--C 1.515 -0.381 0 C-N-CA 124.244 1.018 . . . . 4.01 110.732 170.394 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -54.37 -43.71 71.59 Favored 'General case' 0 N--CA 1.451 -0.408 0 CA-C-O 118.662 -0.685 . . . . 0.37 109.423 -178.423 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 14.9 t80 -58.02 -52.28 66.19 Favored 'General case' 0 N--CA 1.463 0.188 0 C-N-CA 123.756 0.823 . . . . 2.18 111.995 171.849 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 4.0 tmm_? -47.14 -52.57 15.11 Favored 'General case' 0 N--CA 1.465 0.321 0 C-N-CA 123.592 0.757 . . . . 2.52 110.191 179.917 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 73' ' ' LEU . . . . . 0.749 HD12 HG23 ' A' ' 85' ' ' VAL . 0.2 OUTLIER -66.44 -37.96 86.34 Favored 'General case' 0 C--N 1.329 -0.298 0 C-N-CA 126.55 1.94 . . . . 0.49 111.003 178.297 . . . . . . . . 3 3 . 1 . 022 nuclear build core ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER -58.7 -37.57 76.38 Favored 'General case' 0 C--O 1.233 0.193 0 C-N-CA 123.385 0.674 . . . . 2.39 111.506 -172.093 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 75' ' ' HIS . . . . . 0.405 ' CE1' HD12 ' A' ' 15' ' ' ILE . 10.0 p80 -95.43 -7.81 37.28 Favored 'General case' 0 CA--C 1.529 0.145 0 CA-C-O 116.395 -1.764 . . . . 0.93 113.503 -179.979 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 7.6 m -38.53 125.01 1.36 Allowed 'General case' 0 C--N 1.342 0.277 0 CA-C-N 120.413 1.461 . . . . 0.99 111.861 -167.006 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 2.7 p -51.94 -43.4 63.45 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 113.491 -1.686 . . . . 0.99 109.045 176.7 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 10.6 t0 -66.84 106.15 1.8 Allowed 'General case' 0 N--CA 1.448 -0.531 0 N-CA-C 108.565 -0.902 . . . . 1.97 108.565 164.132 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 5.0 t-80 -62.36 -25.47 67.93 Favored 'General case' 0 N--CA 1.454 -0.264 0 O-C-N 121.373 -0.829 . . . . 6.05 111.213 179.491 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -64.24 -43.76 93.94 Favored 'General case' 0 N--CA 1.452 -0.33 0 CA-C-N 118.988 0.813 . . . . 0.75 110.529 176.87 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 81' ' ' GLU . . . . . 0.542 ' HA ' ' HE3' ' A' ' 84' ' ' LYS . 7.5 mt-10 -49.77 -39.06 36.66 Favored 'General case' 0 CA--C 1.513 -0.451 0 C-N-CA 124.094 0.958 . . . . 2.6 111.521 176.738 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 8.4 mtp180 -62.61 -47.68 82.71 Favored 'General case' 0 C--N 1.325 -0.482 0 N-CA-C 108.707 -0.849 . . . . 2.52 108.707 177.765 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 83' ' ' LEU . . . . . 0.416 HD13 ' HA ' ' A' ' 83' ' ' LEU . 1.6 mm? -64.81 -21.09 66.71 Favored 'General case' 0 N--CA 1.453 -0.316 0 CA-C-O 117.163 -1.398 . . . . 0.5 113.671 173.887 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 84' ' ' LYS . . . . . 0.542 ' HE3' ' HA ' ' A' ' 81' ' ' GLU . 0.0 OUTLIER -64.61 -43.52 93.48 Favored 'General case' 0 N--CA 1.463 0.202 0 CA-C-N 122.234 2.288 . . . . 2.22 107.594 170.053 . . . . . . . . 3 3 . 1 . 022 nuclear build core ' A' A ' 85' ' ' VAL . . . . . 0.749 HG23 HD12 ' A' ' 73' ' ' LEU . 68.3 t -63.18 -59.23 4.69 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.603 0 CA-C-O 117.267 -1.349 . . . . 0.41 110.792 173.786 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 15.5 mt-30 -53.84 -44.15 70.05 Favored 'General case' 0 N--CA 1.465 0.286 0 CA-C-N 122.14 2.246 . . . . 1.78 112.29 -176.415 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 34.2 tttm -57.33 -48.24 79.48 Favored 'General case' 0 N--CA 1.449 -0.493 0 O-C-N 121.306 -0.871 . . . . 2.13 110.903 178.139 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 6.3 m-20 -90.12 -0.37 57.57 Favored 'General case' 0 C--N 1.328 -0.327 0 C-N-CA 122.584 0.353 . . . . 0.92 111.037 -174.635 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 89' ' ' ALA . . . . . 0.59 ' HB2' HD21 ' A' ' 55' ' ' LEU . . . -168.48 57.62 0.35 Allowed Pre-proline 0 CA--C 1.536 0.418 0 C-N-CA 124.876 1.27 . . . . 0.46 109.764 -163.789 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 34.3 Cg_endo -61.12 -36.33 81.87 Favored 'Trans proline' 0 N--CA 1.455 -0.744 0 C-N-CA 121.87 1.713 . . . . 2.32 109.501 -174.302 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 2.6 ptpt -75.82 -44.85 39.07 Favored 'General case' 0 N--CA 1.449 -0.489 0 C-N-CA 124.498 1.119 . . . . 2.4 112.342 177.706 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 3.6 m -58.64 -45.13 89.95 Favored 'General case' 0 N--CA 1.463 0.178 0 CA-C-N 120.355 1.434 . . . . 0.38 110.675 -176.424 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 17.2 t80 -59.46 -49.53 77.44 Favored 'General case' 0 CA--C 1.508 -0.657 0 CA-C-O 120.99 0.424 . . . . 2.2 110.083 178.267 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 26.1 tt0 -57.79 -28.72 64.26 Favored 'General case' 0 N--CA 1.445 -0.713 0 CA-C-N 115.283 -0.871 . . . . 1.4 110.449 -178.64 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 8.7 t80 -64.37 -57.79 8.33 Favored 'General case' 0 N--CA 1.452 -0.348 0 C-N-CA 123.683 0.793 . . . . 1.36 110.445 -176.579 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 96' ' ' ILE . . . . . 0.419 HD12 ' H ' ' A' ' 96' ' ' ILE . 3.7 mp -58.05 -39.45 72.5 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.187 0 N-CA-C 108.894 -0.78 . . . . 0.87 108.894 174.79 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 14.4 t30 -62.6 -30.83 71.63 Favored 'General case' 0 CA--C 1.536 0.412 0 O-C-N 121.55 -0.719 . . . . 1.48 111.601 -178.869 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 2.1 t0 . . . . . 0 C--O 1.23 0.079 0 C-N-CA 125.306 1.442 . . . . 2.23 108.544 174.899 . . . . . . . . 0 0 . 1 . 023 nuclear build core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 36.1 t80 . . . . . 0 CA--C 1.515 -0.4 0 N-CA-C 109.689 -0.485 . . . . 4.14 109.689 . . . . . . . . . 0 0 . 1 . 023 nuclear build core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER -62.6 -36.22 74.07 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.32 0 O-C-N 122.064 -0.398 . . . . 0.55 111.815 -178.084 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 9.6 t60 -59.94 -55.49 33.43 Favored 'General case' 0 C--N 1.343 0.305 0 N-CA-C 107.168 -1.419 . . . . 0.48 107.168 176.715 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 43.6 mt-10 -58.7 -32.45 69.18 Favored 'General case' 0 N--CA 1.456 -0.173 0 C-N-CA 123.463 0.705 . . . . 1.96 112.251 -179.626 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 24.8 t80 -59.94 -40.75 90.03 Favored 'General case' 0 CA--C 1.517 -0.292 0 CA-C-N 118.797 0.726 . . . . 3.82 109.2 177.213 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -52.04 -46.98 55.5 Favored Glycine 0 CA--C 1.53 0.981 0 C-N-CA 120.622 -0.799 . . . . 0.58 111.452 170.583 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 42.3 m-70 -58.18 -47.11 84.44 Favored 'General case' 0 N--CA 1.464 0.262 0 CA-C-N 119.119 1.46 . . . . 3.65 111.384 176.121 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -59.43 -30.54 68.55 Favored 'General case' 0 N--CA 1.454 -0.267 0 O-C-N 122.105 -0.372 . . . . 0.84 110.943 -178.619 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 77.1 t -72.21 -42.33 66.51 Favored 'Isoleucine or valine' 0 C--O 1.232 0.146 0 O-C-N 121.205 -0.934 . . . . 1.07 110.5 177.581 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--N 1.329 -0.298 0 C-N-CA 123.195 0.598 . . . . 2.21 110.893 172.011 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 9.1 t70 . . . . . 0 CA--C 1.529 0.147 0 CA-C-O 121.36 0.6 . . . . 2.52 110.057 . . . . . . . . . 0 0 . 1 . 023 nuclear build core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 3.6 mm -51.1 -59.65 1.19 Allowed 'Isoleucine or valine' 0 CA--C 1.535 0.396 0 C-N-CA 125.81 1.644 . . . . 0.56 109.321 -174.067 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 24.8 t80 -54.94 -34.67 63.44 Favored 'General case' 0 C--N 1.329 -0.316 0 O-C-N 121.365 -0.835 . . . . 0.51 112.558 177.878 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 49' ' ' LYS . . . . . 0.56 ' HA ' ' HE2' ' A' ' 49' ' ' LYS . 0.1 OUTLIER -65.59 -40.54 92.81 Favored 'General case' 0 N--CA 1.452 -0.356 0 O-C-N 120.365 -1.459 . . . . 1.05 111.581 -176.127 . . . . . . . . 3 3 . 1 . 023 nuclear build core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 4.9 tp10 -89.68 -65.78 0.98 Allowed 'General case' 0 N--CA 1.452 -0.362 0 N-CA-C 108.834 -0.802 . . . . 2.12 108.834 -178.719 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 51' ' ' GLU . . . . . 0.403 ' OE1' ' HE2' ' A' ' 91' ' ' LYS . 9.9 mp0 -68.49 -27.71 66.37 Favored 'General case' 0 C--O 1.234 0.285 0 O-C-N 121.478 -0.764 . . . . 3.09 111.109 -171.795 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 52' ' ' GLY . . . . . 0.415 ' HA2' ' CD1' ' A' ' 66' ' ' PHE . . . -67.99 37.29 0.24 Allowed Glycine 0 CA--C 1.53 1.01 0 C-N-CA 125.254 1.407 . . . . 0.34 114.018 169.81 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 59.6 p -146.62 20.77 1.32 Allowed 'General case' 0 N--CA 1.448 -0.559 0 O-C-N 120.695 -1.473 . . . . 2.07 111.485 159.996 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 46.8 t30 -130.93 -38.34 1.26 Allowed 'General case' 0 C--N 1.342 0.245 0 N-CA-C 112.954 0.724 . . . . 1.83 112.954 -165.227 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 22.9 mt -68.36 -36.23 78.91 Favored 'General case' 0 N--CA 1.463 0.198 0 O-C-N 121.434 -0.791 . . . . 0.57 110.615 -178.36 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 1.4 t 176.93 169.95 0.52 Allowed 'General case' 0 CA--C 1.53 0.189 0 C-N-CA 125.313 1.445 . . . . 0.57 108.043 -175.155 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 8.2 m -61.24 -31.3 71.09 Favored 'General case' 0 N--CA 1.453 -0.285 0 C-N-CA 123.466 0.707 . . . . 1.02 110.909 170.296 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -64.63 -23.13 67.16 Favored 'General case' 0 N--CA 1.464 0.237 0 CA-C-O 121.089 0.471 . . . . 1.01 111.253 173.269 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -74.51 -12.77 82.23 Favored Glycine 0 N--CA 1.443 -0.89 0 CA-C-O 118.722 -1.044 . . . . 0.47 111.313 175.156 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 60.0 ttt-85 -110.02 -16.01 13.92 Favored 'General case' 0 C--O 1.23 0.075 0 CA-C-N 119.177 1.489 . . . . 2.34 112.76 -177.623 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 1.5 p -60.71 -169.21 0.01 OUTLIER 'General case' 0 CA--C 1.536 0.436 0 C-N-CA 122.487 0.315 . . . . 0.91 110.281 166.645 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 5.3 m120 -45.92 147.29 1.02 Allowed 'General case' 0 C--N 1.341 0.211 0 O-C-N 121.346 -0.846 . . . . 2.09 111.065 179.606 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 14.1 tm-20 -61.44 -28.89 69.59 Favored 'General case' 0 CA--C 1.533 0.321 0 CA-C-O 120.649 0.261 . . . . 3.38 111.017 -173.999 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -52.36 -37.15 55.49 Favored 'General case' 0 CA--C 1.52 -0.203 0 N-CA-C 113.414 0.894 . . . . 0.49 113.414 171.854 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 2.3 mm-40 -84.89 -35.96 21.83 Favored 'General case' 0 C--N 1.322 -0.613 0 C-N-CA 124.468 1.107 . . . . 2.59 110.039 -173.84 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 66' ' ' PHE . . . . . 0.415 ' CD1' ' HA2' ' A' ' 52' ' ' GLY . 67.9 t80 -53.02 -50.47 64.2 Favored 'General case' 0 N--CA 1.453 -0.284 0 C-N-CA 124.403 1.081 . . . . 0.32 111.219 166.555 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 77.5 t80 -63.03 -48.14 80.03 Favored 'General case' 0 CA--C 1.535 0.375 0 O-C-N 121.237 -0.915 . . . . 0.38 110.432 178.424 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -61.66 -53.47 55.67 Favored 'General case' 0 CA--C 1.536 0.426 0 N-CA-C 114.106 1.151 . . . . 0.45 114.106 -176.524 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -58.81 -40.23 83.48 Favored 'General case' 0 C--N 1.329 -0.29 0 O-C-N 121.019 -1.051 . . . . 3.69 110.821 174.094 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -55.93 -42.04 75.51 Favored 'General case' 0 C--O 1.222 -0.35 0 CA-C-N 118.52 0.6 . . . . 0.61 110.326 174.258 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -54.56 -51.44 65.23 Favored 'General case' 0 N--CA 1.464 0.229 0 C-N-CA 123.943 0.897 . . . . 3.14 111.375 172.45 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 52.2 ttt-85 -51.96 -50.13 61.83 Favored 'General case' 0 N--CA 1.462 0.148 0 CA-C-N 117.918 0.326 . . . . 2.2 110.206 179.363 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 73' ' ' LEU . . . . . 0.503 ' CB ' HG21 ' A' ' 85' ' ' VAL . 0.1 OUTLIER -68.7 -30.81 69.55 Favored 'General case' 0 C--N 1.328 -0.351 0 C-N-CA 124.389 1.075 . . . . 0.56 110.938 -178.388 . . . . . . . . 3 3 . 1 . 023 nuclear build core ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 2.4 ttp -63.73 -34.54 78.1 Favored 'General case' 0 N--CA 1.454 -0.244 0 C-N-CA 123.267 0.627 . . . . 2.63 111.059 -174.614 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 10.0 p80 -99.21 1.46 44.85 Favored 'General case' 0 CA--C 1.531 0.227 0 CA-C-O 116.663 -1.637 . . . . 1.22 113.724 178.679 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 6.7 m -42.31 120.37 1.62 Allowed 'General case' 0 C--N 1.343 0.304 0 CA-C-N 120.573 1.533 . . . . 1.26 110.473 -171.843 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 2.7 p -48.34 -43.88 33.79 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 113.744 -1.571 . . . . 1.31 109.064 178.449 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 11.7 t0 -69.72 105.91 2.9 Favored 'General case' 0 N--CA 1.446 -0.652 0 CA-C-O 122.006 0.908 . . . . 1.99 109.291 163.942 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 49.4 p-80 -49.38 -38.4 28.46 Favored 'General case' 0 N--CA 1.453 -0.285 0 CA-C-N 115.476 -0.784 . . . . 4.34 111.98 173.605 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -61.52 -42.41 98.77 Favored 'General case' 0 C--N 1.331 -0.209 0 O-C-N 121.689 -0.632 . . . . 1.07 110.778 -177.741 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 81' ' ' GLU . . . . . 0.423 ' HA ' ' HD3' ' A' ' 84' ' ' LYS . 18.7 mm-40 -53.77 -36.87 62.86 Favored 'General case' 0 N--CA 1.451 -0.424 0 C-N-CA 123.183 0.593 . . . . 4.41 111.964 175.429 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 14.6 mtp180 -65.06 -46.26 81.93 Favored 'General case' 0 C--N 1.325 -0.471 0 C-N-CA 119.022 -1.071 . . . . 2.32 108.683 176.861 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 1.6 mm? -62.29 -23.17 66.58 Favored 'General case' 0 N--CA 1.455 -0.195 0 CA-C-O 117.724 -1.132 . . . . 0.47 112.909 175.88 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 84' ' ' LYS . . . . . 0.423 ' HD3' ' HA ' ' A' ' 81' ' ' GLU . 2.4 mptm? -60.98 -46.15 91.93 Favored 'General case' 0 CA--C 1.516 -0.329 0 CA-C-N 120.922 1.692 . . . . 1.38 108.18 169.891 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 85' ' ' VAL . . . . . 0.503 HG21 ' CB ' ' A' ' 73' ' ' LEU . 90.3 t -62.12 -61.08 1.79 Allowed 'Isoleucine or valine' 0 N--CA 1.45 -0.463 0 CA-C-O 118.141 -0.933 . . . . 0.43 109.951 176.448 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 2.5 mt-30 -50.03 -49.67 50.16 Favored 'General case' 0 CA--C 1.53 0.183 0 CA-C-N 119.842 1.201 . . . . 1.9 111.88 -173.058 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 13.2 ptpt -65.99 -40.37 91.12 Favored 'General case' 0 N--CA 1.456 -0.157 0 O-C-N 121.896 -0.503 . . . . 4.1 111.055 -176.227 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 52.1 m-20 -79.43 -10.78 59.88 Favored 'General case' 0 N--CA 1.461 0.105 0 N-CA-C 112.051 0.389 . . . . 1.77 112.051 -179.694 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -155.7 71.48 5.38 Favored Pre-proline 0 N--CA 1.446 -0.64 0 C-N-CA 124.409 1.084 . . . . 0.43 109.413 -170.568 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 76.5 Cg_endo -81.13 60.49 7.85 Favored 'Trans proline' 0 N--CA 1.459 -0.552 0 C-N-CA 124.506 3.471 . . . . 1.7 110.822 -173.769 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 91' ' ' LYS . . . . . 0.403 ' HE2' ' OE1' ' A' ' 51' ' ' GLU . 5.4 ptmt 175.03 -51.52 0.01 OUTLIER 'General case' 0 C--O 1.224 -0.287 0 C-N-CA 126.986 2.114 . . . . 2.14 109.716 -170.202 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 2.9 m -57.34 -44.93 84.67 Favored 'General case' 0 CA--C 1.522 -0.116 0 CA-C-N 119.286 0.948 . . . . 0.39 110.245 176.946 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 8.0 t80 -59.25 -47.46 85.27 Favored 'General case' 0 CA--C 1.506 -0.716 0 C-N-CA 120.309 -0.557 . . . . 1.95 110.391 177.709 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 54.4 tt0 -57.34 -33.83 68.16 Favored 'General case' 0 N--CA 1.44 -0.946 0 CA-C-N 115.173 -0.921 . . . . 1.75 110.594 178.085 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 6.2 t80 -62.63 -54.49 38.69 Favored 'General case' 0 C--N 1.333 -0.117 0 N-CA-C 108.645 -0.872 . . . . 1.15 108.645 -175.016 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 3.0 mp -60.34 -42.05 89.39 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.37 0 N-CA-C 108.475 -0.935 . . . . 0.83 108.475 176.677 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 3.2 t30 -62.32 -25.99 68.18 Favored 'General case' 0 CA--C 1.535 0.377 0 CA-C-N 118.413 0.551 . . . . 1.46 111.857 -177.305 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 7.8 t70 . . . . . 0 C--O 1.228 -0.07 0 C-N-CA 124.627 1.171 . . . . 2.17 109.202 176.609 . . . . . . . . 0 0 . 1 . 024 nuclear build core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.455 -0.193 0 CA-C-O 122.071 0.939 . . . . 2.81 109.17 . . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER -71.4 -29.3 34.86 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.453 0 CA-C-N 115.867 -0.606 . . . . 0.86 111.641 -176.249 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 3.9 t60 -59.96 -53.37 58.69 Favored 'General case' 0 N--CA 1.453 -0.303 0 N-CA-C 106.749 -1.575 . . . . 0.92 106.749 176.759 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 13.0 mm-40 -63.37 -30.72 71.8 Favored 'General case' 0 N--CA 1.449 -0.501 0 CA-C-O 117.943 -1.027 . . . . 4.6 111.672 -177.13 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 1.0 OUTLIER -53.37 -54.55 35.01 Favored 'General case' 0 N--CA 1.464 0.24 0 CA-C-N 119.975 1.261 . . . . 2.46 111.085 168.042 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -48.81 -47.19 31.3 Favored Glycine 0 CA--C 1.524 0.594 0 N-CA-C 109.808 -1.317 . . . . 0.96 109.808 174.997 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 1.8 t-160 -63.28 -41.65 99.03 Favored 'General case' 0 N--CA 1.447 -0.577 0 N-CA-C 113.295 0.85 . . . . 1.75 113.295 -176.565 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -65.93 -30.98 71.65 Favored 'General case' 0 N--CA 1.449 -0.506 0 C-N-CA 123.734 0.814 . . . . 1.22 109.238 -178.759 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 93.5 t -68.52 -37.1 77.25 Favored 'Isoleucine or valine' 0 C--O 1.233 0.222 0 C-N-CA 118.57 -1.252 . . . . 1.32 110.27 173.589 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 1.7 t70 . . . . . 0 C--N 1.331 -0.217 0 N-CA-C 111.968 0.359 . . . . 2.05 111.968 173.291 . . . . . . . . 0 0 . 1 . 024 nuclear build core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 5.0 t70 . . . . . 0 N--CA 1.47 0.553 0 N-CA-C 108.557 -0.905 . . . . 2.54 108.557 . . . . . . . . . 0 0 . 1 . 024 nuclear build core ' A' A ' 47' ' ' ILE . . . . . 0.507 HD13 ' HE2' ' A' ' 91' ' ' LYS . 5.1 mm -49.17 -56.15 3.03 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.478 0 C-N-CA 125.976 1.71 . . . . 0.72 108.229 176.903 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 26.4 t80 -63.38 -30.35 71.5 Favored 'General case' 0 C--N 1.328 -0.351 0 O-C-N 120.51 -1.369 . . . . 0.95 113.052 175.803 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 49' ' ' LYS . . . . . 0.498 ' HA ' ' HE2' ' A' ' 49' ' ' LYS . 0.4 OUTLIER -63.67 -50.72 68.13 Favored 'General case' 0 C--N 1.33 -0.252 0 O-C-N 120.138 -1.601 . . . . 1.72 110.76 -178.898 . . . . . . . . 3 3 . 1 . 024 nuclear build core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 17.3 tt0 -90.63 -53.41 4.43 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.957 0.408 . . . . 3.78 110.024 -171.823 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 10.0 mp0 -74.07 -29.66 61.99 Favored 'General case' 0 C--O 1.235 0.303 0 O-C-N 121.249 -0.907 . . . . 2.78 110.6 -176.978 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 52' ' ' GLY . . . . . 0.445 ' HA2' ' CD1' ' A' ' 66' ' ' PHE . . . -71.16 33.69 0.53 Allowed Glycine 0 CA--C 1.528 0.878 0 C-N-CA 124.613 1.101 . . . . 0.62 114.306 173.462 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 44.7 t -149.15 43.19 0.95 Allowed 'General case' 0 N--CA 1.447 -0.595 0 N-CA-C 107.678 -1.231 . . . . 1.69 107.678 158.592 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -145.4 -44.41 0.22 Allowed 'General case' 0 CA--C 1.518 -0.286 0 N-CA-C 113.226 0.824 . . . . 2.14 113.226 -176.436 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 19.3 mt -55.72 -40.63 72.7 Favored 'General case' 0 N--CA 1.462 0.16 0 CA-C-O 121.118 0.485 . . . . 0.46 111.445 -174.879 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 56' ' ' THR . . . . . 0.4 HG23 ' H ' ' A' ' 59' ' ' GLY . 0.0 OUTLIER -179.79 162.1 1.03 Allowed 'General case' 0 C--N 1.329 -0.309 0 N-CA-C 106.855 -1.535 . . . . 0.45 106.855 -178.254 . . . . . . . . 3 3 . 1 . 024 nuclear build core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 74.3 m -59.11 -33.47 70.88 Favored 'General case' 0 N--CA 1.456 -0.151 0 O-C-N 122.155 -0.341 . . . . 1.31 110.235 171.779 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 58' ' ' TYR . . . . . 0.406 ' O ' HG22 ' A' ' 61' ' ' THR . 0.1 OUTLIER -61.71 -39.51 91.74 Favored 'General case' 0 C--O 1.226 -0.161 0 O-C-N 121.786 -0.571 . . . . 1.17 110.255 177.149 . . . . . . . . 3 3 . 1 . 024 nuclear build core ' A' A ' 59' ' ' GLY . . . . . 0.4 ' H ' HG23 ' A' ' 56' ' ' THR . . . -74.44 -2.02 62.44 Favored Glycine 0 CA--C 1.526 0.737 0 C-N-CA 123.613 0.625 . . . . 0.88 112.313 -179.956 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 59.9 ttt180 -97.33 -7.13 32.71 Favored 'General case' 0 N--CA 1.452 -0.361 0 CA-C-N 117.965 0.883 . . . . 4.14 111.561 174.46 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 61' ' ' THR . . . . . 0.457 HG23 ' N ' ' A' ' 62' ' ' ASN . 1.6 t -63.53 -167.24 0.02 OUTLIER 'General case' 0 CA--C 1.53 0.18 0 CA-C-O 121.574 0.702 . . . . 3.43 110.233 166.908 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 62' ' ' ASN . . . . . 0.457 ' N ' HG23 ' A' ' 61' ' ' THR . 2.3 m120 -46.71 150.56 0.69 Allowed 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 121.279 0.561 . . . . 2.59 111.166 170.344 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 12.6 tm-20 -53.87 -24.38 15.7 Favored 'General case' 0 CA--C 1.537 0.451 0 C-N-CA 124.098 0.959 . . . . 4.28 111.667 -177.877 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -47.11 -57.46 5.06 Favored 'General case' 0 N--CA 1.45 -0.465 0 C-N-CA 125.215 1.406 . . . . 0.84 113.738 169.763 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 3.3 mt-10 -85.55 -19.49 31.04 Favored 'General case' 0 CA--C 1.514 -0.434 0 C-N-CA 118.01 -1.476 . . . . 3.17 110.798 -175.824 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 66' ' ' PHE . . . . . 0.445 ' CD1' ' HA2' ' A' ' 52' ' ' GLY . 68.3 t80 -55.35 -51.56 66.39 Favored 'General case' 0 N--CA 1.449 -0.497 0 CA-C-N 118.277 0.49 . . . . 0.51 110.117 166.883 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 87.7 t80 -69.24 -47.17 65.49 Favored 'General case' 0 N--CA 1.445 -0.692 0 C-N-CA 123.58 0.752 . . . . 0.52 110.188 -176.981 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -65.18 -45.93 82.85 Favored 'General case' 0 CA--C 1.538 0.493 0 O-C-N 121.757 -0.589 . . . . 0.53 111.575 -175.747 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 9.4 mm-40 -61.37 -42.21 98.34 Favored 'General case' 0 N--CA 1.462 0.151 0 O-C-N 121.175 -0.953 . . . . 4.76 110.541 171.442 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -57.36 -41.16 79.59 Favored 'General case' 0 C--O 1.224 -0.285 0 O-C-N 121.25 -0.906 . . . . 0.45 110.23 -179.715 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 51.1 t80 -59.66 -50.13 75.06 Favored 'General case' 0 C--O 1.231 0.083 0 CA-C-N 118.777 0.717 . . . . 3.55 111.0 174.769 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 34.4 ttt180 -47.63 -58.23 4.52 Favored 'General case' 0 N--CA 1.465 0.292 0 O-C-N 121.755 -0.59 . . . . 2.26 109.902 176.281 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 73' ' ' LEU . . . . . 0.606 ' CB ' HG21 ' A' ' 85' ' ' VAL . 0.1 OUTLIER -64.23 -27.45 69.06 Favored 'General case' 0 C--N 1.329 -0.325 0 C-N-CA 125.376 1.471 . . . . 0.62 110.923 -177.101 . . . . . . . . 3 3 . 1 . 024 nuclear build core ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 1.7 ttp -58.99 -42.97 91.31 Favored 'General case' 0 N--CA 1.452 -0.365 0 C-N-CA 123.12 0.568 . . . . 2.53 110.772 -178.358 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 17.0 p80 -93.55 -37.56 11.84 Favored 'General case' 0 C--O 1.225 -0.23 0 CA-C-O 115.576 -2.154 . . . . 1.64 112.34 179.792 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 2.6 m 4.19 112.22 0.0 OUTLIER 'General case' 0 N--CA 1.471 0.579 0 C-N-CA 128.285 2.634 . . . . 1.15 115.099 -176.238 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 2.0 p -43.65 -44.32 6.3 Favored 'General case' 0 N--CA 1.452 -0.354 0 C-N-CA 125.628 1.571 . . . . 1.44 111.571 177.576 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 56.9 t0 -73.98 105.36 5.19 Favored 'General case' 0 N--CA 1.454 -0.264 0 C-N-CA 117.495 -1.682 . . . . 2.33 108.827 166.639 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 4.1 p-80 -39.91 -39.12 0.78 Allowed 'General case' 0 CA--C 1.531 0.231 0 C-N-CA 124.355 1.062 . . . . 5.28 112.665 170.616 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -60.86 -44.61 96.8 Favored 'General case' 0 N--CA 1.449 -0.497 0 CA-C-O 118.983 -0.532 . . . . 1.08 110.752 -177.582 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -52.44 -38.83 60.12 Favored 'General case' 0 CA--C 1.518 -0.251 0 CA-C-O 121.222 0.534 . . . . 3.89 110.522 177.83 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -64.82 -48.52 74.07 Favored 'General case' 0 N--CA 1.451 -0.381 0 N-CA-C 108.595 -0.891 . . . . 3.3 108.595 179.799 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 1.6 mm? -62.69 -25.72 68.3 Favored 'General case' 0 N--CA 1.454 -0.233 0 CA-C-O 118.132 -0.937 . . . . 1.24 112.724 175.99 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 14.8 mttt -65.18 -44.09 89.58 Favored 'General case' 0 CA--C 1.518 -0.261 0 CA-C-N 120.528 1.513 . . . . 1.45 108.084 174.256 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 85' ' ' VAL . . . . . 0.606 HG21 ' CB ' ' A' ' 73' ' ' LEU . 96.6 t -63.19 -60.18 3.18 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.544 0 CA-C-O 117.295 -1.336 . . . . 0.51 111.191 173.605 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 24.1 mt-30 -49.91 -51.11 43.32 Favored 'General case' 0 N--CA 1.463 0.189 0 CA-C-N 121.425 1.921 . . . . 2.34 111.827 -177.277 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.92 -37.65 88.36 Favored 'General case' 0 CA--C 1.531 0.234 0 O-C-N 121.545 -0.722 . . . . 2.42 110.933 -175.656 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 83.0 m-20 -85.45 -5.78 59.26 Favored 'General case' 0 CA--C 1.531 0.237 0 CA-C-N 118.091 0.405 . . . . 1.13 111.134 179.869 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -159.93 74.34 3.07 Favored Pre-proline 0 N--CA 1.446 -0.629 0 C-N-CA 125.016 1.326 . . . . 0.35 109.482 -173.903 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 85.3 Cg_endo -82.05 50.78 3.57 Favored 'Trans proline' 0 CA--C 1.536 0.582 0 C-N-CA 124.294 3.329 . . . . 1.65 110.96 -175.479 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 91' ' ' LYS . . . . . 0.507 ' HE2' HD13 ' A' ' 47' ' ' ILE . 0.1 OUTLIER -169.1 -57.57 0.02 OUTLIER 'General case' 0 N--CA 1.451 -0.393 0 C-N-CA 126.777 2.031 . . . . 2.31 108.28 -174.189 . . . . . . . . 3 3 . 1 . 024 nuclear build core ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 3.9 m -50.15 -45.5 53.27 Favored 'General case' 0 N--CA 1.464 0.226 0 C-N-CA 123.835 0.854 . . . . 0.48 112.276 178.02 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 16.6 t80 -57.31 -50.75 71.94 Favored 'General case' 0 CA--C 1.512 -0.507 0 CA-C-O 121.843 0.83 . . . . 2.57 110.712 179.03 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 23.2 tt0 -60.19 -28.33 67.88 Favored 'General case' 0 N--CA 1.441 -0.908 0 CA-C-N 114.221 -1.354 . . . . 2.83 110.007 -179.083 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 4.5 t80 -65.73 -55.75 15.69 Favored 'General case' 0 N--CA 1.452 -0.354 0 C-N-CA 124.364 1.065 . . . . 1.17 110.205 -177.754 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 2.8 mp -56.67 -45.1 82.54 Favored 'Isoleucine or valine' 0 C--O 1.228 -0.068 0 N-CA-C 107.961 -1.125 . . . . 0.83 107.961 176.34 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 5.3 t30 -58.24 -33.08 68.97 Favored 'General case' 0 CA--C 1.538 0.516 0 N-CA-C 111.962 0.356 . . . . 1.62 111.962 -178.891 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 28.8 t70 . . . . . 0 CA--C 1.517 -0.306 0 C-N-CA 125.203 1.401 . . . . 1.97 110.777 178.459 . . . . . . . . 0 0 . 1 . 025 nuclear build core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 3.2 t80 . . . . . 0 C--O 1.227 -0.12 0 CA-C-O 121.081 0.467 . . . . 3.08 111.24 . . . . . . . . . 0 0 . 1 . 025 nuclear build core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 0.5 OUTLIER -66.17 -34.37 69.74 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.501 0 O-C-N 121.567 -0.708 . . . . 0.62 112.159 -177.907 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 24.4 t-80 -63.38 -53.0 59.33 Favored 'General case' 0 N--CA 1.453 -0.295 0 N-CA-C 107.832 -1.173 . . . . 0.97 107.832 179.916 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 17.2 mt-10 -58.63 -38.66 78.54 Favored 'General case' 0 N--CA 1.449 -0.477 0 C-N-CA 127.398 2.279 . . . . 2.92 110.004 179.683 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -51.56 -47.05 63.6 Favored 'General case' 0 CA--C 1.519 -0.225 0 C-N-CA 123.709 0.804 . . . . 2.33 109.689 170.829 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -48.77 -49.26 28.57 Favored Glycine 0 CA--C 1.527 0.841 0 CA-C-O 119.728 -0.484 . . . . 0.58 111.912 171.851 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 60.4 m-70 -60.62 -45.4 94.17 Favored 'General case' 0 C--O 1.223 -0.299 0 CA-C-N 119.338 1.569 . . . . 3.55 111.422 176.115 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -62.19 -24.42 67.19 Favored 'General case' 0 CA--C 1.534 0.339 0 O-C-N 121.019 -1.051 . . . . 1.08 111.159 -179.474 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 78.3 t -78.26 -35.7 20.02 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.183 0 O-C-N 121.197 -0.94 . . . . 1.44 110.938 173.44 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 15.1 t0 . . . . . 0 C--N 1.333 -0.109 0 C-N-CA 124.37 1.068 . . . . 2.7 109.716 171.278 . . . . . . . . 0 0 . 1 . 025 nuclear build core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 21.5 t70 . . . . . 0 N--CA 1.47 0.56 0 CA-C-O 120.617 0.246 . . . . 2.25 110.823 . . . . . . . . . 0 0 . 1 . 025 nuclear build core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 5.2 mm -46.92 -52.13 4.37 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.622 0 C-N-CA 125.244 1.418 . . . . 0.96 108.839 174.175 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 33.9 t80 -63.97 -28.01 69.52 Favored 'General case' 0 N--CA 1.453 -0.287 0 O-C-N 120.785 -1.197 . . . . 0.44 113.288 179.322 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 49' ' ' LYS . . . . . 0.497 ' HA ' ' HE2' ' A' ' 49' ' ' LYS . 10.5 mmpt? -68.97 -48.76 62.35 Favored 'General case' 0 C--N 1.329 -0.323 0 O-C-N 119.908 -1.745 . . . . 0.98 110.834 -177.838 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 4.2 tp10 -84.88 -58.48 2.69 Favored 'General case' 0 N--CA 1.453 -0.322 0 N-CA-C 108.743 -0.836 . . . . 2.21 108.743 -174.232 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 20.7 mp0 -74.56 -31.74 62.19 Favored 'General case' 0 C--O 1.235 0.3 0 O-C-N 121.052 -1.03 . . . . 2.68 110.982 -174.844 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 52' ' ' GLY . . . . . 0.403 ' HA2' ' CD1' ' A' ' 66' ' ' PHE . . . -72.39 42.98 0.85 Allowed Glycine 0 CA--C 1.531 1.091 0 C-N-CA 125.097 1.332 . . . . 0.4 114.336 174.354 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 27.9 t -155.03 35.15 0.39 Allowed 'General case' 0 N--CA 1.451 -0.409 0 O-C-N 121.048 -1.266 . . . . 1.88 108.614 153.332 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 42.9 t30 -140.52 -40.56 0.42 Allowed 'General case' 0 C--N 1.341 0.197 0 N-CA-C 112.728 0.64 . . . . 1.94 112.728 -164.997 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 30.9 mt -64.31 -38.68 91.91 Favored 'General case' 0 C--N 1.332 -0.177 0 O-C-N 121.85 -0.531 . . . . 0.64 110.754 178.209 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 1.4 t 177.57 171.6 0.6 Allowed 'General case' 0 CA--C 1.531 0.241 0 C-N-CA 125.513 1.525 . . . . 0.67 107.612 -175.372 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 8.5 m -59.82 -31.32 69.62 Favored 'General case' 0 N--CA 1.455 -0.216 0 O-C-N 121.717 -0.614 . . . . 1.04 110.634 168.421 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -66.28 -19.05 65.71 Favored 'General case' 0 N--CA 1.463 0.183 0 N-CA-C 112.045 0.387 . . . . 1.31 112.045 174.735 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -83.04 -8.44 85.69 Favored Glycine 0 N--CA 1.439 -1.102 0 CA-C-O 118.579 -1.123 . . . . 0.43 110.546 175.792 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -110.77 -18.99 13.0 Favored 'General case' 0 C--O 1.232 0.166 0 CA-C-N 119.357 1.579 . . . . 2.71 112.527 -176.347 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 3.4 p -62.77 -163.57 0.01 OUTLIER 'General case' 0 CA--C 1.538 0.483 0 C-N-CA 124.177 0.991 . . . . 0.95 109.447 168.282 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 78.1 m-20 -53.29 148.33 8.84 Favored 'General case' 0 CA--C 1.53 0.175 0 O-C-N 120.449 -1.407 . . . . 2.78 110.445 -174.14 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 30.7 tt0 -59.77 -26.94 66.11 Favored 'General case' 0 CA--C 1.537 0.477 0 C-N-CA 123.226 0.61 . . . . 2.87 111.168 -176.07 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -62.38 -39.27 92.64 Favored 'General case' 0 N--CA 1.458 -0.063 0 O-C-N 121.367 -0.833 . . . . 0.59 112.509 171.63 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 13.9 mt-10 -69.2 -44.35 72.31 Favored 'General case' 0 CA--C 1.514 -0.439 0 O-C-N 121.041 -1.037 . . . . 2.21 110.435 177.45 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 66' ' ' PHE . . . . . 0.403 ' CD1' ' HA2' ' A' ' 52' ' ' GLY . 51.7 t80 -53.04 -46.03 68.3 Favored 'General case' 0 CA--C 1.534 0.328 0 C-N-CA 125.308 1.443 . . . . 0.34 111.296 173.485 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 62.3 t80 -64.01 -48.48 76.21 Favored 'General case' 0 CA--C 1.534 0.33 0 CA-C-O 122.217 1.008 . . . . 0.69 109.973 177.379 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -64.44 -41.96 96.26 Favored 'General case' 0 N--CA 1.446 -0.648 0 O-C-N 121.203 -0.936 . . . . 0.44 113.226 -174.564 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -68.67 -35.77 77.66 Favored 'General case' 0 C--N 1.332 -0.154 0 O-C-N 121.054 -1.029 . . . . 3.63 109.848 175.006 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -54.24 -41.27 68.56 Favored 'General case' 0 C--O 1.223 -0.315 0 CA-C-N 118.949 0.795 . . . . 0.38 110.327 171.101 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 19.7 t80 -58.48 -49.97 75.44 Favored 'General case' 0 N--CA 1.464 0.241 0 CA-C-N 120.027 1.285 . . . . 3.4 111.635 173.45 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -51.44 -54.38 27.46 Favored 'General case' 0 CA--C 1.531 0.239 0 O-C-N 121.709 -0.62 . . . . 4.12 110.506 179.035 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 73' ' ' LEU . . . . . 0.608 ' HB3' HG21 ' A' ' 85' ' ' VAL . 0.1 OUTLIER -66.65 -32.77 74.31 Favored 'General case' 0 C--N 1.324 -0.543 0 C-N-CA 124.377 1.071 . . . . 0.42 109.96 -174.468 . . . . . . . . 3 3 . 1 . 025 nuclear build core ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 1.8 tmt? -61.58 -39.32 90.75 Favored 'General case' 0 N--CA 1.447 -0.606 0 C-N-CA 123.676 0.79 . . . . 2.52 112.124 -177.774 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 13.0 p80 -94.59 -8.93 36.68 Favored 'General case' 0 C--O 1.232 0.133 0 CA-C-O 117.3 -1.333 . . . . 1.24 113.187 -179.655 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 9.7 m -40.03 127.37 2.16 Favored 'General case' 0 N--CA 1.45 -0.434 0 CA-C-O 123.24 1.495 . . . . 1.05 110.81 -168.459 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 1.4 p -52.63 -42.77 64.93 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 112.692 -2.049 . . . . 1.3 108.892 -178.315 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 78' ' ' ASP . . . . . 0.439 ' OD2' ' HB3' ' A' ' 80' ' ' ALA . 14.4 t0 -70.62 114.19 8.48 Favored 'General case' 0 N--CA 1.444 -0.739 0 CA-C-O 121.98 0.895 . . . . 1.92 108.916 169.548 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 52.5 m80 -57.72 -32.39 67.36 Favored 'General case' 0 N--CA 1.455 -0.194 0 O-C-N 121.639 -0.663 . . . . 5.33 110.615 174.597 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 80' ' ' ALA . . . . . 0.439 ' HB3' ' OD2' ' A' ' 78' ' ' ASP . . . -61.85 -50.83 70.68 Favored 'General case' 0 N--CA 1.451 -0.381 0 CA-C-O 118.401 -0.809 . . . . 0.85 110.313 179.722 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 4.2 mt-10 -43.17 -45.45 5.57 Favored 'General case' 0 C--N 1.339 0.138 0 C-N-CA 124.725 1.21 . . . . 2.78 110.204 176.648 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 1.9 mtp180 -63.91 -52.75 58.42 Favored 'General case' 0 N--CA 1.453 -0.32 0 CA-C-N 115.828 -0.623 . . . . 2.92 109.778 -178.497 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 1.3 mm? -63.67 -21.08 66.2 Favored 'General case' 0 N--CA 1.452 -0.33 0 CA-C-O 117.651 -1.166 . . . . 0.71 112.701 178.042 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 2.5 mptm? -64.12 -44.55 91.89 Favored 'General case' 0 C--O 1.225 -0.221 0 CA-C-N 121.324 1.875 . . . . 1.48 107.639 171.2 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 85' ' ' VAL . . . . . 0.608 HG21 ' HB3' ' A' ' 73' ' ' LEU . 84.4 t -62.11 -60.82 2.11 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.489 0 CA-C-O 118.144 -0.931 . . . . 0.4 110.368 175.324 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -51.13 -48.14 61.87 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 119.765 1.166 . . . . 2.09 111.197 -174.493 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 37.4 tttm -56.85 -48.54 77.84 Favored 'General case' 0 N--CA 1.449 -0.519 0 C-N-CA 123.769 0.828 . . . . 3.22 111.754 176.457 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 47.4 m-20 -79.29 -7.81 58.58 Favored 'General case' 0 CA--C 1.532 0.261 0 C-N-CA 123.231 0.612 . . . . 1.14 111.556 -177.244 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -165.8 73.19 1.3 Allowed Pre-proline 0 N--CA 1.448 -0.558 0 C-N-CA 125.488 1.515 . . . . 0.74 110.345 -167.72 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 74.4 Cg_endo -73.31 8.14 1.91 Allowed 'Trans proline' 0 N--CA 1.457 -0.62 0 C-N-CA 123.099 2.532 . . . . 1.95 112.875 -175.093 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -122.43 -47.93 2.09 Favored 'General case' 0 N--CA 1.45 -0.431 0 C-N-CA 125.221 1.408 . . . . 2.29 109.638 -177.625 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 2.7 m -53.92 -46.87 71.61 Favored 'General case' 0 C--N 1.334 -0.081 0 C-N-CA 123.706 0.803 . . . . 0.81 111.132 177.568 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 10.3 t80 -60.27 -47.45 85.94 Favored 'General case' 0 CA--C 1.508 -0.635 0 CA-C-O 121.355 0.598 . . . . 2.49 110.567 178.499 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 24.2 tt0 -56.58 -33.76 66.5 Favored 'General case' 0 N--CA 1.441 -0.912 0 CA-C-N 114.693 -1.139 . . . . 2.05 109.882 -179.914 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 3.2 t80 -63.33 -57.94 8.73 Favored 'General case' 0 N--CA 1.455 -0.221 0 C-N-CA 124.443 1.097 . . . . 1.16 109.633 -175.891 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 47.0 mm -51.9 -46.72 41.18 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.14 0 C-N-CA 123.345 0.658 . . . . 1.88 109.67 175.575 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 40.3 t30 -63.75 -32.99 74.67 Favored 'General case' 0 CA--C 1.53 0.205 0 N-CA-C 111.714 0.264 . . . . 2.03 111.714 -176.559 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 CA--C 1.523 -0.075 0 C-N-CA 124.304 1.042 . . . . 2.17 108.639 176.778 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 CA--C 1.522 -0.097 0 CA-C-O 121.161 0.505 . . . . 4.13 109.853 . . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER -62.36 -33.65 60.24 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.313 0 N-CA-C 112.617 0.599 . . . . 0.54 112.617 178.838 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 10.1 t60 -61.62 -52.33 64.8 Favored 'General case' 0 CA--C 1.531 0.213 0 N-CA-C 106.684 -1.599 . . . . 0.67 106.684 178.349 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 36.7 mt-10 -57.21 -36.84 71.37 Favored 'General case' 0 CA--C 1.53 0.207 0 O-C-N 121.473 -0.767 . . . . 2.63 111.337 176.946 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 1.1 t80 -56.9 -41.73 78.63 Favored 'General case' 0 C--N 1.33 -0.25 0 O-C-N 121.511 -0.743 . . . . 2.14 110.881 175.398 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -52.88 -45.11 61.59 Favored Glycine 0 CA--C 1.53 0.97 0 N-CA-C 111.249 -0.74 . . . . 0.73 111.249 172.631 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 71.6 m-70 -59.7 -49.02 79.35 Favored 'General case' 0 C--O 1.227 -0.105 0 CA-C-N 118.216 1.008 . . . . 3.62 111.279 175.403 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -58.69 -29.29 66.52 Favored 'General case' 0 CA--C 1.533 0.291 0 O-C-N 122.018 -0.426 . . . . 0.6 110.982 -179.185 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 49.3 t -66.57 -42.21 89.59 Favored 'Isoleucine or valine' 0 C--O 1.233 0.223 0 O-C-N 121.08 -1.012 . . . . 1.0 111.053 176.27 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 65.0 m-20 . . . . . 0 C--O 1.232 0.146 0 CA-C-N 117.904 0.32 . . . . 2.17 111.648 175.777 . . . . . . . . 0 0 . 1 . 026 nuclear build core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 1.6 t70 . . . . . 0 N--CA 1.468 0.432 0 N-CA-C 109.612 -0.514 . . . . 2.19 109.612 . . . . . . . . . 0 0 . 1 . 026 nuclear build core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 4.4 mm -50.3 -53.25 12.52 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.26 0 C-N-CA 123.988 0.915 . . . . 0.47 109.383 178.262 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 20.2 t80 -60.11 -32.22 70.78 Favored 'General case' 0 N--CA 1.452 -0.338 0 C-N-CA 123.504 0.722 . . . . 0.4 112.243 178.465 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 49' ' ' LYS . . . . . 0.501 ' HA ' ' HE2' ' A' ' 49' ' ' LYS . 0.6 OUTLIER -63.38 -51.14 67.09 Favored 'General case' 0 CA--C 1.519 -0.22 0 O-C-N 120.336 -1.478 . . . . 0.91 110.502 -179.331 . . . . . . . . 3 3 . 1 . 026 nuclear build core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 3.1 tp10 -79.44 -65.98 0.93 Allowed 'General case' 0 N--CA 1.452 -0.338 0 CA-C-O 122.27 1.033 . . . . 2.13 108.559 -175.368 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 3.8 mm-40 -72.14 -30.23 64.82 Favored 'General case' 0 N--CA 1.453 -0.316 0 C-N-CA 124.006 0.923 . . . . 2.3 109.956 -167.336 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 52' ' ' GLY . . . . . 0.413 ' HA2' ' CD1' ' A' ' 66' ' ' PHE . . . -68.99 41.68 0.34 Allowed Glycine 0 CA--C 1.527 0.815 0 C-N-CA 125.706 1.622 . . . . 0.33 113.838 169.036 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 65.3 p -145.77 22.42 1.44 Allowed 'General case' 0 N--CA 1.448 -0.55 0 O-C-N 120.871 -1.37 . . . . 1.98 111.49 159.681 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 47.9 t-20 -135.44 -44.32 0.69 Allowed 'General case' 0 C--O 1.226 -0.16 0 N-CA-C 111.906 0.336 . . . . 1.58 111.906 -165.529 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 28.7 mt -58.55 -38.55 78.07 Favored 'General case' 0 N--CA 1.462 0.163 0 CA-C-O 120.985 0.421 . . . . 0.4 111.142 -174.987 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER 178.16 172.03 0.68 Allowed 'General case' 0 CA--C 1.531 0.22 0 C-N-CA 125.468 1.507 . . . . 0.53 107.591 -178.244 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 14.4 m -56.89 -35.55 69.08 Favored 'General case' 0 N--CA 1.453 -0.283 0 O-C-N 121.572 -0.705 . . . . 1.0 110.319 166.7 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -64.67 -21.43 66.73 Favored 'General case' 0 CA--C 1.534 0.343 0 CA-C-O 121.085 0.469 . . . . 1.31 111.858 175.969 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -80.73 -12.49 82.76 Favored Glycine 0 N--CA 1.444 -0.791 0 N-CA-C 111.125 -0.79 . . . . 0.45 111.125 176.372 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 36.4 ttt-85 -110.98 -11.59 14.31 Favored 'General case' 0 CA--C 1.529 0.171 0 CA-C-N 118.758 1.279 . . . . 2.32 112.151 -179.15 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 2.2 p -63.9 -161.63 0.01 OUTLIER 'General case' 0 CA--C 1.54 0.568 0 C-N-CA 123.616 0.766 . . . . 0.99 109.9 167.059 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 16.3 t-20 -52.34 151.83 3.78 Favored 'General case' 0 CA--C 1.532 0.287 0 O-C-N 120.907 -1.121 . . . . 2.14 110.709 -177.574 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 35.7 tt0 -59.91 -36.37 76.85 Favored 'General case' 0 CA--C 1.53 0.182 0 CA-C-N 118.915 0.78 . . . . 2.47 110.349 -176.527 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -55.37 -30.14 59.78 Favored 'General case' 0 C--N 1.331 -0.198 0 O-C-N 121.522 -0.736 . . . . 0.42 112.813 176.924 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 1.6 mm-40 -82.16 -38.67 24.34 Favored 'General case' 0 N--CA 1.447 -0.589 0 CA-C-O 118.612 -0.709 . . . . 2.65 110.362 -179.177 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 66' ' ' PHE . . . . . 0.413 ' CD1' ' HA2' ' A' ' 52' ' ' GLY . 59.0 t80 -55.16 -47.29 75.36 Favored 'General case' 0 N--CA 1.452 -0.361 0 C-N-CA 124.267 1.027 . . . . 0.36 111.43 170.73 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 56.9 t80 -65.03 -48.11 75.02 Favored 'General case' 0 CA--C 1.538 0.501 0 O-C-N 121.061 -1.024 . . . . 0.49 109.819 176.141 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -58.82 -55.69 31.92 Favored 'General case' 0 CA--C 1.536 0.44 0 N-CA-C 113.252 0.834 . . . . 0.27 113.252 -174.7 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -55.4 -39.56 70.34 Favored 'General case' 0 C--N 1.331 -0.218 0 O-C-N 121.027 -1.045 . . . . 3.87 111.355 171.264 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -60.17 -32.95 71.54 Favored 'General case' 0 CA--C 1.533 0.311 0 CA-C-N 119.737 1.153 . . . . 0.42 110.872 175.516 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -59.17 -49.71 76.83 Favored 'General case' 0 N--CA 1.464 0.229 0 CA-C-N 119.127 0.876 . . . . 3.37 111.901 168.681 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 72' ' ' ARG . . . . . 0.494 ' HE ' ' CD2' ' A' ' 73' ' ' LEU . 10.7 ttp180 -51.92 -61.61 2.15 Favored 'General case' 0 CA--C 1.534 0.352 0 O-C-N 121.392 -0.818 . . . . 2.09 110.82 174.905 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 73' ' ' LEU . . . . . 0.494 ' CD2' ' HE ' ' A' ' 72' ' ' ARG . 0.1 OUTLIER -62.25 -45.89 91.3 Favored 'General case' 0 C--O 1.221 -0.436 0 C-N-CA 125.56 1.544 . . . . 0.49 110.649 -170.94 . . . . . . . . 3 3 . 1 . 026 nuclear build core ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -63.61 -25.96 68.46 Favored 'General case' 0 C--N 1.331 -0.216 0 O-C-N 120.276 -1.515 . . . . 4.57 111.808 -179.867 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -91.96 -12.11 34.28 Favored 'General case' 0 C--O 1.232 0.169 0 CA-C-O 117.063 -1.446 . . . . 1.03 112.327 175.214 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 80.3 p -48.9 122.66 5.99 Favored 'General case' 0 N--CA 1.446 -0.642 0 CA-C-N 119.8 1.182 . . . . 2.25 108.31 -167.436 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 2.2 p -51.21 -39.36 56.36 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 114.646 -1.161 . . . . 1.11 109.641 177.102 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 13.5 t0 -63.98 104.35 0.7 Allowed 'General case' 0 N--CA 1.448 -0.528 0 CA-C-O 121.641 0.734 . . . . 2.06 109.846 166.685 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 39.3 p-80 -50.17 -35.23 25.28 Favored 'General case' 0 C--N 1.332 -0.171 0 C-N-CA 122.991 0.517 . . . . 4.54 111.994 174.268 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -61.12 -51.24 69.93 Favored 'General case' 0 N--CA 1.449 -0.512 0 CA-C-O 118.516 -0.754 . . . . 0.63 110.736 -178.072 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 1.2 mt-10 -50.42 -39.52 47.53 Favored 'General case' 0 C--O 1.233 0.198 0 CA-C-N 119.132 0.878 . . . . 3.25 110.478 177.759 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -62.97 -52.96 60.98 Favored 'General case' 0 N--CA 1.453 -0.312 0 C-N-CA 119.218 -0.993 . . . . 3.03 108.891 -178.588 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 1.2 mm? -65.64 -18.1 65.08 Favored 'General case' 0 N--CA 1.451 -0.423 0 CA-C-O 117.866 -1.064 . . . . 0.55 112.114 178.851 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 6.0 mttt -65.83 -44.65 84.91 Favored 'General case' 0 CA--C 1.516 -0.335 0 CA-C-N 120.824 1.647 . . . . 1.23 108.299 169.371 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 95.8 t -58.2 -60.28 2.44 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.497 0 CA-C-N 118.757 0.708 . . . . 0.5 110.051 171.254 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -57.37 -45.54 84.34 Favored 'General case' 0 CA--C 1.53 0.202 0 CA-C-N 119.512 1.051 . . . . 2.35 111.812 -169.721 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 56.6 tttt -58.09 -53.44 58.25 Favored 'General case' 0 N--CA 1.451 -0.404 0 C-N-CA 123.723 0.809 . . . . 2.16 109.712 177.03 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 4.3 m-20 -77.23 -6.5 53.27 Favored 'General case' 0 N--CA 1.453 -0.283 0 CA-C-O 118.825 -0.607 . . . . 0.92 111.229 -173.927 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -164.46 72.9 1.61 Allowed Pre-proline 0 N--CA 1.447 -0.609 0 C-N-CA 124.952 1.301 . . . . 0.39 110.587 -171.75 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 72.9 Cg_endo -74.27 16.89 0.55 Allowed 'Trans proline' 0 CA--C 1.536 0.584 0 C-N-CA 123.461 2.774 . . . . 1.47 113.283 -173.861 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -133.75 -41.82 0.84 Allowed 'General case' 0 N--CA 1.454 -0.252 0 C-N-CA 125.385 1.474 . . . . 2.69 109.29 -177.635 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 5.7 m -54.55 -48.1 72.4 Favored 'General case' 0 CA--C 1.521 -0.154 0 O-C-N 121.159 -0.963 . . . . 0.38 110.615 171.517 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 2.7 t80 -59.12 -46.67 87.72 Favored 'General case' 0 CA--C 1.506 -0.733 0 C-N-CA 119.849 -0.741 . . . . 2.45 110.492 179.342 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 50.2 tt0 -54.09 -37.13 63.93 Favored 'General case' 0 N--CA 1.442 -0.85 0 O-C-N 123.964 0.79 . . . . 2.41 110.319 177.708 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 4.4 t80 -60.66 -57.63 11.9 Favored 'General case' 0 N--CA 1.457 -0.078 0 CA-C-N 118.549 0.613 . . . . 0.94 109.568 -174.557 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 3.2 mp -60.9 -39.01 80.58 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.284 0 N-CA-C 109.588 -0.523 . . . . 0.75 109.588 177.598 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 9.3 t-20 -62.0 -35.41 78.43 Favored 'General case' 0 N--CA 1.455 -0.198 0 O-C-N 121.597 -0.689 . . . . 2.45 111.443 -174.789 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 C--O 1.231 0.11 0 C-N-CA 125.679 1.592 . . . . 2.1 108.303 174.904 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 34.0 t80 . . . . . 0 C--O 1.227 -0.117 0 CA-C-O 122.173 0.987 . . . . 3.39 109.344 . . . . . . . . . 0 0 . 1 . 027 nuclear build core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 0.7 OUTLIER -63.1 -33.97 63.94 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.469 0 O-C-N 121.625 -0.672 . . . . 0.5 111.956 179.694 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 2.2 t-160 -60.29 -53.69 54.63 Favored 'General case' 0 CA--C 1.533 0.32 0 N-CA-C 106.7 -1.592 . . . . 0.57 106.7 176.554 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 86.4 mt-10 -51.54 -44.7 62.75 Favored 'General case' 0 C--O 1.223 -0.32 0 C-N-CA 124.455 1.102 . . . . 2.47 110.05 177.669 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -53.37 -56.98 12.3 Favored 'General case' 0 CA--C 1.519 -0.25 0 C-N-CA 124.476 1.11 . . . . 2.41 110.892 177.987 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -48.03 -46.66 26.6 Favored Glycine 0 CA--C 1.523 0.537 0 N-CA-C 110.466 -1.054 . . . . 0.5 110.466 175.652 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 20' ' ' HIS . . . . . 0.64 ' CE1' ' HB1' ' A' ' 64' ' ' ALA . 2.6 t-160 -60.68 -46.35 90.67 Favored 'General case' 0 N--CA 1.45 -0.428 0 O-C-N 122.052 -0.675 . . . . 1.79 112.028 -179.525 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -60.38 -31.46 70.37 Favored 'General case' 0 N--CA 1.447 -0.575 0 N-CA-C 109.428 -0.582 . . . . 0.67 109.428 -179.214 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 26.3 t -66.47 -41.54 88.77 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.182 0 C-N-CA 118.567 -1.253 . . . . 0.86 111.682 175.44 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 33.3 t0 . . . . . 0 N--CA 1.464 0.243 0 CA-C-O 122.098 0.952 . . . . 2.06 111.114 174.925 . . . . . . . . 0 0 . 1 . 027 nuclear build core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 42.2 t0 . . . . . 0 N--CA 1.467 0.41 0 CA-C-O 121.185 0.517 . . . . 2.28 110.335 . . . . . . . . . 0 0 . 1 . 027 nuclear build core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 5.4 mm -51.94 -54.74 12.18 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.397 0 C-N-CA 124.74 1.216 . . . . 0.53 109.523 172.673 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 48' ' ' PHE . . . . . 0.474 ' CD2' ' HE3' ' A' ' 49' ' ' LYS . 22.1 t80 -57.77 -28.62 64.14 Favored 'General case' 0 N--CA 1.452 -0.325 0 O-C-N 120.414 -1.429 . . . . 0.47 112.148 176.538 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 49' ' ' LYS . . . . . 0.474 ' HE3' ' CD2' ' A' ' 48' ' ' PHE . 0.2 OUTLIER -69.17 -46.21 68.08 Favored 'General case' 0 N--CA 1.45 -0.431 0 O-C-N 120.353 -1.467 . . . . 1.11 111.251 -178.317 . . . . . . . . 3 3 . 1 . 027 nuclear build core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 52.3 tp10 -83.68 -66.01 0.94 Allowed 'General case' 0 C--N 1.33 -0.264 0 N-CA-C 109.009 -0.738 . . . . 2.82 109.009 -179.688 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 29.9 mp0 -69.19 -32.6 72.0 Favored 'General case' 0 C--O 1.236 0.384 0 O-C-N 121.384 -0.823 . . . . 2.69 111.35 -172.082 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -72.14 42.27 0.78 Allowed Glycine 0 CA--C 1.529 0.913 0 C-N-CA 124.652 1.12 . . . . 0.39 113.949 172.5 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 22.9 t -146.38 24.43 1.26 Allowed 'General case' 0 N--CA 1.447 -0.584 0 O-C-N 121.246 -1.149 . . . . 1.58 109.511 159.257 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -138.06 -27.99 0.88 Allowed 'General case' 0 C--N 1.342 0.273 0 N-CA-C 113.778 1.029 . . . . 2.28 113.778 -169.979 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 55' ' ' LEU . . . . . 0.624 HD22 HG22 ' A' ' 85' ' ' VAL . 32.0 mt -68.28 -40.02 81.96 Favored 'General case' 0 C--N 1.333 -0.151 0 CA-C-N 119.06 0.845 . . . . 0.45 110.793 -179.441 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER 177.71 165.42 0.65 Allowed 'General case' 0 C--N 1.33 -0.253 0 C-N-CA 125.511 1.524 . . . . 0.44 106.961 -173.477 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 7.2 m -59.8 -35.18 74.14 Favored 'General case' 0 N--CA 1.453 -0.278 0 C-N-CA 123.027 0.531 . . . . 1.05 110.637 170.262 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -71.18 -6.09 36.84 Favored 'General case' 0 CA--C 1.533 0.306 0 C-N-CA 122.88 0.472 . . . . 1.01 112.032 176.127 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -101.85 4.23 52.97 Favored Glycine 0 CA--C 1.524 0.606 0 C-N-CA 124.524 1.059 . . . . 0.54 111.196 172.853 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -114.1 -17.89 11.81 Favored 'General case' 0 CA--C 1.527 0.064 0 C-N-CA 124.356 1.062 . . . . 3.59 111.514 177.274 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 13.9 p -61.74 -160.13 0.01 OUTLIER 'General case' 0 CA--C 1.541 0.607 0 C-N-CA 125.443 1.497 . . . . 0.85 109.691 168.069 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 3.7 m120 -50.49 146.62 5.26 Favored 'General case' 0 CA--C 1.535 0.373 0 O-C-N 119.983 -1.698 . . . . 2.16 111.469 -177.081 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 38.8 tt0 -56.52 -30.62 63.24 Favored 'General case' 0 N--CA 1.467 0.398 0 CA-C-O 121.443 0.64 . . . . 2.65 110.493 179.095 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 64' ' ' ALA . . . . . 0.64 ' HB1' ' CE1' ' A' ' 20' ' ' HIS . . . -53.69 -45.05 70.24 Favored 'General case' 0 N--CA 1.452 -0.367 0 C-N-CA 123.841 0.857 . . . . 0.58 112.183 172.643 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 8.7 mt-10 -72.75 -39.26 66.99 Favored 'General case' 0 C--O 1.221 -0.397 0 O-C-N 121.562 -0.712 . . . . 2.29 110.756 178.484 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 55.4 t80 -51.45 -52.93 42.2 Favored 'General case' 0 C--N 1.332 -0.159 0 C-N-CA 123.337 0.655 . . . . 0.31 111.18 173.99 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 73.4 t80 -66.61 -45.54 78.83 Favored 'General case' 0 N--CA 1.449 -0.492 0 C-N-CA 123.711 0.804 . . . . 0.41 110.579 -178.567 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -60.12 -47.6 85.22 Favored 'General case' 0 CA--C 1.539 0.537 0 O-C-N 121.198 -0.939 . . . . 0.25 111.963 -178.666 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 48.1 mm-40 -55.41 -44.79 76.55 Favored 'General case' 0 CA--C 1.517 -0.292 0 C-N-CA 125.011 1.324 . . . . 4.23 109.975 169.36 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -55.7 -45.94 77.77 Favored 'General case' 0 N--CA 1.446 -0.632 0 CA-C-O 118.06 -0.971 . . . . 0.39 109.508 -175.869 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 73.9 t80 -56.82 -50.8 71.3 Favored 'General case' 0 N--CA 1.464 0.271 0 CA-C-N 119.343 0.974 . . . . 2.66 111.913 172.799 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 18.3 ttp180 -46.15 -58.02 4.0 Favored 'General case' 0 CA--C 1.531 0.25 0 CA-C-N 118.283 0.492 . . . . 2.61 110.826 178.103 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 73' ' ' LEU . . . . . 0.611 HD12 HG23 ' A' ' 85' ' ' VAL . 0.1 OUTLIER -65.14 -32.51 74.23 Favored 'General case' 0 C--N 1.324 -0.528 0 C-N-CA 125.332 1.453 . . . . 0.41 110.92 -178.428 . . . . . . . . 3 3 . 1 . 027 nuclear build core ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -59.48 -39.57 84.14 Favored 'General case' 0 CA--C 1.517 -0.315 0 C-N-CA 123.701 0.8 . . . . 2.52 110.012 -178.047 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 22.9 p80 -90.52 -36.45 14.48 Favored 'General case' 0 N--CA 1.45 -0.443 0 CA-C-O 115.723 -2.084 . . . . 0.96 110.867 -176.948 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 15.9 m -8.14 111.32 0.01 OUTLIER 'General case' 0 C--N 1.348 0.53 0 C-N-CA 127.883 2.473 . . . . 1.03 113.342 -171.765 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 4.1 p -46.56 -42.62 16.19 Favored 'General case' 0 N--CA 1.45 -0.465 0 C-N-CA 125.186 1.394 . . . . 0.98 110.567 -177.013 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 78' ' ' ASP . . . . . 0.419 ' OD2' ' HB3' ' A' ' 80' ' ' ALA . 14.6 t0 -70.13 105.63 2.99 Favored 'General case' 0 N--CA 1.447 -0.586 0 C-N-CA 118.073 -1.451 . . . . 2.26 110.162 164.333 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 5.9 p-80 -39.38 -43.36 1.19 Allowed 'General case' 0 N--CA 1.45 -0.464 0 CA-C-N 114.457 -1.247 . . . . 4.34 113.039 169.657 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 80' ' ' ALA . . . . . 0.419 ' HB3' ' OD2' ' A' ' 78' ' ' ASP . . . -66.98 -40.1 87.35 Favored 'General case' 0 N--CA 1.453 -0.291 0 O-C-N 121.872 -0.517 . . . . 0.91 110.195 -172.549 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 81' ' ' GLU . . . . . 0.472 ' OE1' HD13 ' A' ' 73' ' ' LEU . 1.1 tm-20 -50.94 -41.79 59.24 Favored 'General case' 0 C--N 1.328 -0.327 0 C-N-CA 124.604 1.161 . . . . 3.33 110.097 172.625 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -63.53 -47.18 82.68 Favored 'General case' 0 CA--C 1.519 -0.234 0 C-N-CA 119.327 -0.949 . . . . 3.26 108.795 176.926 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 83' ' ' LEU . . . . . 0.403 HD13 ' HA ' ' A' ' 83' ' ' LEU . 2.1 mm? -56.57 -25.11 51.52 Favored 'General case' 0 N--CA 1.456 -0.129 0 CA-C-O 118.042 -0.98 . . . . 0.62 113.308 174.061 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 14.9 mptt -64.64 -48.33 75.23 Favored 'General case' 0 CA--C 1.52 -0.21 0 CA-C-N 121.082 1.764 . . . . 3.04 108.956 172.337 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 85' ' ' VAL . . . . . 0.624 HG22 HD22 ' A' ' 55' ' ' LEU . 2.4 t -57.87 -60.51 2.1 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.5 0 CA-C-N 118.608 0.64 . . . . 0.69 109.921 173.488 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 86' ' ' GLN . . . . . 0.436 ' HG2' ' CG ' ' A' ' 93' ' ' PHE . 36.0 mt-30 -52.48 -50.44 62.73 Favored 'General case' 0 N--CA 1.453 -0.32 0 CA-C-N 118.909 0.777 . . . . 4.59 111.091 -171.064 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 8.5 pttp -65.02 -41.09 95.61 Favored 'General case' 0 N--CA 1.455 -0.214 0 O-C-N 121.623 -0.673 . . . . 3.4 110.842 -179.249 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 89.9 m-20 -79.75 -8.5 59.29 Favored 'General case' 0 CA--C 1.529 0.16 0 O-C-N 122.077 -0.389 . . . . 1.07 110.891 -177.27 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 89' ' ' ALA . . . . . 0.542 ' HB2' HD21 ' A' ' 55' ' ' LEU . . . -160.9 62.52 1.63 Allowed Pre-proline 0 N--CA 1.446 -0.648 0 C-N-CA 123.606 0.763 . . . . 0.51 110.769 -169.416 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 28.5 Cg_endo -59.99 -35.9 91.61 Favored 'Trans proline' 0 N--CA 1.452 -0.929 0 C-N-CA 122.018 1.812 . . . . 2.16 110.56 -174.153 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 3.4 tttt -77.56 -44.23 29.23 Favored 'General case' 0 N--CA 1.453 -0.285 0 C-N-CA 123.496 0.718 . . . . 4.66 111.219 -177.038 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 12.0 m -58.21 -42.47 86.26 Favored 'General case' 0 CA--C 1.518 -0.288 0 O-C-N 121.22 -0.925 . . . . 0.53 110.394 177.734 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 93' ' ' PHE . . . . . 0.436 ' CG ' ' HG2' ' A' ' 86' ' ' GLN . 56.3 t80 -54.9 -51.38 66.2 Favored 'General case' 0 CA--C 1.502 -0.893 0 C-N-CA 120.07 -0.652 . . . . 2.74 111.161 178.144 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 36.6 tt0 -50.94 -35.61 34.24 Favored 'General case' 0 N--CA 1.445 -0.701 0 O-C-N 124.374 1.046 . . . . 2.03 111.016 178.74 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 4.1 t80 -58.75 -58.95 6.32 Favored 'General case' 0 CA--C 1.532 0.288 0 C-N-CA 123.268 0.627 . . . . 0.98 110.102 -177.55 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 3.9 mp -62.89 -35.29 70.55 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.128 0 O-C-N 121.419 -0.801 . . . . 0.88 109.59 178.781 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 7.5 t-20 -63.23 -29.81 71.08 Favored 'General case' 0 N--CA 1.452 -0.328 0 C-N-CA 122.693 0.397 . . . . 2.0 110.206 -179.012 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 10.7 t70 . . . . . 0 C--N 1.333 -0.116 0 CA-C-O 121.546 0.689 . . . . 2.56 109.734 174.57 . . . . . . . . 0 0 . 1 . 028 nuclear build core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 79.4 t80 . . . . . 0 C--O 1.224 -0.256 0 CA-C-O 120.58 0.228 . . . . 3.12 111.28 . . . . . . . . . 0 0 . 1 . 028 nuclear build core ' A' A ' 15' ' ' ILE . . . . . 0.425 HD12 ' CE1' ' A' ' 75' ' ' HIS . 0.9 OUTLIER -66.69 -31.0 51.54 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.192 0 O-C-N 121.457 -0.777 . . . . 0.5 112.632 -179.199 . . . . . . . . 3 3 . 1 . 028 nuclear build core ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 5.7 t60 -59.65 -57.2 13.97 Favored 'General case' 0 C--N 1.341 0.228 0 N-CA-C 106.406 -1.702 . . . . 0.62 106.406 176.359 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 44.0 mt-10 -54.11 -39.51 66.47 Favored 'General case' 0 N--CA 1.452 -0.343 0 C-N-CA 124.607 1.163 . . . . 2.1 110.713 178.384 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 4.0 t80 -58.78 -48.08 82.5 Favored 'General case' 0 CA--C 1.521 -0.16 0 C-N-CA 124.054 0.942 . . . . 2.02 110.488 178.625 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -51.15 -45.44 51.74 Favored Glycine 0 CA--C 1.525 0.67 0 N-CA-C 110.322 -1.111 . . . . 0.42 110.322 172.983 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 20' ' ' HIS . . . . . 0.544 ' CE1' ' HB1' ' A' ' 64' ' ' ALA . 2.3 t-160 -60.81 -48.68 80.72 Favored 'General case' 0 N--CA 1.45 -0.426 0 O-C-N 122.109 -0.642 . . . . 1.88 111.32 179.434 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -60.3 -30.89 69.77 Favored 'General case' 0 N--CA 1.453 -0.319 0 O-C-N 121.696 -0.628 . . . . 0.67 110.169 179.846 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 74.2 t -69.95 -39.47 77.52 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.163 0 O-C-N 121.338 -0.851 . . . . 0.84 110.633 176.8 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 9.5 t0 . . . . . 0 C--N 1.331 -0.204 0 CA-C-O 121.364 0.602 . . . . 2.14 110.698 172.242 . . . . . . . . 0 0 . 1 . 028 nuclear build core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 14.8 t70 . . . . . 0 N--CA 1.465 0.31 0 CA-C-O 121.033 0.444 . . . . 2.12 110.396 . . . . . . . . . 0 0 . 1 . 028 nuclear build core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 5.7 mm -53.31 -50.08 49.38 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.19 0 N-CA-C 108.339 -0.986 . . . . 0.46 108.339 172.052 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 19.6 t80 -63.61 -25.76 68.38 Favored 'General case' 0 N--CA 1.454 -0.225 0 O-C-N 121.906 -0.496 . . . . 0.42 112.008 177.667 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 49' ' ' LYS . . . . . 0.545 ' HA ' ' CE ' ' A' ' 49' ' ' LYS . 0.6 OUTLIER -71.22 -48.37 51.75 Favored 'General case' 0 N--CA 1.45 -0.43 0 O-C-N 119.774 -1.829 . . . . 1.49 110.888 -178.192 . . . . . . . . 3 3 . 1 . 028 nuclear build core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 22.8 tp10 -85.63 -63.53 1.31 Allowed 'General case' 0 C--N 1.328 -0.331 0 N-CA-C 108.582 -0.896 . . . . 2.6 108.582 -176.927 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 3.4 mm-40 -67.22 -32.86 74.2 Favored 'General case' 0 CA--C 1.536 0.407 0 C-N-CA 123.833 0.853 . . . . 2.73 109.789 -170.175 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 52' ' ' GLY . . . . . 0.446 ' HA2' ' CD1' ' A' ' 66' ' ' PHE . . . -68.05 43.9 0.3 Allowed Glycine 0 CA--C 1.53 1.028 0 C-N-CA 126.917 2.199 . . . . 0.34 114.587 171.132 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 33.1 p -154.2 32.25 0.43 Allowed 'General case' 0 N--CA 1.448 -0.536 0 O-C-N 121.104 -1.233 . . . . 1.96 109.869 160.274 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -137.35 -43.94 0.55 Allowed 'General case' 0 CA--C 1.517 -0.296 0 N-CA-C 112.908 0.707 . . . . 1.81 112.908 -168.719 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 55' ' ' LEU . . . . . 0.5 HD22 HG22 ' A' ' 85' ' ' VAL . 15.3 mt -63.11 -36.48 83.74 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 120.872 0.367 . . . . 0.38 110.749 -175.926 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 1.1 t 176.53 171.01 0.45 Allowed 'General case' 0 CA--C 1.531 0.234 0 C-N-CA 125.835 1.654 . . . . 0.45 107.501 -177.919 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 20.8 m -57.38 -33.71 68.1 Favored 'General case' 0 N--CA 1.453 -0.306 0 O-C-N 121.713 -0.617 . . . . 0.91 110.555 168.016 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -61.15 -30.89 70.66 Favored 'General case' 0 CA--C 1.53 0.199 0 CA-C-N 118.475 0.58 . . . . 1.08 110.894 174.207 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -71.8 -11.56 73.69 Favored Glycine 0 C--O 1.221 -0.663 0 O-C-N 121.354 -0.841 . . . . 0.37 111.729 176.524 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 32.1 ttt180 -105.14 -12.54 16.07 Favored 'General case' 0 CA--C 1.533 0.294 0 CA-C-N 118.817 1.308 . . . . 2.78 112.473 177.224 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 41.4 p -66.39 -134.9 0.0 OUTLIER 'General case' 0 N--CA 1.47 0.573 0 CA-C-N 118.833 0.742 . . . . 0.77 111.211 178.204 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 6.7 t-20 -69.07 152.91 44.62 Favored 'General case' 0 N--CA 1.453 -0.307 0 O-C-N 119.465 -2.022 . . . . 2.9 107.943 179.871 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 5.3 tm-20 -60.7 -33.1 72.36 Favored 'General case' 0 CA--C 1.531 0.246 0 CA-C-N 118.72 0.691 . . . . 3.4 109.625 177.487 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 64' ' ' ALA . . . . . 0.544 ' HB1' ' CE1' ' A' ' 20' ' ' HIS . . . -61.0 -30.73 70.46 Favored 'General case' 0 N--CA 1.45 -0.435 0 N-CA-C 113.246 0.832 . . . . 0.52 113.246 174.848 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 2.4 mt-10 -80.13 -42.31 23.76 Favored 'General case' 0 CA--C 1.51 -0.567 0 CA-C-O 118.392 -0.813 . . . . 2.36 110.592 176.5 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 66' ' ' PHE . . . . . 0.446 ' CD1' ' HA2' ' A' ' 52' ' ' GLY . 54.7 t80 -48.99 -49.0 42.92 Favored 'General case' 0 N--CA 1.453 -0.309 0 C-N-CA 123.596 0.758 . . . . 0.33 111.164 172.816 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 82.7 t80 -63.29 -44.42 95.11 Favored 'General case' 0 CA--C 1.539 0.53 0 O-C-N 121.319 -0.863 . . . . 0.38 110.772 177.074 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -62.21 -56.44 18.66 Favored 'General case' 0 CA--C 1.54 0.586 0 O-C-N 121.296 -0.878 . . . . 0.31 113.021 -175.594 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 1.1 pp20? -56.19 -38.45 70.98 Favored 'General case' 0 C--N 1.333 -0.123 0 O-C-N 120.962 -1.086 . . . . 3.73 111.204 171.376 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -57.91 -42.55 84.99 Favored 'General case' 0 N--CA 1.45 -0.438 0 CA-C-O 118.493 -0.765 . . . . 0.37 110.562 175.347 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 55.7 t80 -59.98 -50.08 75.16 Favored 'General case' 0 N--CA 1.464 0.268 0 CA-C-N 120.37 1.441 . . . . 2.8 111.544 174.453 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 6.9 ttt180 -44.71 -62.22 1.29 Allowed 'General case' 0 N--CA 1.465 0.294 0 N-CA-C 109.097 -0.705 . . . . 2.28 109.097 178.08 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 73' ' ' LEU . . . . . 0.528 HD12 HG23 ' A' ' 85' ' ' VAL . 0.1 OUTLIER -60.43 -37.93 82.47 Favored 'General case' 0 CA--C 1.515 -0.372 0 C-N-CA 125.651 1.58 . . . . 0.42 111.107 -177.253 . . . . . . . . 3 3 . 1 . 028 nuclear build core ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 1.6 tmt? -65.81 -33.01 74.86 Favored 'General case' 0 N--CA 1.451 -0.393 0 O-C-N 122.189 -0.319 . . . . 2.81 111.263 -174.593 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 75' ' ' HIS . . . . . 0.425 ' CE1' HD12 ' A' ' 15' ' ' ILE . 5.2 p80 -92.8 -20.43 20.74 Favored 'General case' 0 CA--C 1.527 0.096 0 CA-C-O 117.159 -1.4 . . . . 0.87 112.708 177.35 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 76' ' ' SER . . . . . 0.425 ' O ' ' HD2' ' A' ' 82' ' ' ARG . 32.0 m -33.77 114.43 0.19 Allowed 'General case' 0 C--O 1.22 -0.491 0 C-N-CA 125.981 1.712 . . . . 1.19 112.446 -169.547 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 1.4 p -46.11 -39.96 10.24 Favored 'General case' 0 C--N 1.326 -0.441 0 C-N-CA 124.863 1.265 . . . . 1.43 110.832 -178.968 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 11.5 t0 -65.03 103.42 0.74 Allowed 'General case' 0 N--CA 1.451 -0.407 0 CA-C-O 121.823 0.821 . . . . 1.87 110.238 165.486 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 11.7 p80 -46.15 -37.7 7.32 Favored 'General case' 0 N--CA 1.455 -0.212 0 C-N-CA 123.574 0.75 . . . . 4.47 112.13 173.316 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -61.1 -47.05 88.09 Favored 'General case' 0 N--CA 1.451 -0.394 0 CA-C-N 118.378 0.535 . . . . 0.75 110.292 -178.555 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 2.9 mt-10 -52.8 -40.22 63.04 Favored 'General case' 0 CA--C 1.512 -0.484 0 CA-C-O 121.116 0.484 . . . . 3.13 111.365 177.348 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 82' ' ' ARG . . . . . 0.425 ' HD2' ' O ' ' A' ' 76' ' ' SER . 15.3 mtp180 -64.77 -56.49 13.25 Favored 'General case' 0 N--CA 1.45 -0.468 0 C-N-CA 119.173 -1.011 . . . . 2.46 108.343 178.762 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 83' ' ' LEU . . . . . 0.418 HD13 ' HA ' ' A' ' 83' ' ' LEU . 0.9 OUTLIER -56.34 -23.77 39.48 Favored 'General case' 0 C--O 1.223 -0.291 0 N-CA-C 113.28 0.844 . . . . 0.57 113.28 178.883 . . . . . . . . 3 3 . 1 . 028 nuclear build core ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 32.1 mttt -67.66 -45.3 75.68 Favored 'General case' 0 CA--C 1.517 -0.31 0 CA-C-N 120.242 1.383 . . . . 1.65 108.777 173.64 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 85' ' ' VAL . . . . . 0.528 HG23 HD12 ' A' ' 73' ' ' LEU . 39.8 t -60.11 -53.48 48.0 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.614 0 CA-C-O 118.661 -0.685 . . . . 0.42 110.671 170.95 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 60.1 mt-30 -60.6 -44.59 96.11 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 120.394 1.452 . . . . 4.31 110.965 -171.125 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 22.4 tttt -59.87 -51.32 70.24 Favored 'General case' 0 N--CA 1.452 -0.362 0 C-N-CA 123.948 0.899 . . . . 2.22 110.6 175.751 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 38.9 m-20 -78.41 -8.24 58.26 Favored 'General case' 0 C--N 1.331 -0.212 0 C-N-CA 122.944 0.498 . . . . 1.15 111.474 -174.144 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 89' ' ' ALA . . . . . 0.462 ' HB2' HD21 ' A' ' 55' ' ' LEU . . . -159.37 69.61 3.29 Favored Pre-proline 0 N--CA 1.447 -0.598 0 C-N-CA 125.013 1.325 . . . . 0.43 109.305 -173.144 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 36.2 Cg_endo -61.36 -25.76 80.61 Favored 'Trans proline' 0 N--CA 1.453 -0.907 0 C-N-CA 122.454 2.103 . . . . 1.74 110.759 -176.462 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 7.1 mttp -81.62 -52.96 6.64 Favored 'General case' 0 N--CA 1.449 -0.493 0 C-N-CA 123.211 0.604 . . . . 4.79 110.557 177.902 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 2.3 m -55.51 -39.9 71.1 Favored 'General case' 0 N--CA 1.467 0.385 0 CA-C-N 119.28 0.946 . . . . 0.6 111.296 -175.67 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 3.2 t80 -48.96 -65.67 0.53 Allowed 'General case' 0 CA--C 1.503 -0.836 0 CA-C-O 121.423 0.63 . . . . 4.64 112.562 175.261 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 44.7 tt0 -54.2 -31.98 54.44 Favored 'General case' 0 N--CA 1.44 -0.965 0 CA-C-N 113.926 -1.488 . . . . 1.51 109.727 -178.162 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 4.7 t80 -68.9 -58.53 4.01 Favored 'General case' 0 N--CA 1.451 -0.398 0 C-N-CA 122.87 0.468 . . . . 2.03 110.442 -173.102 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 35.5 mm -48.27 -46.41 13.75 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.139 0 C-N-CA 123.9 0.88 . . . . 1.55 109.961 172.279 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 12.4 t-20 -64.82 -32.7 74.52 Favored 'General case' 0 CA--C 1.535 0.373 0 CA-C-N 117.853 0.297 . . . . 1.73 111.631 -176.153 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 12.5 t70 . . . . . 0 N--CA 1.464 0.236 0 CA-C-O 121.61 0.719 . . . . 2.06 109.404 174.723 . . . . . . . . 0 0 . 1 . 029 nuclear build core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 15.3 t80 . . . . . 0 CA--C 1.517 -0.29 0 N-CA-C 108.481 -0.933 . . . . 2.51 108.481 . . . . . . . . . 0 0 . 1 . 029 nuclear build core ' A' A ' 15' ' ' ILE . . . . . 0.432 HD12 ' CE1' ' A' ' 75' ' ' HIS . 0.6 OUTLIER -61.43 -34.5 61.57 Favored 'Isoleucine or valine' 0 CA--C 1.528 0.113 0 CA-C-O 118.864 -0.589 . . . . 0.52 112.579 175.547 . . . . . . . . 3 3 . 1 . 029 nuclear build core ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 4.6 t60 -56.44 -55.09 37.92 Favored 'General case' 0 C--N 1.341 0.211 0 N-CA-C 106.916 -1.513 . . . . 0.52 106.916 177.309 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 48.3 mt-10 -62.41 -32.11 72.9 Favored 'General case' 0 N--CA 1.452 -0.367 0 CA-C-O 118.709 -0.662 . . . . 2.63 111.802 179.608 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 17.7 t80 -59.19 -50.21 74.9 Favored 'General case' 0 N--CA 1.452 -0.326 0 CA-C-N 118.999 0.818 . . . . 2.17 109.618 177.34 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -51.87 -43.08 54.49 Favored Glycine 0 CA--C 1.529 0.909 0 N-CA-C 111.011 -0.836 . . . . 0.55 111.011 173.889 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 26.1 t-80 -63.28 -53.04 59.04 Favored 'General case' 0 N--CA 1.453 -0.307 0 O-C-N 121.82 -0.812 . . . . 1.7 111.593 -177.738 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -63.65 -27.56 69.31 Favored 'General case' 0 N--CA 1.451 -0.388 0 C-N-CA 123.094 0.558 . . . . 1.02 110.172 -179.352 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 25.1 t -68.28 -42.39 84.44 Favored 'Isoleucine or valine' 0 C--O 1.235 0.307 0 O-C-N 121.342 -0.848 . . . . 1.25 109.646 177.049 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 2.8 t70 . . . . . 0 N--CA 1.451 -0.381 0 C-N-CA 120.204 -0.599 . . . . 2.8 111.837 176.209 . . . . . . . . 0 0 . 1 . 029 nuclear build core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 50.8 t0 . . . . . 0 N--CA 1.465 0.322 0 CA-C-O 122.335 1.064 . . . . 2.19 108.4 . . . . . . . . . 0 0 . 1 . 029 nuclear build core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 2.0 mm -52.71 -51.6 34.34 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.29 0 C-N-CA 124.781 1.232 . . . . 0.57 110.211 -179.203 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 37.5 t80 -57.71 -31.54 66.52 Favored 'General case' 0 N--CA 1.454 -0.254 0 N-CA-C 113.044 0.757 . . . . 0.41 113.044 178.305 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 49' ' ' LYS . . . . . 0.447 ' HA ' ' HE2' ' A' ' 49' ' ' LYS . 1.0 OUTLIER -62.19 -44.8 95.79 Favored 'General case' 0 C--N 1.331 -0.216 0 O-C-N 120.967 -1.083 . . . . 1.09 111.091 -178.255 . . . . . . . . 3 3 . 1 . 029 nuclear build core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 17.8 tp10 -90.62 -61.61 1.64 Allowed 'General case' 0 CA--C 1.531 0.25 0 CA-C-O 122.442 1.115 . . . . 2.58 109.625 -177.141 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 51' ' ' GLU . . . . . 0.479 ' OE2' ' HE3' ' A' ' 91' ' ' LYS . 28.3 mm-40 -71.41 -34.23 70.16 Favored 'General case' 0 C--N 1.329 -0.305 0 C-N-CA 123.773 0.829 . . . . 2.43 109.889 -169.785 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 52' ' ' GLY . . . . . 0.427 ' HA2' ' CD1' ' A' ' 66' ' ' PHE . . . -69.84 38.8 0.4 Allowed Glycine 0 CA--C 1.528 0.889 0 C-N-CA 125.705 1.621 . . . . 0.4 113.894 168.162 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 34.3 t -153.37 37.82 0.48 Allowed 'General case' 0 N--CA 1.446 -0.656 0 O-C-N 121.133 -1.216 . . . . 1.68 108.191 159.371 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -141.18 -47.63 0.4 Allowed 'General case' 0 CA--C 1.518 -0.251 0 N-CA-C 112.384 0.513 . . . . 1.91 112.384 -169.203 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 55' ' ' LEU . . . . . 0.44 HD22 HG22 ' A' ' 85' ' ' VAL . 37.7 mt -63.31 -36.76 84.77 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 120.808 0.337 . . . . 0.51 110.911 -176.361 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER 177.09 166.5 0.55 Allowed 'General case' 0 CA--C 1.529 0.172 0 C-N-CA 124.673 1.189 . . . . 0.46 108.289 -173.602 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 9.3 m -60.04 -35.07 74.31 Favored 'General case' 0 N--CA 1.454 -0.253 0 C-N-CA 123.212 0.605 . . . . 0.91 110.608 168.73 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -67.59 -10.75 54.83 Favored 'General case' 0 CA--C 1.533 0.324 0 C-N-CA 123.126 0.57 . . . . 1.68 111.716 175.359 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -93.05 -8.62 61.49 Favored Glycine 0 N--CA 1.445 -0.721 0 C-N-CA 124.887 1.232 . . . . 0.43 110.982 174.895 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 37.0 ttt180 -108.88 -11.58 14.99 Favored 'General case' 0 CA--C 1.528 0.118 0 CA-C-N 118.598 1.199 . . . . 2.68 111.88 177.725 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 31.9 p -65.33 -156.1 0.01 OUTLIER 'General case' 0 CA--C 1.541 0.611 0 N-CA-C 109.361 -0.607 . . . . 0.87 109.361 170.098 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 1.3 m-20 -52.82 145.84 11.7 Favored 'General case' 0 CA--C 1.53 0.188 0 O-C-N 120.119 -1.613 . . . . 1.72 110.312 -178.01 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 31.4 tt0 -60.97 -27.91 68.61 Favored 'General case' 0 CA--C 1.537 0.461 0 CA-C-O 122.118 0.961 . . . . 3.17 111.083 -177.595 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -58.62 -41.45 85.93 Favored 'General case' 0 N--CA 1.452 -0.351 0 C-N-CA 124.848 1.259 . . . . 0.51 112.447 170.626 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 6.0 mt-10 -71.73 -42.03 67.8 Favored 'General case' 0 C--O 1.219 -0.534 0 CA-C-O 118.163 -0.922 . . . . 1.79 110.323 176.405 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 66' ' ' PHE . . . . . 0.427 ' CD1' ' HA2' ' A' ' 52' ' ' GLY . 52.7 t80 -50.33 -52.92 32.65 Favored 'General case' 0 N--CA 1.456 -0.143 0 C-N-CA 123.377 0.671 . . . . 0.38 111.077 175.488 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 52.2 t80 -59.64 -42.98 93.98 Favored 'General case' 0 CA--C 1.539 0.555 0 O-C-N 121.712 -0.617 . . . . 0.57 110.53 177.003 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -64.1 -54.28 36.48 Favored 'General case' 0 CA--C 1.538 0.505 0 O-C-N 121.278 -0.889 . . . . 0.37 113.054 -175.124 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 1.4 pp20? -61.56 -37.48 83.98 Favored 'General case' 0 C--N 1.332 -0.195 0 O-C-N 120.97 -1.081 . . . . 3.9 110.174 175.523 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -58.73 -36.27 74.03 Favored 'General case' 0 N--CA 1.451 -0.409 0 CA-C-N 118.377 0.535 . . . . 0.5 110.938 173.761 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 41.6 t80 -63.68 -51.04 66.84 Favored 'General case' 0 CA--C 1.531 0.221 0 CA-C-N 119.758 1.163 . . . . 3.23 111.359 171.627 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 6.2 ttp180 -45.15 -54.14 7.22 Favored 'General case' 0 N--CA 1.468 0.426 0 C-N-CA 123.244 0.618 . . . . 2.31 109.463 177.311 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -67.25 -55.26 14.72 Favored 'General case' 0 C--N 1.329 -0.325 0 C-N-CA 126.615 1.966 . . . . 0.76 110.793 -174.24 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -56.82 -31.73 65.03 Favored 'General case' 0 N--CA 1.464 0.268 0 CA-C-N 119.576 1.08 . . . . 2.78 111.416 -177.622 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 75' ' ' HIS . . . . . 0.432 ' CE1' HD12 ' A' ' 15' ' ' ILE . 0.0 OUTLIER -90.72 -19.92 23.02 Favored 'General case' 0 N--CA 1.454 -0.233 0 CA-C-O 117.342 -1.313 . . . . 0.9 111.748 179.284 . . . . . . . . 3 3 . 1 . 029 nuclear build core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 3.1 m -47.01 115.94 1.22 Allowed 'General case' 0 CA--C 1.507 -0.705 0 CA-C-N 119.953 1.251 . . . . 1.56 108.031 -174.815 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -46.12 -39.45 9.49 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 114.793 -1.094 . . . . 1.91 110.306 -179.533 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 18.0 t0 -57.3 104.78 0.18 Allowed 'General case' 0 N--CA 1.452 -0.337 0 CA-C-O 122.7 1.238 . . . . 2.04 111.556 168.562 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 1.9 p80 -46.73 -38.25 9.66 Favored 'General case' 0 N--CA 1.45 -0.428 0 CA-C-N 114.664 -1.153 . . . . 5.26 112.612 171.539 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -61.2 -58.76 6.98 Favored 'General case' 0 N--CA 1.45 -0.454 0 CA-C-N 119.276 0.944 . . . . 1.12 109.245 -176.346 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -48.27 -39.9 23.06 Favored 'General case' 0 N--CA 1.453 -0.275 0 C-N-CA 123.595 0.758 . . . . 3.68 112.101 179.125 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 12.8 mtt180 -64.23 -53.93 41.49 Favored 'General case' 0 C--N 1.328 -0.362 0 C-N-CA 120.441 -0.504 . . . . 3.2 110.904 178.6 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 83' ' ' LEU . . . . . 0.413 HD13 ' HA ' ' A' ' 83' ' ' LEU . 1.1 mm? -62.06 -23.26 66.37 Favored 'General case' 0 N--CA 1.449 -0.486 0 CA-C-O 117.883 -1.056 . . . . 0.67 111.57 177.654 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 1.7 mptm? -64.57 -42.46 95.62 Favored 'General case' 0 C--O 1.224 -0.281 0 CA-C-N 120.857 1.662 . . . . 1.64 108.283 171.867 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 85' ' ' VAL . . . . . 0.44 HG22 HD22 ' A' ' 55' ' ' LEU . 69.6 t -61.99 -63.45 0.81 Allowed 'Isoleucine or valine' 0 C--O 1.218 -0.557 0 CA-C-O 118.13 -0.938 . . . . 0.4 110.107 172.928 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -48.96 -47.47 43.89 Favored 'General case' 0 CA--C 1.536 0.412 0 CA-C-N 120.328 1.422 . . . . 1.95 111.704 -173.619 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 32.7 tttm -63.0 -50.53 70.39 Favored 'General case' 0 N--CA 1.452 -0.353 0 C-N-CA 124.449 1.1 . . . . 2.13 111.784 179.102 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 25.3 m-20 -86.78 5.16 37.86 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 119.038 -0.506 . . . . 1.07 110.997 -175.006 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 89' ' ' ALA . . . . . 0.422 ' HB2' HD21 ' A' ' 55' ' ' LEU . . . -162.28 69.36 2.16 Favored Pre-proline 0 N--CA 1.447 -0.575 0 C-N-CA 125.54 1.536 . . . . 0.37 109.277 -176.112 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 90.3 Cg_endo -79.45 59.86 7.57 Favored 'Trans proline' 0 N--CA 1.458 -0.566 0 C-N-CA 124.214 3.276 . . . . 1.96 110.801 -173.659 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 91' ' ' LYS . . . . . 0.479 ' HE3' ' OE2' ' A' ' 51' ' ' GLU . 0.0 OUTLIER 175.89 -48.4 0.01 OUTLIER 'General case' 0 CA--C 1.531 0.232 0 C-N-CA 127.046 2.139 . . . . 2.35 109.713 -172.574 . . . . . . . . 3 3 . 1 . 029 nuclear build core ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 8.6 m -57.74 -43.55 85.46 Favored 'General case' 0 CA--C 1.516 -0.333 0 O-C-N 121.101 -0.999 . . . . 0.46 111.445 179.991 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 3.7 t80 -54.28 -48.43 71.24 Favored 'General case' 0 CA--C 1.515 -0.402 0 C-N-CA 120.114 -0.635 . . . . 2.23 110.021 176.251 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 30.0 tt0 -60.82 -29.72 69.65 Favored 'General case' 0 N--CA 1.441 -0.888 0 CA-C-N 115.025 -0.989 . . . . 1.56 111.118 -179.799 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -63.41 -61.97 1.99 Allowed 'General case' 0 N--CA 1.463 0.205 0 C-N-CA 124.427 1.091 . . . . 1.62 108.919 -177.223 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 3.8 mp -53.35 -45.06 56.17 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.323 0 N-CA-C 108.48 -0.933 . . . . 0.99 108.48 177.246 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -57.69 -35.35 70.48 Favored 'General case' 0 C--O 1.225 -0.197 0 N-CA-C 112.352 0.501 . . . . 1.87 112.352 -179.655 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--N 1.334 -0.1 0 C-N-CA 124.845 1.258 . . . . 2.35 109.203 178.636 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 11.2 t80 . . . . . 0 CA--C 1.519 -0.236 0 CA-C-O 120.654 0.264 . . . . 2.67 110.677 . . . . . . . . . 0 0 . 1 . 030 nuclear build core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 0.6 OUTLIER -69.46 -32.85 54.63 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.328 0 CA-C-O 118.809 -0.615 . . . . 0.44 112.571 178.894 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 9.3 t60 -59.94 -58.51 8.23 Favored 'General case' 0 CA--C 1.53 0.21 0 N-CA-C 107.227 -1.397 . . . . 0.64 107.227 175.775 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 1.5 mp0 -51.37 -44.55 62.16 Favored 'General case' 0 C--O 1.226 -0.135 0 C-N-CA 124.154 0.982 . . . . 4.04 110.634 176.697 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 18' ' ' PHE . . . . . 0.453 ' O ' HG23 ' A' ' 22' ' ' VAL . 0.2 OUTLIER -54.2 -52.17 62.09 Favored 'General case' 0 CA--C 1.517 -0.322 0 C-N-CA 123.582 0.753 . . . . 2.61 109.505 179.884 . . . . . . . . 3 3 . 1 . 030 nuclear build core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -45.97 -49.05 13.88 Favored Glycine 0 CA--C 1.524 0.646 0 N-CA-C 110.808 -0.917 . . . . 0.48 110.808 174.435 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 4.3 t-80 -59.16 -47.06 86.68 Favored 'General case' 0 N--CA 1.452 -0.346 0 O-C-N 122.015 -0.697 . . . . 1.83 111.393 179.209 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -61.03 -32.66 72.27 Favored 'General case' 0 N--CA 1.453 -0.294 0 O-C-N 121.635 -0.666 . . . . 0.82 110.47 178.438 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 22' ' ' VAL . . . . . 0.453 HG23 ' O ' ' A' ' 18' ' ' PHE . 40.4 t -67.63 -35.28 72.39 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.267 0 O-C-N 121.235 -0.915 . . . . 0.93 110.393 178.271 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 8.0 t0 . . . . . 0 N--CA 1.451 -0.391 0 CA-C-O 121.506 0.669 . . . . 1.9 110.983 176.611 . . . . . . . . 0 0 . 1 . 030 nuclear build core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 16.2 t70 . . . . . 0 N--CA 1.468 0.456 0 N-CA-C 109.112 -0.699 . . . . 2.2 109.112 . . . . . . . . . 0 0 . 1 . 030 nuclear build core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 2.8 mm -54.69 -49.46 67.86 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.449 0 C-N-CA 125.338 1.455 . . . . 0.52 108.548 178.304 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 38.4 t80 -59.85 -26.35 65.76 Favored 'General case' 0 N--CA 1.453 -0.319 0 O-C-N 120.596 -1.315 . . . . 0.82 113.462 177.683 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 49' ' ' LYS . . . . . 0.628 ' HA ' ' HE2' ' A' ' 49' ' ' LYS . 9.0 mmpt? -70.04 -48.0 59.72 Favored 'General case' 0 CA--C 1.516 -0.339 0 O-C-N 120.095 -1.628 . . . . 1.51 110.859 -179.482 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 4.4 tp10 -87.51 -56.64 3.27 Favored 'General case' 0 CA--C 1.533 0.314 0 N-CA-C 109.039 -0.726 . . . . 2.11 109.039 -173.622 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 51' ' ' GLU . . . . . 0.465 ' OE1' ' HE3' ' A' ' 91' ' ' LYS . 19.0 mp0 -76.81 -31.87 57.25 Favored 'General case' 0 C--O 1.235 0.321 0 O-C-N 121.024 -1.048 . . . . 2.8 111.452 -175.952 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 52' ' ' GLY . . . . . 0.42 ' HA2' ' CD1' ' A' ' 66' ' ' PHE . . . -70.04 38.76 0.42 Allowed Glycine 0 CA--C 1.532 1.124 0 C-N-CA 124.997 1.284 . . . . 0.39 114.343 171.595 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 39.2 t -154.21 49.37 0.63 Allowed 'General case' 0 N--CA 1.448 -0.537 0 N-CA-C 107.234 -1.395 . . . . 1.96 107.234 153.692 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -145.34 -49.7 0.24 Allowed 'General case' 0 CA--C 1.516 -0.339 0 N-CA-C 112.644 0.609 . . . . 2.06 112.644 -177.306 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 55' ' ' LEU . . . . . 0.537 HD21 ' HB2' ' A' ' 89' ' ' ALA . 17.5 mt -60.46 -35.54 76.12 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-O 120.891 0.377 . . . . 0.35 111.047 -172.962 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER 178.28 169.58 0.78 Allowed 'General case' 0 CA--C 1.53 0.209 0 C-N-CA 125.752 1.621 . . . . 0.45 107.487 -179.307 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 26.4 m -59.16 -33.36 70.82 Favored 'General case' 0 N--CA 1.454 -0.233 0 O-C-N 121.673 -0.642 . . . . 1.04 110.633 169.93 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -59.58 -34.19 72.4 Favored 'General case' 0 C--N 1.34 0.189 0 CA-C-N 118.31 0.505 . . . . 1.35 109.992 173.114 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -67.95 -9.91 57.67 Favored Glycine 0 C--O 1.22 -0.741 0 CA-C-O 119.074 -0.848 . . . . 0.42 111.836 178.184 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 41.3 ttt180 -107.77 -8.92 15.9 Favored 'General case' 0 N--CA 1.454 -0.237 0 CA-C-N 119.082 1.441 . . . . 3.5 112.582 178.084 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 68.7 p -69.45 -126.34 0.0 OUTLIER 'General case' 0 CA--C 1.537 0.461 0 CA-C-N 118.404 0.547 . . . . 1.08 111.196 179.456 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 4.2 t-20 -75.13 148.65 39.49 Favored 'General case' 0 N--CA 1.45 -0.43 0 O-C-N 120.081 -1.637 . . . . 1.83 107.497 176.156 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 30.7 tt0 -60.61 -31.98 71.12 Favored 'General case' 0 CA--C 1.538 0.5 0 CA-C-O 121.828 0.823 . . . . 3.26 110.37 179.425 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -61.36 -34.45 75.32 Favored 'General case' 0 CA--C 1.53 0.192 0 O-C-N 121.172 -0.955 . . . . 0.55 113.105 173.542 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 4.6 mt-10 -77.55 -39.27 46.48 Favored 'General case' 0 C--O 1.222 -0.378 0 O-C-N 121.016 -1.053 . . . . 2.07 110.137 179.246 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 66' ' ' PHE . . . . . 0.42 ' CD1' ' HA2' ' A' ' 52' ' ' GLY . 43.7 t80 -50.34 -45.66 55.16 Favored 'General case' 0 CA--C 1.532 0.253 0 C-N-CA 124.775 1.23 . . . . 0.41 110.959 170.434 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 72.1 t80 -65.86 -43.96 86.85 Favored 'General case' 0 CA--C 1.533 0.309 0 O-C-N 120.994 -1.067 . . . . 0.48 111.758 175.311 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -62.96 -53.98 45.63 Favored 'General case' 0 CA--C 1.537 0.449 0 O-C-N 121.381 -0.824 . . . . 0.41 112.002 -174.369 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -55.94 -40.97 73.94 Favored 'General case' 0 C--N 1.332 -0.182 0 O-C-N 120.92 -1.112 . . . . 3.89 111.299 169.868 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -55.99 -40.17 72.93 Favored 'General case' 0 C--O 1.223 -0.297 0 CA-C-N 119.122 0.874 . . . . 0.4 110.844 177.471 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 56.9 t80 -58.06 -49.93 75.19 Favored 'General case' 0 C--O 1.233 0.224 0 CA-C-N 119.683 1.129 . . . . 3.32 111.504 174.316 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 48.3 ttt180 -49.56 -53.8 21.66 Favored 'General case' 0 N--CA 1.467 0.377 0 N-CA-C 109.322 -0.621 . . . . 2.08 109.322 177.605 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 73' ' ' LEU . . . . . 0.553 ' HB3' HG21 ' A' ' 85' ' ' VAL . 0.1 OUTLIER -65.38 -34.24 77.84 Favored 'General case' 0 C--N 1.327 -0.392 0 C-N-CA 124.187 0.995 . . . . 0.43 110.289 -175.851 . . . . . . . . 3 3 . 1 . 030 nuclear build core ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER -60.04 -42.37 94.3 Favored 'General case' 0 C--N 1.333 -0.139 0 C-N-CA 123.77 0.828 . . . . 2.36 110.939 -176.341 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 9.3 p80 -95.13 -4.99 45.14 Favored 'General case' 0 N--CA 1.457 -0.113 0 CA-C-O 116.964 -1.493 . . . . 0.86 113.365 -178.306 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 12.4 m -40.92 126.29 2.48 Favored 'General case' 0 N--CA 1.452 -0.34 0 CA-C-O 123.222 1.487 . . . . 1.04 110.806 -168.349 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 1.1 p -52.82 -42.19 64.89 Favored 'General case' 0 N--CA 1.447 -0.584 0 CA-C-N 112.642 -2.072 . . . . 0.95 108.8 179.481 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 62.3 t0 -72.55 111.68 7.94 Favored 'General case' 0 N--CA 1.451 -0.414 0 CA-C-O 122.089 0.947 . . . . 2.07 108.673 168.885 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 4.2 t-160 -54.3 -33.05 57.91 Favored 'General case' 0 CA--C 1.532 0.268 0 CA-C-N 115.738 -0.665 . . . . 5.62 109.802 176.899 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -56.87 -52.19 66.1 Favored 'General case' 0 N--CA 1.451 -0.4 0 CA-C-N 117.904 0.32 . . . . 0.65 110.708 176.672 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 5.2 mt-10 -52.12 -39.57 60.06 Favored 'General case' 0 CA--C 1.514 -0.428 0 C-N-CA 123.365 0.666 . . . . 2.86 110.966 -177.59 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 2.4 mtp180 -61.92 -53.54 54.36 Favored 'General case' 0 N--CA 1.448 -0.546 0 C-N-CA 119.971 -0.692 . . . . 2.7 109.738 176.864 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 1.3 mm? -61.01 -24.53 66.23 Favored 'General case' 0 N--CA 1.453 -0.294 0 CA-C-O 117.421 -1.276 . . . . 0.53 112.936 177.655 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 2.0 mptm? -63.73 -43.11 97.5 Favored 'General case' 0 CA--C 1.522 -0.131 0 CA-C-N 121.499 1.954 . . . . 1.17 107.981 173.882 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 85' ' ' VAL . . . . . 0.553 HG21 ' HB3' ' A' ' 73' ' ' LEU . 99.7 t -64.13 -63.3 0.89 Allowed 'Isoleucine or valine' 0 C--O 1.214 -0.808 0 CA-C-O 118.437 -0.792 . . . . 0.45 110.009 173.233 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -49.44 -38.57 29.88 Favored 'General case' 0 CA--C 1.532 0.256 0 CA-C-N 120.325 1.42 . . . . 2.05 112.277 -172.492 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 22.7 tttt -64.52 -58.98 4.88 Favored 'General case' 0 N--CA 1.45 -0.439 0 C-N-CA 124.81 1.244 . . . . 2.02 110.833 174.025 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 61.6 m-20 -80.48 2.37 25.54 Favored 'General case' 0 CA--C 1.535 0.373 0 C-N-CA 123.505 0.722 . . . . 1.11 111.815 -173.733 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 89' ' ' ALA . . . . . 0.537 ' HB2' HD21 ' A' ' 55' ' ' LEU . . . -156.66 73.63 4.74 Favored Pre-proline 0 N--CA 1.446 -0.639 0 C-N-CA 126.802 2.041 . . . . 0.5 108.012 -175.387 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 62.1 Cg_endo -80.69 60.81 8.01 Favored 'Trans proline' 0 N--CA 1.454 -0.824 0 C-N-CA 124.057 3.171 . . . . 1.96 109.351 -179.837 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 91' ' ' LYS . . . . . 0.465 ' HE3' ' OE1' ' A' ' 51' ' ' GLU . 0.0 OUTLIER 171.28 -56.81 0.01 OUTLIER 'General case' 0 C--O 1.224 -0.269 0 C-N-CA 126.411 1.884 . . . . 2.36 110.466 -170.345 . . . . . . . . 3 3 . 1 . 030 nuclear build core ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 1.4 m -53.69 -46.01 70.56 Favored 'General case' 0 N--CA 1.466 0.373 0 CA-C-N 119.95 1.25 . . . . 0.43 110.75 -179.534 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 8.6 t80 -61.21 -46.34 90.87 Favored 'General case' 0 CA--C 1.509 -0.599 0 CA-C-O 121.653 0.74 . . . . 2.46 110.187 178.852 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 8.1 tt0 -58.53 -30.95 67.48 Favored 'General case' 0 N--CA 1.441 -0.902 0 CA-C-N 114.482 -1.236 . . . . 1.81 110.126 -178.538 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -63.99 -68.74 0.32 Allowed 'General case' 0 N--CA 1.452 -0.349 0 C-N-CA 124.634 1.174 . . . . 1.02 108.753 -177.666 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 96' ' ' ILE . . . . . 0.447 HD12 ' H ' ' A' ' 96' ' ' ILE . 3.8 mp -49.86 -43.38 19.59 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.217 0 C-N-CA 123.457 0.703 . . . . 0.86 109.743 176.653 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 13.0 t30 -61.03 -35.42 76.83 Favored 'General case' 0 CA--C 1.531 0.241 0 O-C-N 121.961 -0.462 . . . . 1.37 111.94 -177.418 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 23.1 t70 . . . . . 0 CA--C 1.516 -0.362 0 C-N-CA 123.499 0.719 . . . . 2.12 109.624 173.777 . . . . . . . . 0 0 . 1 . 031 nuclear build core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 49.7 t80 . . . . . 0 N--CA 1.463 0.204 0 CA-C-O 121.38 0.61 . . . . 4.12 110.685 . . . . . . . . . 0 0 . 1 . 031 nuclear build core ' A' A ' 15' ' ' ILE . . . . . 0.412 HD12 ' CE1' ' A' ' 75' ' ' HIS . 1.2 pt -63.05 -33.18 59.27 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.449 0 O-C-N 121.151 -0.968 . . . . 0.61 112.093 -178.488 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 2.6 t-160 -58.49 -49.27 77.98 Favored 'General case' 0 CA--C 1.532 0.268 0 N-CA-C 107.69 -1.226 . . . . 0.84 107.69 174.903 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 40.1 mt-10 -61.01 -36.56 79.82 Favored 'General case' 0 C--O 1.218 -0.554 0 C-N-CA 124.168 0.987 . . . . 2.73 109.752 -178.195 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 4.1 t80 -55.04 -50.23 69.61 Favored 'General case' 0 CA--C 1.522 -0.099 0 CA-C-N 119.354 0.979 . . . . 3.78 110.284 171.827 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -48.35 -50.23 23.98 Favored Glycine 0 CA--C 1.524 0.615 0 N-CA-C 111.454 -0.658 . . . . 0.58 111.454 172.768 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 20' ' ' HIS . . . . . 0.445 ' NE2' ' HB1' ' A' ' 64' ' ' ALA . 2.2 t-80 -63.89 -44.93 91.51 Favored 'General case' 0 N--CA 1.45 -0.443 0 O-C-N 121.846 -0.796 . . . . 1.97 111.408 -177.533 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -55.86 -34.1 65.14 Favored 'General case' 0 N--CA 1.448 -0.536 0 C-N-CA 123.575 0.75 . . . . 0.96 109.125 -178.318 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 98.5 t -68.37 -42.37 84.13 Favored 'Isoleucine or valine' 0 N--CA 1.457 -0.101 0 C-N-CA 119.782 -0.767 . . . . 1.05 111.986 174.474 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 3.7 t70 . . . . . 0 N--CA 1.465 0.312 0 CA-C-O 122.284 1.04 . . . . 2.34 111.428 173.262 . . . . . . . . 0 0 . 1 . 031 nuclear build core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 45.9 t0 . . . . . 0 N--CA 1.461 0.097 0 N-CA-C 108.817 -0.809 . . . . 2.48 108.817 . . . . . . . . . 0 0 . 1 . 031 nuclear build core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 7.1 mm -50.2 -54.44 8.44 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.523 0 C-N-CA 125.32 1.448 . . . . 0.44 109.202 174.387 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 30.4 t80 -61.83 -26.5 68.16 Favored 'General case' 0 CA--C 1.531 0.245 0 O-C-N 120.927 -1.108 . . . . 0.38 113.232 179.578 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 49' ' ' LYS . . . . . 0.573 ' HA ' ' HE2' ' A' ' 49' ' ' LYS . 9.6 mmpt? -72.24 -45.01 62.01 Favored 'General case' 0 CA--C 1.516 -0.347 0 O-C-N 119.675 -1.891 . . . . 1.21 111.684 -175.513 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -86.72 -64.68 1.11 Allowed 'General case' 0 C--N 1.328 -0.349 0 N-CA-C 106.774 -1.565 . . . . 3.71 106.774 -177.701 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 15.0 mm-40 -65.09 -36.05 83.09 Favored 'General case' 0 N--CA 1.452 -0.367 0 CA-C-N 115.677 -0.692 . . . . 2.16 110.165 -170.925 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 52' ' ' GLY . . . . . 0.452 ' HA2' ' CD1' ' A' ' 66' ' ' PHE . . . -69.07 37.6 0.3 Allowed Glycine 0 CA--C 1.527 0.82 0 C-N-CA 125.582 1.563 . . . . 0.29 114.44 171.761 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 11.2 t -147.71 23.4 1.11 Allowed 'General case' 0 N--CA 1.451 -0.401 0 O-C-N 121.047 -1.267 . . . . 1.82 110.47 155.592 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 13.7 t30 -134.11 -23.13 1.75 Allowed 'General case' 0 C--N 1.342 0.28 0 N-CA-C 113.958 1.096 . . . . 1.78 113.958 -164.1 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 55' ' ' LEU . . . . . 0.563 HD22 HG22 ' A' ' 85' ' ' VAL . 14.6 mt -76.91 -37.02 56.21 Favored 'General case' 0 C--O 1.226 -0.144 0 O-C-N 121.891 -0.505 . . . . 0.45 110.571 176.124 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER 178.2 169.91 0.76 Allowed 'General case' 0 CA--C 1.532 0.273 0 C-N-CA 125.795 1.638 . . . . 0.61 107.096 -175.796 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 7.2 m -60.11 -33.88 72.72 Favored 'General case' 0 N--CA 1.454 -0.266 0 O-C-N 121.708 -0.62 . . . . 1.2 110.721 168.596 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -67.77 -9.11 41.27 Favored 'General case' 0 N--CA 1.467 0.41 0 N-CA-C 112.328 0.492 . . . . 1.47 112.328 174.498 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -87.83 -3.91 79.67 Favored Glycine 0 C--O 1.221 -0.683 0 CA-C-O 118.472 -1.182 . . . . 0.44 111.09 173.366 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 3.6 ttp85 -118.0 -7.97 10.8 Favored 'General case' 0 CA--C 1.53 0.183 0 CA-C-N 119.292 1.546 . . . . 3.53 112.253 -177.155 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 25.4 p -67.39 -148.13 0.01 OUTLIER 'General case' 0 CA--C 1.537 0.477 0 C-N-CA 124.958 1.303 . . . . 0.89 109.079 172.165 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 3.7 m120 -56.7 143.77 35.12 Favored 'General case' 0 N--CA 1.455 -0.176 0 O-C-N 119.753 -1.842 . . . . 2.53 109.176 176.049 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 15.6 tm-20 -57.04 -32.86 66.62 Favored 'General case' 0 C--O 1.223 -0.338 0 CA-C-O 121.538 0.685 . . . . 3.58 110.078 178.086 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 64' ' ' ALA . . . . . 0.445 ' HB1' ' NE2' ' A' ' 20' ' ' HIS . . . -56.62 -35.37 68.22 Favored 'General case' 0 N--CA 1.45 -0.466 0 O-C-N 121.357 -0.839 . . . . 0.63 112.676 176.332 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 8.9 mt-10 -75.62 -42.18 52.38 Favored 'General case' 0 CA--C 1.512 -0.485 0 O-C-N 121.4 -0.812 . . . . 2.09 110.834 175.184 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 66' ' ' PHE . . . . . 0.452 ' CD1' ' HA2' ' A' ' 52' ' ' GLY . 37.4 t80 -49.47 -56.49 9.57 Favored 'General case' 0 N--CA 1.454 -0.275 0 C-N-CA 123.782 0.833 . . . . 0.36 110.818 175.104 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 90.5 t80 -62.14 -48.37 80.43 Favored 'General case' 0 N--CA 1.451 -0.424 0 C-N-CA 123.19 0.596 . . . . 0.46 110.686 179.697 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -59.02 -39.4 81.81 Favored 'General case' 0 CA--C 1.544 0.737 0 O-C-N 121.112 -0.992 . . . . 0.3 112.54 -178.113 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 37.4 mm-40 -64.37 -42.21 96.31 Favored 'General case' 0 CA--C 1.518 -0.288 0 C-N-CA 124.563 1.145 . . . . 4.58 109.901 172.314 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -53.69 -43.05 68.6 Favored 'General case' 0 N--CA 1.449 -0.477 0 CA-C-O 118.282 -0.866 . . . . 0.42 109.694 178.485 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 10.8 t80 -59.15 -49.48 77.7 Favored 'General case' 0 N--CA 1.463 0.211 0 CA-C-N 119.437 1.017 . . . . 2.2 111.898 173.13 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -50.27 -55.95 13.26 Favored 'General case' 0 CA--C 1.531 0.223 0 O-C-N 121.588 -0.695 . . . . 2.47 110.408 179.301 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' A' A ' 73' ' ' LEU . . . . . 0.722 HD12 HG23 ' A' ' 85' ' ' VAL . 0.2 OUTLIER -63.66 -30.56 71.65 Favored 'General case' 0 C--N 1.325 -0.495 0 C-N-CA 125.819 1.648 . . . . 0.42 110.846 -179.756 . . . . . . . . 3 3 . 1 . 031 nuclear build core ' A' A ' 74' ' ' MET . . . . . 0.452 ' HA ' ' CE2' ' A' ' 93' ' ' PHE . 1.1 tmt? -61.97 -39.92 93.82 Favored 'General case' 0 N--CA 1.451 -0.378 0 C-N-CA 123.281 0.632 . . . . 2.58 111.976 -177.364 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' A' A ' 75' ' ' HIS . . . . . 0.412 ' CE1' HD12 ' A' ' 15' ' ' ILE . 27.6 p80 -90.06 -45.97 8.8 Favored 'General case' 0 C--O 1.225 -0.225 0 CA-C-O 116.758 -1.592 . . . . 1.11 110.064 179.992 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 14.8 m 5.4 111.1 0.0 OUTLIER 'General case' 0 N--CA 1.469 0.492 0 C-N-CA 129.09 2.956 . . . . 1.06 114.719 -174.514 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 3.1 p -46.47 -44.58 17.63 Favored 'General case' 0 C--O 1.235 0.325 0 C-N-CA 125.38 1.472 . . . . 1.07 110.837 179.417 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 11.3 t0 -66.17 104.31 1.15 Allowed 'General case' 0 N--CA 1.449 -0.482 0 N-CA-C 108.673 -0.862 . . . . 2.18 108.673 167.279 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 41.4 m80 -55.86 -30.96 62.32 Favored 'General case' 0 N--CA 1.454 -0.26 0 CA-C-O 118.994 -0.527 . . . . 5.42 111.084 176.747 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -58.13 -50.95 71.69 Favored 'General case' 0 N--CA 1.446 -0.668 0 CA-C-O 117.937 -1.03 . . . . 0.6 109.767 176.708 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 1.9 mt-10 -46.89 -41.2 15.47 Favored 'General case' 0 N--CA 1.464 0.236 0 CA-C-N 119.583 1.083 . . . . 3.1 111.083 179.128 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -62.94 -51.66 66.06 Favored 'General case' 0 C--N 1.327 -0.383 0 N-CA-C 109.359 -0.608 . . . . 3.01 109.359 179.149 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 1.7 mm? -66.56 -18.97 65.66 Favored 'General case' 0 N--CA 1.453 -0.301 0 CA-C-O 118.11 -0.948 . . . . 0.47 113.261 176.922 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 2.0 mptm? -65.56 -48.51 72.14 Favored 'General case' 0 CA--C 1.518 -0.279 0 CA-C-N 120.629 1.559 . . . . 1.26 106.805 169.346 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 85' ' ' VAL . . . . . 0.722 HG23 HD12 ' A' ' 73' ' ' LEU . 45.6 t -63.9 -46.57 93.8 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.663 0 CA-C-O 117.482 -1.247 . . . . 0.45 111.809 177.955 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 30.3 mt-30 -60.9 -52.23 65.91 Favored 'General case' 0 N--CA 1.462 0.126 0 CA-C-N 122.114 2.233 . . . . 2.14 111.261 179.61 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -65.13 -40.46 94.5 Favored 'General case' 0 CA--C 1.532 0.254 0 O-C-N 121.654 -0.653 . . . . 2.39 110.463 -172.717 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 6.9 m-20 -75.32 -21.75 58.18 Favored 'General case' 0 C--O 1.226 -0.172 0 CA-C-O 118.772 -0.632 . . . . 0.9 110.771 177.948 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 89' ' ' ALA . . . . . 0.442 ' HB2' HD21 ' A' ' 55' ' ' LEU . . . -143.54 77.29 15.41 Favored Pre-proline 0 C--O 1.237 0.444 0 C-N-CA 124.15 0.98 . . . . 0.33 110.217 -173.238 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 94.2 Cg_endo -79.75 66.67 8.77 Favored 'Trans proline' 0 N--CA 1.453 -0.856 0 C-N-CA 124.024 3.15 . . . . 1.94 109.8 -173.27 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER 168.34 -53.07 0.01 OUTLIER 'General case' 0 C--O 1.224 -0.273 0 C-N-CA 126.923 2.089 . . . . 2.22 111.234 -171.718 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 4.3 m -55.38 -47.02 76.47 Favored 'General case' 0 N--CA 1.466 0.338 0 CA-C-N 120.19 1.359 . . . . 0.46 110.567 -177.525 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 93' ' ' PHE . . . . . 0.452 ' CE2' ' HA ' ' A' ' 74' ' ' MET . 8.2 t80 -59.92 -48.11 83.03 Favored 'General case' 0 CA--C 1.511 -0.528 0 CA-C-O 121.552 0.691 . . . . 1.87 110.163 178.278 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 8.3 tt0 -56.76 -31.31 64.47 Favored 'General case' 0 N--CA 1.441 -0.875 0 CA-C-N 114.602 -1.181 . . . . 1.91 110.163 -178.019 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 7.1 t80 -64.86 -56.25 14.54 Favored 'General case' 0 N--CA 1.453 -0.319 0 C-N-CA 124.02 0.928 . . . . 1.12 109.798 -176.362 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 2.9 mp -57.93 -44.62 87.04 Favored 'Isoleucine or valine' 0 N--CA 1.457 -0.119 0 N-CA-C 108.44 -0.948 . . . . 0.85 108.44 177.321 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 24.3 t30 -60.61 -31.8 70.95 Favored 'General case' 0 CA--C 1.532 0.273 0 C-N-CA 122.285 0.234 . . . . 1.45 111.544 -177.427 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 CA--C 1.521 -0.145 0 C-N-CA 124.552 1.141 . . . . 2.64 109.17 176.086 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.474 1.229 0 N-CA-C 110.194 -1.163 . . . . 10.82 110.194 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 2' ' ' SER . . . . . 0.451 ' O ' ' HE2' ' A' ' 3' ' ' LYS . 59.9 m 69.15 68.42 0.27 Allowed 'General case' 0 N--CA 1.453 -0.298 0 N-CA-C 115.652 1.723 . . . . 11.24 115.652 139.595 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 3' ' ' LYS . . . . . 0.451 ' HE2' ' O ' ' A' ' 2' ' ' SER . 0.0 OUTLIER -139.65 154.85 47.63 Favored 'General case' 0 C--N 1.334 -0.093 0 N-CA-C 107.197 -1.408 . . . . 13.99 107.197 158.523 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -102.74 -100.54 2.56 Favored Glycine 0 CA--C 1.506 -0.508 0 N-CA-C 106.721 -2.552 . . . . 10.53 106.721 -1.177 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 33.2 m -73.52 -166.94 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.439 -0.979 0 N-CA-C 108.016 -1.105 . . . . 11.25 108.016 150.771 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 3.1 pt-20 -87.05 70.5 10.26 Favored 'General case' 0 N--CA 1.445 -0.713 0 CA-C-O 122.818 1.294 . . . . 8.73 112.856 175.578 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 7' ' ' LEU . . . . . 0.522 ' H ' HD13 ' A' ' 7' ' ' LEU . 0.0 OUTLIER -73.75 23.51 0.08 Allowed 'General case' 0 CA--C 1.543 0.678 0 CA-C-N 112.988 -1.915 . . . . 7.39 111.803 137.252 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . 0.348 0.3 OUTLIER 81.39 -36.87 0.12 Allowed 'General case' 0 N--CA 1.454 -0.267 0 C-N-CA 129.402 3.081 . . . . 6.45 113.189 161.241 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 6.6 m-20 -43.21 -41.51 3.85 Favored 'General case' 0 CA--C 1.516 -0.347 0 N-CA-C 113.47 0.915 . . . . 2.44 113.47 170.659 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 10' ' ' ASP . . . . . 0.428 ' HA ' ' HA ' ' A' ' 2' ' ' SER . 0.0 OUTLIER -57.19 -53.14 61.48 Favored 'General case' 0 N--CA 1.45 -0.435 0 C-N-CA 120.272 -0.571 . . . . 3.17 110.181 -177.162 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 2.6 m -77.71 -48.58 16.35 Favored 'General case' 0 N--CA 1.44 -0.964 0 N-CA-C 108.309 -0.997 . . . . 1.5 108.309 -166.305 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 12' ' ' GLU . . . . . 0.476 ' HA ' HD11 ' A' ' 15' ' ' ILE . 7.4 pt-20 -74.28 -27.4 60.71 Favored 'General case' 0 N--CA 1.449 -0.483 0 CA-C-N 115.298 -0.864 . . . . 2.98 110.198 -175.025 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -66.68 -56.39 13.29 Favored Glycine 0 N--CA 1.446 -0.651 0 N-CA-C 108.855 -1.698 . . . . 0.69 108.855 168.772 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 1.8 t80 -54.27 -46.21 72.61 Favored 'General case' 0 C--O 1.224 -0.271 0 CA-C-N 118.544 1.172 . . . . 2.32 110.755 -173.855 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 15' ' ' ILE . . . . . 0.476 HD11 ' HA ' ' A' ' 12' ' ' GLU . 1.8 pt -71.94 -29.91 35.0 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.299 0 N-CA-C 113.349 0.87 . . . . 0.58 113.349 176.666 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 4.9 t60 -59.67 -57.65 12.02 Favored 'General case' 0 CA--C 1.533 0.297 0 N-CA-C 106.6 -1.63 . . . . 0.55 106.6 174.662 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 28.1 mt-10 -48.1 -45.09 32.41 Favored 'General case' 0 C--O 1.223 -0.311 0 C-N-CA 126.631 1.972 . . . . 2.65 110.368 174.55 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 1.4 t80 -59.23 -48.15 82.69 Favored 'General case' 0 CA--C 1.519 -0.239 0 C-N-CA 123.421 0.688 . . . . 2.03 110.184 179.857 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -51.34 -45.18 52.93 Favored Glycine 0 CA--C 1.523 0.553 0 N-CA-C 110.476 -1.05 . . . . 0.44 110.476 171.835 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 20' ' ' HIS . . . . . 0.463 ' CE1' ' HB1' ' A' ' 64' ' ' ALA . 3.9 t60 -64.42 -34.05 77.29 Favored 'General case' 0 N--CA 1.45 -0.451 0 O-C-N 121.628 -0.925 . . . . 1.9 111.826 179.689 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -71.29 -30.09 65.84 Favored 'General case' 0 N--CA 1.454 -0.267 0 O-C-N 121.505 -0.747 . . . . 0.57 109.884 174.594 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 60.5 t -67.25 -39.94 83.98 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.299 0 O-C-N 120.951 -1.093 . . . . 0.76 109.641 174.55 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 15.3 t0 -62.31 -26.79 68.61 Favored 'General case' 0 C--N 1.327 -0.376 0 C-N-CA 123.669 0.788 . . . . 2.02 111.468 175.465 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 6.6 t70 -73.72 -54.92 6.98 Favored 'General case' 0 N--CA 1.452 -0.353 0 N-CA-C 108.122 -1.066 . . . . 1.84 108.122 -175.893 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 61.0 t80 -63.47 -43.3 97.7 Favored 'General case' 0 CA--C 1.52 -0.187 0 N-CA-C 109.012 -0.736 . . . . 2.45 109.012 -179.296 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -56.35 -38.2 71.05 Favored 'General case' 0 N--CA 1.445 -0.705 0 CA-C-O 118.154 -0.927 . . . . 1.01 110.877 176.381 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -75.74 -31.28 56.46 Favored Glycine 0 CA--C 1.526 0.759 0 CA-C-N 119.721 1.146 . . . . 1.06 111.935 -179.429 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 1.0 OUTLIER -69.0 -43.2 75.29 Favored 'General case' 0 CA--C 1.532 0.264 0 O-C-N 121.295 -1.121 . . . . 1.97 109.525 179.918 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -83.81 -33.88 24.84 Favored 'General case' 0 N--CA 1.45 -0.438 0 C-N-CA 125.615 1.566 . . . . 1.41 113.361 -177.658 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 21.2 mt -131.28 149.98 52.34 Favored 'General case' 0 N--CA 1.45 -0.456 0 N-CA-C 108.016 -1.105 . . . . 2.1 108.016 -168.263 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 2.1 t70 77.73 -161.14 0.03 OUTLIER 'General case' 0 C--N 1.327 -0.375 0 N-CA-C 107.41 -1.329 . . . . 4.7 107.41 -154.748 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 1.3 mmpt? -162.1 -36.82 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.366 0 O-C-N 121.532 -0.73 . . . . 6.82 111.284 -135.292 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 31.4 t30 -128.09 154.79 45.32 Favored 'General case' 0 C--O 1.221 -0.435 0 N-CA-C 108.889 -0.782 . . . . 5.87 108.889 -170.205 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 41.1 tt0 2.43 -47.35 0.0 OUTLIER 'General case' 0 N--CA 1.472 0.632 0 C-N-CA 130.087 3.355 . . . . 7.4 116.584 151.669 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 4.9 m -53.19 109.5 0.44 Allowed 'General case' 0 CA--C 1.536 0.436 0 C-N-CA 124.717 1.207 . . . . 5.47 109.923 175.904 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 27.3 t70 -79.48 -19.22 50.31 Favored 'General case' 0 CA--C 1.538 0.491 0 N-CA-C 114.567 1.321 . . . . 5.97 114.567 -145.426 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 8.3 mp -129.47 161.57 30.1 Favored 'General case' 0 CA--C 1.538 0.495 0 C-N-CA 126.077 1.751 . . . . 1.89 107.763 -170.115 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 1.9 p -73.99 -12.14 15.07 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.657 0 CA-C-N 120.233 1.378 . . . . 2.06 111.807 -179.212 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 12.0 t -44.44 146.1 0.75 Allowed 'General case' 0 CA--C 1.532 0.27 0 C-N-CA 124.102 0.961 . . . . 3.14 111.082 167.313 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 49.8 t30 50.56 44.54 27.23 Favored 'General case' 0 N--CA 1.453 -0.318 0 C-N-CA 125.097 1.359 . . . . 5.32 112.263 178.269 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 12.1 t -120.78 -170.4 1.99 Allowed 'General case' 0 N--CA 1.447 -0.607 0 N-CA-C 106.726 -1.583 . . . . 2.94 106.726 160.586 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 9.5 tttm 71.91 -68.81 0.21 Allowed 'General case' 0 N--CA 1.465 0.324 0 C-N-CA 124.862 1.265 . . . . 5.95 111.942 178.197 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 15.6 tttm -141.71 58.73 1.5 Allowed 'General case' 0 CA--C 1.529 0.154 0 C-N-CA 123.934 0.894 . . . . 5.96 108.848 -171.529 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 18.4 m-30 9.13 92.42 0.01 OUTLIER 'General case' 0 N--CA 1.466 0.36 0 C-N-CA 127.978 2.511 . . . . 4.75 113.849 178.594 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 45' ' ' ILE . . . . . 0.401 HD11 ' HE3' ' A' ' 49' ' ' LYS 0.336 3.6 tt 53.57 12.81 0.05 OUTLIER 'Isoleucine or valine' 0 CA--C 1.554 1.103 0 C-N-CA 125.858 1.663 . . . . 2.36 115.297 161.046 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 3.3 t0 -58.36 -61.65 2.42 Favored 'General case' 0 N--CA 1.47 0.567 0 C-N-CA 126.291 1.837 . . . . 2.51 110.518 176.071 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 3.9 mm -54.5 -47.43 71.17 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.301 0 C-N-CA 125.372 1.469 . . . . 0.45 108.616 -172.099 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 26.0 t80 -65.98 -37.1 85.11 Favored 'General case' 0 N--CA 1.449 -0.511 0 O-C-N 121.7 -0.625 . . . . 0.43 112.315 176.792 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 49' ' ' LYS . . . . . 0.488 ' CA ' ' HE2' ' A' ' 49' ' ' LYS . 0.0 OUTLIER -64.27 -45.74 86.75 Favored 'General case' 0 CA--C 1.514 -0.432 0 C-N-CA 118.007 -1.477 . . . . 1.38 111.244 -172.735 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 5.4 tp10 -84.31 -66.22 0.92 Allowed 'General case' 0 N--CA 1.446 -0.626 0 N-CA-C 108.242 -1.022 . . . . 2.05 108.242 -177.919 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 9.2 mm-40 -69.94 -32.13 70.24 Favored 'General case' 0 CA--C 1.533 0.29 0 O-C-N 121.439 -0.788 . . . . 2.04 110.555 -169.052 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -68.89 37.04 0.29 Allowed Glycine 0 CA--C 1.529 0.931 0 C-N-CA 125.992 1.758 . . . . 0.3 114.546 172.154 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 76.7 p -140.03 17.71 2.46 Favored 'General case' 0 N--CA 1.448 -0.546 0 O-C-N 121.224 -1.162 . . . . 2.09 111.401 160.093 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 30.4 t-20 -131.67 -39.3 1.12 Allowed 'General case' 0 C--N 1.339 0.146 0 N-CA-C 112.099 0.407 . . . . 1.56 112.099 -162.533 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 24.6 mt -63.05 -35.87 81.68 Favored 'General case' 0 CA--C 1.533 0.299 0 O-C-N 121.745 -0.597 . . . . 0.37 110.972 -176.257 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 4.4 t 168.32 175.55 0.04 OUTLIER 'General case' 0 CA--C 1.534 0.351 0 C-N-CA 127.463 2.305 . . . . 0.91 107.673 -179.052 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 6.9 m -59.69 -37.57 79.2 Favored 'General case' 0 N--CA 1.454 -0.249 0 C-N-CA 124.425 1.09 . . . . 0.91 111.378 176.348 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -63.97 -28.41 69.8 Favored 'General case' 0 N--CA 1.463 0.204 0 C-N-CA 122.938 0.495 . . . . 1.04 111.258 173.233 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -68.01 -3.71 31.11 Favored Glycine 0 CA--C 1.523 0.592 0 O-C-N 121.39 -0.819 . . . . 0.4 111.715 172.707 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 1.8 ttt180 -129.87 6.11 5.05 Favored 'General case' 0 N--CA 1.451 -0.402 0 CA-C-N 118.574 1.187 . . . . 2.18 112.231 -174.994 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 58.2 p -75.05 -132.03 0.01 OUTLIER 'General case' 0 CA--C 1.536 0.41 0 N-CA-C 108.123 -1.066 . . . . 0.89 108.123 169.59 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 1.5 m-20 -73.05 155.94 39.26 Favored 'General case' 0 CA--C 1.527 0.079 0 O-C-N 120.283 -1.511 . . . . 1.58 108.447 176.238 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 35.8 tt0 -62.09 -33.48 74.51 Favored 'General case' 0 CA--C 1.534 0.345 0 C-N-CA 119.512 -0.875 . . . . 2.56 110.463 178.531 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 64' ' ' ALA . . . . . 0.463 ' HB1' ' CE1' ' A' ' 20' ' ' HIS . . . -60.82 -21.08 62.79 Favored 'General case' 0 C--N 1.331 -0.236 0 O-C-N 121.117 -0.989 . . . . 0.64 113.596 176.9 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 4.9 mt-10 -85.49 -49.57 7.97 Favored 'General case' 0 CA--C 1.509 -0.615 0 O-C-N 121.331 -0.856 . . . . 1.9 110.919 171.254 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 49.8 t80 -41.11 -49.85 3.45 Favored 'General case' 0 CA--C 1.535 0.376 0 C-N-CA 123.874 0.87 . . . . 0.31 111.666 171.869 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 77.9 t80 -62.59 -47.54 83.36 Favored 'General case' 0 CA--C 1.533 0.3 0 C-N-CA 123.509 0.724 . . . . 0.38 111.314 175.674 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -59.93 -53.46 57.61 Favored 'General case' 0 CA--C 1.535 0.386 0 C-N-CA 124.15 0.98 . . . . 0.28 112.264 -175.672 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 8.0 pt-20 -66.06 -31.07 71.73 Favored 'General case' 0 N--CA 1.451 -0.412 0 O-C-N 120.575 -1.328 . . . . 3.24 112.079 173.527 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -59.33 -40.57 86.74 Favored 'General case' 0 N--CA 1.451 -0.391 0 CA-C-N 119.749 1.159 . . . . 0.35 109.122 174.452 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 23.1 t80 -58.6 -51.4 70.08 Favored 'General case' 0 C--O 1.23 0.055 0 C-N-CA 124.546 1.138 . . . . 2.31 110.92 175.002 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 26.0 ttt180 -46.39 -66.87 0.34 Allowed 'General case' 0 N--CA 1.464 0.247 0 C-N-CA 123.4 0.68 . . . . 1.88 109.548 175.147 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 73' ' ' LEU . . . . . 0.515 ' HB3' HG21 ' A' ' 85' ' ' VAL . 0.1 OUTLIER -55.89 -35.77 66.9 Favored 'General case' 0 N--CA 1.45 -0.458 0 C-N-CA 126.19 1.796 . . . . 0.41 109.491 -173.271 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 2.1 ttp -59.64 -37.96 80.09 Favored 'General case' 0 C--O 1.234 0.242 0 N-CA-C 112.283 0.475 . . . . 2.4 112.283 -176.489 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 11.0 p80 -100.01 2.14 43.16 Favored 'General case' 0 CA--C 1.53 0.208 0 N-CA-C 114.459 1.281 . . . . 1.05 114.459 -177.566 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 70.3 m -49.51 128.51 17.56 Favored 'General case' 0 N--CA 1.448 -0.54 0 CA-C-N 120.43 1.468 . . . . 1.11 112.797 -168.518 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 4.1 p -50.96 -45.51 60.79 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 112.97 -1.923 . . . . 0.98 108.88 172.9 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 22.5 t0 -69.22 99.02 1.09 Allowed 'General case' 0 N--CA 1.449 -0.493 0 N-CA-C 107.241 -1.392 . . . . 2.22 107.241 162.951 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 36.8 p-80 -62.86 -30.18 71.31 Favored 'General case' 0 N--CA 1.45 -0.444 0 CA-C-N 115.342 -0.845 . . . . 3.81 112.241 -178.346 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -59.32 -39.42 83.04 Favored 'General case' 0 C--N 1.326 -0.453 0 O-C-N 121.83 -0.543 . . . . 0.69 110.189 174.402 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 2.6 tt0 -52.91 -35.92 58.83 Favored 'General case' 0 N--CA 1.466 0.326 0 CA-C-O 121.643 0.735 . . . . 2.99 110.483 176.817 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 18.6 mtp180 -67.57 -48.19 67.59 Favored 'General case' 0 CA--C 1.519 -0.248 0 N-CA-C 109.262 -0.644 . . . . 2.28 109.262 179.561 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 1.5 mm? -62.89 -23.82 67.52 Favored 'General case' 0 N--CA 1.452 -0.338 0 CA-C-O 117.702 -1.142 . . . . 0.5 112.31 177.848 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 2.5 mptm? -62.09 -44.43 96.68 Favored 'General case' 0 C--O 1.225 -0.234 0 CA-C-N 120.822 1.646 . . . . 1.19 108.349 170.282 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 85' ' ' VAL . . . . . 0.515 HG21 ' HB3' ' A' ' 73' ' ' LEU . 96.7 t -61.29 -57.94 9.84 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.486 0 CA-C-O 117.467 -1.254 . . . . 0.36 110.962 176.107 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 57.0 mt-30 -55.51 -49.24 73.11 Favored 'General case' 0 N--CA 1.466 0.36 0 CA-C-N 121.603 2.001 . . . . 2.37 111.7 -176.355 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 76.6 tttt -53.92 -49.69 68.08 Favored 'General case' 0 N--CA 1.446 -0.645 0 C-N-CA 123.74 0.816 . . . . 1.95 110.92 179.963 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 3.0 m-20 -83.54 -9.0 59.23 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 118.918 -0.563 . . . . 1.04 111.727 -175.327 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -160.87 73.95 2.7 Favored Pre-proline 0 C--O 1.238 0.466 0 C-N-CA 124.991 1.317 . . . . 0.31 109.669 -170.628 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 84.9 Cg_endo -77.08 22.48 0.56 Allowed 'Trans proline' 0 CA--C 1.537 0.647 0 C-N-CA 123.521 2.814 . . . . 1.44 112.707 -173.41 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 4.7 ptmt -141.61 -43.15 0.36 Allowed 'General case' 0 N--CA 1.451 -0.423 0 C-N-CA 125.799 1.64 . . . . 2.59 109.397 -175.829 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 4.4 m -57.61 -46.09 84.52 Favored 'General case' 0 CA--C 1.517 -0.306 0 CA-C-N 119.924 1.238 . . . . 0.33 111.265 172.247 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 22.5 t80 -56.85 -49.25 76.04 Favored 'General case' 0 CA--C 1.505 -0.78 0 C-N-CA 119.835 -0.746 . . . . 1.79 109.55 177.432 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 55.3 tt0 -58.76 -28.59 66.05 Favored 'General case' 0 N--CA 1.439 -1.0 0 CA-C-N 114.9 -1.045 . . . . 1.4 110.844 178.721 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 18.4 t80 -67.13 -53.31 31.81 Favored 'General case' 0 N--CA 1.454 -0.231 0 CA-C-N 119.367 0.985 . . . . 0.96 109.615 -178.812 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 2.0 mp -63.99 -30.27 49.56 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.246 0 N-CA-C 108.315 -0.994 . . . . 0.8 108.315 177.284 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -73.73 -25.17 60.06 Favored 'General case' 0 CA--C 1.538 0.509 0 O-C-N 121.735 -0.603 . . . . 1.52 111.196 179.642 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 34.2 t0 -69.29 -49.92 51.51 Favored 'General case' 0 CA--C 1.507 -0.674 0 N-CA-C 106.335 -1.728 . . . . 2.76 106.335 172.45 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 87.2 mm-40 -80.57 31.03 0.29 Allowed 'General case' 0 N--CA 1.435 -1.192 0 CA-C-N 113.895 -1.502 . . . . 2.38 111.021 172.923 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 4.7 tp -60.69 109.95 0.53 Allowed 'Isoleucine or valine' 0 CA--C 1.514 -0.43 0 N-CA-C 105.365 -2.087 . . . . 4.17 105.365 165.484 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 101' ' ' LYS . . . . . 0.722 ' HE2' ' HA ' ' A' ' 101' ' ' LYS 0.314 0.0 OUTLIER -142.77 -151.67 0.37 Allowed 'General case' 0 N--CA 1.442 -0.831 0 C-N-CA 117.558 -1.657 . . . . 7.68 112.03 177.719 . . . . . . . . 4 4 . 1 . 001 nuclear build full ' A' A ' 102' ' ' PHE . . . . . . . . . . . . . 2.6 t80 -156.22 35.57 0.33 Allowed 'General case' 0 N--CA 1.446 -0.647 0 N-CA-C 106.755 -1.572 . . . . 6.33 106.755 -143.565 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 3.6 tp -71.23 114.71 9.92 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.66 0 N-CA-C 106.727 -1.583 . . . . 3.35 106.727 177.124 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 104' ' ' ILE . . . . . 0.574 ' HA ' ' HB2' ' A' ' 105' ' ' ASN 0.265 0.9 OUTLIER 70.31 172.22 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.55 0.953 0 O-C-N 124.117 0.886 . . . . 6.04 109.691 167.705 . . . . . . . . 4 4 . 1 . 001 nuclear build full ' A' A ' 105' ' ' ASN . . . . . 0.574 ' HB2' ' HA ' ' A' ' 104' ' ' ILE 0.314 16.0 m120 101.35 105.85 0.01 OUTLIER 'General case' 0 N--CA 1.469 0.522 2 C-N-CA 137.631 6.373 . . . . 6.7 112.707 -13.268 . . . . . . . . 4 3 . 1 . 001 nuclear build full ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 13.1 t . . . . . 0 C--O 1.247 0.956 0 C-N-CA 131.581 3.952 . . . . 7.88 112.005 14.592 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.471 0.989 0 N-CA-C 109.302 -1.519 . . . . 23.86 109.302 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -176.04 -85.48 0.0 OUTLIER 'General case' 0 C--O 1.226 -0.173 0 N-CA-C 107.919 -1.141 . . . . 24.83 107.919 173.974 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 6.6 ptpp? -163.9 170.66 16.45 Favored 'General case' 0 N--CA 1.455 -0.215 0 N-CA-C 108.194 -1.039 . . . . 28.0 108.194 -176.897 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 102.21 140.51 11.1 Favored Glycine 0 C--N 1.332 0.321 0 N-CA-C 108.63 -1.788 . . . . 19.7 108.63 -173.473 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 33.1 m -104.87 -162.35 0.14 Allowed 'Isoleucine or valine' 0 N--CA 1.442 -0.835 0 N-CA-C 108.271 -1.011 . . . . 18.15 108.271 175.553 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 1.3 pp20? -79.77 129.11 34.2 Favored 'General case' 0 N--CA 1.448 -0.531 0 N-CA-C 108.835 -0.802 . . . . 12.1 108.835 170.923 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 7' ' ' LEU . . . . . 0.462 HD22 ' N ' ' A' ' 7' ' ' LEU . 0.0 OUTLIER -160.61 36.14 0.16 Allowed 'General case' 0 N--CA 1.446 -0.667 0 C-N-CA 124.756 1.222 . . . . 10.97 109.087 173.191 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 3.3 mmm180 -143.19 98.24 3.23 Favored 'General case' 0 N--CA 1.453 -0.301 0 C-N-CA 123.563 0.745 . . . . 9.77 109.156 -175.013 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 2.4 m120 -52.21 -33.51 41.38 Favored 'General case' 0 CA--C 1.516 -0.343 0 N-CA-C 112.47 0.545 . . . . 2.8 112.47 173.482 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 4.8 t70 -58.85 -54.69 44.23 Favored 'General case' 0 N--CA 1.448 -0.532 0 C-N-CA 123.21 0.604 . . . . 2.42 110.81 176.406 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 15.1 m -69.32 -48.02 62.74 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 121.899 0.857 . . . . 1.57 110.794 -175.944 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 12' ' ' GLU . . . . . 0.431 ' OE2' ' HD3' ' A' ' 72' ' ' ARG . 20.9 tp10 -67.01 -30.67 70.84 Favored 'General case' 0 CA--C 1.534 0.359 0 C-N-CA 126.387 1.875 . . . . 4.96 109.751 -176.359 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -71.59 -43.0 53.75 Favored Glycine 0 N--CA 1.448 -0.557 0 N-CA-C 110.322 -1.111 . . . . 0.72 110.322 170.314 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -55.45 -52.85 62.27 Favored 'General case' 0 C--O 1.227 -0.127 0 CA-C-N 118.369 1.084 . . . . 3.46 110.297 -174.941 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER -63.58 -36.01 74.79 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.488 0 N-CA-C 112.838 0.681 . . . . 0.5 112.838 177.664 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 2.5 t60 -57.23 -57.34 13.04 Favored 'General case' 0 C--N 1.341 0.235 0 N-CA-C 107.115 -1.439 . . . . 0.49 107.115 177.659 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 38.7 mt-10 -59.67 -40.37 87.55 Favored 'General case' 0 N--CA 1.452 -0.362 0 C-N-CA 123.712 0.805 . . . . 2.17 110.479 -178.248 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -53.15 -48.74 67.7 Favored 'General case' 0 CA--C 1.518 -0.26 0 CA-C-N 118.849 0.749 . . . . 3.36 110.319 175.842 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -48.72 -47.09 30.89 Favored Glycine 0 CA--C 1.525 0.7 0 N-CA-C 110.715 -0.954 . . . . 0.51 110.715 174.913 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 20' ' ' HIS . . . . . 0.53 ' CE1' ' HB1' ' A' ' 64' ' ' ALA . 2.3 t-160 -65.05 -44.5 88.84 Favored 'General case' 0 C--O 1.224 -0.282 0 O-C-N 122.149 -0.618 . . . . 1.83 111.682 179.493 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -61.72 -32.76 73.0 Favored 'General case' 0 N--CA 1.453 -0.302 0 O-C-N 120.915 -1.116 . . . . 0.97 109.933 -179.385 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 78.8 t -71.91 -36.35 57.59 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.306 0 O-C-N 121.519 -0.738 . . . . 1.31 109.292 176.267 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 8.9 t0 -57.52 -27.21 62.38 Favored 'General case' 0 N--CA 1.453 -0.288 0 C-N-CA 123.491 0.717 . . . . 2.03 111.401 173.793 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 14.7 t70 -71.74 -55.78 7.02 Favored 'General case' 0 N--CA 1.451 -0.423 0 N-CA-C 109.053 -0.721 . . . . 1.98 109.053 -178.127 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 60.7 t80 -64.39 -54.78 27.35 Favored 'General case' 0 CA--C 1.518 -0.262 0 CA-C-N 115.957 -0.565 . . . . 2.4 109.5 -176.896 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -55.06 -33.8 63.03 Favored 'General case' 0 N--CA 1.448 -0.564 0 CA-C-O 118.59 -0.719 . . . . 1.69 111.222 176.507 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -68.31 -38.54 87.5 Favored Glycine 0 CA--C 1.522 0.531 0 CA-C-N 119.59 1.086 . . . . 1.46 111.485 178.314 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -69.83 -45.79 67.06 Favored 'General case' 0 N--CA 1.453 -0.279 0 O-C-N 122.338 -0.507 . . . . 3.21 110.185 -177.795 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -79.84 -32.18 40.53 Favored 'General case' 0 N--CA 1.451 -0.381 0 C-N-CA 124.772 1.229 . . . . 1.64 112.986 -175.82 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 12.8 mt -127.27 103.36 7.36 Favored 'General case' 0 N--CA 1.451 -0.423 0 N-CA-C 107.243 -1.392 . . . . 2.86 107.243 -169.06 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -126.13 153.1 45.04 Favored 'General case' 0 N--CA 1.454 -0.238 0 N-CA-C 109.219 -0.66 . . . . 5.33 109.219 -176.167 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -164.99 98.12 0.74 Allowed 'General case' 0 N--CA 1.452 -0.375 0 N-CA-C 108.524 -0.917 . . . . 9.45 108.524 173.349 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 6.9 t-20 62.39 135.27 0.01 OUTLIER 'General case' 0 C--O 1.222 -0.376 0 C-N-CA 128.567 2.747 . . . . 10.75 111.299 -171.357 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 13.6 tt0 47.0 60.91 3.12 Favored 'General case' 0 CA--C 1.532 0.278 0 C-N-CA 124.338 1.055 . . . . 11.01 110.124 -179.564 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 22.2 p -57.9 84.95 0.01 OUTLIER 'General case' 0 N--CA 1.454 -0.232 0 C-N-CA 126.639 1.976 . . . . 7.04 112.284 -170.258 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -156.0 106.47 2.43 Favored 'General case' 0 N--CA 1.449 -0.502 0 N-CA-C 106.691 -1.596 . . . . 5.35 106.691 -179.333 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 5.4 mp 66.88 150.94 0.06 Allowed 'General case' 0 CA--C 1.539 0.52 0 C-N-CA 125.377 1.471 . . . . 2.35 112.166 177.844 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 7.8 p -87.27 35.94 0.06 OUTLIER 'Isoleucine or valine' 0 CA--C 1.538 0.489 0 O-C-N 119.674 -1.891 . . . . 3.54 110.855 -179.448 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 5.0 t -112.14 -41.01 4.04 Favored 'General case' 0 C--O 1.23 0.064 0 O-C-N 121.153 -0.967 . . . . 4.1 109.901 175.651 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 9.5 m120 -74.36 68.94 1.58 Allowed 'General case' 0 CA--C 1.531 0.218 0 C-N-CA 123.628 0.771 . . . . 6.0 110.436 -177.419 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -163.29 70.49 0.24 Allowed 'General case' 0 N--CA 1.451 -0.408 0 O-C-N 120.771 -1.206 . . . . 3.45 108.966 -178.31 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -151.61 68.05 0.9 Allowed 'General case' 0 CA--C 1.521 -0.17 0 O-C-N 121.05 -1.031 . . . . 9.11 108.754 174.843 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER 68.18 -75.05 0.07 Allowed 'General case' 0 C--O 1.225 -0.226 0 C-N-CA 125.244 1.418 . . . . 6.88 110.218 -174.889 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 23.7 p90 -156.4 87.72 1.05 Allowed 'General case' 0 C--O 1.222 -0.343 0 CA-C-N 119.43 1.014 . . . . 9.23 108.521 172.107 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 27.9 pt 37.93 57.78 0.19 Allowed 'Isoleucine or valine' 0 N--CA 1.47 0.54 0 C-N-CA 124.422 1.089 . . . . 2.48 112.107 177.524 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 4.9 t0 -86.23 -56.76 3.3 Favored 'General case' 0 C--N 1.33 -0.248 0 C-N-CA 124.591 1.156 . . . . 2.39 109.935 -173.044 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 7.6 mm -48.92 -57.83 1.47 Allowed 'Isoleucine or valine' 0 CA--C 1.531 0.216 0 C-N-CA 125.897 1.679 . . . . 0.43 110.079 179.499 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 21.6 t80 -60.0 -29.76 68.69 Favored 'General case' 0 N--CA 1.451 -0.41 0 C-N-CA 124.038 0.935 . . . . 0.45 111.962 179.82 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 49' ' ' LYS . . . . . 0.402 ' HA ' ' HE2' ' A' ' 49' ' ' LYS . 0.1 OUTLIER -69.14 -45.09 70.98 Favored 'General case' 0 N--CA 1.453 -0.315 0 O-C-N 120.289 -1.507 . . . . 1.22 110.956 -175.597 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 3.9 tp10 -86.84 -60.62 1.93 Allowed 'General case' 0 CA--C 1.532 0.266 0 CA-C-O 122.253 1.025 . . . . 2.4 109.349 -178.088 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 22.1 mm-40 -72.6 -28.79 62.99 Favored 'General case' 0 C--O 1.235 0.313 0 O-C-N 121.519 -0.738 . . . . 2.55 110.358 -171.348 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -70.89 39.92 0.53 Allowed Glycine 0 CA--C 1.534 1.234 0 C-N-CA 124.838 1.209 . . . . 0.37 113.743 169.829 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 24.3 m -151.82 36.47 0.56 Allowed 'General case' 0 CA--C 1.529 0.161 0 C-N-CA 125.638 1.575 . . . . 1.89 108.746 159.779 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 1.3 m-80 -141.65 -47.25 0.37 Allowed 'General case' 0 CA--C 1.515 -0.381 0 O-C-N 122.052 -0.405 . . . . 1.86 112.074 -172.893 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 55' ' ' LEU . . . . . 0.544 HD22 HG22 ' A' ' 85' ' ' VAL . 23.7 mt -63.81 -34.04 77.03 Favored 'General case' 0 C--N 1.332 -0.156 0 C-N-CA 120.294 -0.562 . . . . 0.52 111.227 -172.201 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER 177.82 169.43 0.7 Allowed 'General case' 0 C--N 1.331 -0.208 0 C-N-CA 124.937 1.295 . . . . 0.81 107.775 -173.575 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 39.4 m -61.56 -36.8 81.66 Favored 'General case' 0 N--CA 1.456 -0.146 0 O-C-N 121.81 -0.556 . . . . 0.9 110.677 168.767 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 4.7 m-85 -67.36 -7.58 25.98 Favored 'General case' 0 N--CA 1.465 0.316 0 CA-C-N 118.359 0.527 . . . . 1.61 112.164 172.87 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -82.59 -8.82 85.59 Favored Glycine 0 N--CA 1.441 -1.024 0 CA-C-O 118.024 -1.431 . . . . 0.43 110.934 173.569 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 4.8 ttt-85 -116.39 -9.15 11.54 Favored 'General case' 0 CA--C 1.529 0.166 0 CA-C-N 119.897 1.849 . . . . 2.83 112.283 -177.3 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 22.3 p -72.35 -136.51 0.01 OUTLIER 'General case' 0 CA--C 1.536 0.437 0 C-N-CA 123.366 0.666 . . . . 0.92 109.376 177.601 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -65.87 146.47 54.7 Favored 'General case' 0 N--CA 1.454 -0.264 0 O-C-N 119.784 -1.822 . . . . 1.6 108.187 178.182 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 61.6 tt0 -55.7 -34.28 64.94 Favored 'General case' 0 CA--C 1.533 0.301 0 CA-C-O 121.651 0.739 . . . . 2.92 110.564 178.21 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 64' ' ' ALA . . . . . 0.53 ' HB1' ' CE1' ' A' ' 20' ' ' HIS . . . -59.44 -36.76 76.53 Favored 'General case' 0 N--CA 1.452 -0.36 0 C-N-CA 123.334 0.654 . . . . 0.43 112.523 176.45 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 9.1 mt-10 -72.27 -43.53 64.16 Favored 'General case' 0 N--CA 1.455 -0.224 0 O-C-N 121.402 -0.811 . . . . 2.45 109.989 177.461 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 43.6 t80 -50.58 -50.91 52.5 Favored 'General case' 0 N--CA 1.454 -0.257 0 C-N-CA 124.089 0.955 . . . . 0.3 111.086 173.543 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 63.2 t80 -61.56 -46.78 88.43 Favored 'General case' 0 N--CA 1.454 -0.249 0 C-N-CA 123.308 0.643 . . . . 0.52 110.521 178.3 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -59.42 -48.45 81.61 Favored 'General case' 0 CA--C 1.536 0.418 0 O-C-N 121.615 -0.678 . . . . 0.29 111.36 -176.646 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 5.6 mm-40 -58.23 -45.35 87.85 Favored 'General case' 0 CA--C 1.52 -0.191 0 C-N-CA 123.324 0.65 . . . . 4.03 110.406 172.737 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -56.21 -39.66 72.83 Favored 'General case' 0 N--CA 1.453 -0.281 0 CA-C-N 118.927 0.785 . . . . 0.43 109.97 -179.555 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 1.4 t80 -60.58 -48.79 80.22 Favored 'General case' 0 CA--C 1.531 0.246 0 C-N-CA 124.475 1.11 . . . . 2.79 110.716 174.187 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 72' ' ' ARG . . . . . 0.431 ' HD3' ' OE2' ' A' ' 12' ' ' GLU . 3.3 tmm_? -51.98 -54.51 28.87 Favored 'General case' 0 CA--C 1.535 0.388 0 C-N-CA 124.669 1.188 . . . . 2.4 110.595 178.042 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 73' ' ' LEU . . . . . 0.663 HD12 HG23 ' A' ' 85' ' ' VAL . 0.1 OUTLIER -62.77 -33.83 75.99 Favored 'General case' 0 C--N 1.326 -0.431 0 C-N-CA 126.463 1.905 . . . . 0.48 110.665 179.659 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -53.37 -45.94 69.43 Favored 'General case' 0 C--N 1.331 -0.217 0 C-N-CA 123.556 0.742 . . . . 2.45 111.888 -175.671 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 12.6 p-80 -96.97 -19.03 19.07 Favored 'General case' 0 C--O 1.225 -0.201 0 CA-C-O 116.341 -1.79 . . . . 1.95 114.481 -179.778 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 10.0 m -18.9 117.42 0.02 OUTLIER 'General case' 0 C--N 1.345 0.376 0 C-N-CA 126.962 2.105 . . . . 1.17 113.237 -176.856 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 1.8 p -45.46 -44.32 12.19 Favored 'General case' 0 N--CA 1.45 -0.467 0 C-N-CA 126.097 1.759 . . . . 1.32 110.06 -178.808 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 59.1 t0 -75.68 107.46 7.86 Favored 'General case' 0 N--CA 1.451 -0.376 0 C-N-CA 118.097 -1.441 . . . . 1.91 109.161 169.182 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 3.4 p-80 -41.31 -36.97 0.89 Allowed 'General case' 0 CA--C 1.531 0.244 0 C-N-CA 124.202 1.001 . . . . 4.47 112.821 170.493 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -58.24 -45.88 86.95 Favored 'General case' 0 N--CA 1.45 -0.468 0 C-N-CA 122.841 0.456 . . . . 0.64 110.985 -178.822 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 9.2 mt-10 -59.49 -35.28 73.83 Favored 'General case' 0 N--CA 1.455 -0.219 0 CA-C-N 118.396 0.544 . . . . 2.52 110.921 -179.532 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 5.6 mtp180 -64.57 -50.52 66.94 Favored 'General case' 0 C--N 1.328 -0.346 0 N-CA-C 108.651 -0.87 . . . . 2.81 108.651 178.575 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 83' ' ' LEU . . . . . 0.408 HD13 ' HA ' ' A' ' 83' ' ' LEU . 1.4 mm? -62.05 -25.11 67.49 Favored 'General case' 0 N--CA 1.449 -0.485 0 CA-C-O 118.113 -0.946 . . . . 0.54 111.836 174.715 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 21.5 mmtp -68.26 -39.44 82.21 Favored 'General case' 0 CA--C 1.514 -0.416 0 CA-C-N 121.071 1.759 . . . . 2.8 109.221 176.528 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 85' ' ' VAL . . . . . 0.663 HG23 HD12 ' A' ' 73' ' ' LEU . 72.0 t -61.41 -65.97 0.45 Allowed 'Isoleucine or valine' 0 C--O 1.218 -0.57 0 CA-C-O 117.39 -1.29 . . . . 0.53 109.656 168.616 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 2.0 mt-30 -48.03 -45.64 32.31 Favored 'General case' 0 N--CA 1.469 0.494 0 CA-C-N 121.281 1.855 . . . . 2.15 112.531 -173.906 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 11.4 tttt -60.67 -59.58 5.17 Favored 'General case' 0 N--CA 1.45 -0.459 0 C-N-CA 125.111 1.365 . . . . 3.39 110.428 177.812 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 64.8 m-20 -84.85 14.56 4.68 Favored 'General case' 0 CA--C 1.532 0.287 0 CA-C-O 118.791 -0.623 . . . . 1.25 110.951 -175.559 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 89' ' ' ALA . . . . . 0.474 ' HB2' HD21 ' A' ' 55' ' ' LEU . . . -170.1 71.45 0.62 Allowed Pre-proline 0 N--CA 1.448 -0.552 0 C-N-CA 126.011 1.725 . . . . 0.34 109.024 -178.473 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 94.2 Cg_endo -81.56 52.51 4.29 Favored 'Trans proline' 0 N--CA 1.459 -0.541 0 C-N-CA 124.001 3.134 . . . . 1.82 110.721 -175.756 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -170.47 -44.81 0.02 OUTLIER 'General case' 0 CA--C 1.534 0.365 0 C-N-CA 126.55 1.94 . . . . 3.2 109.376 174.646 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 5.6 m -52.17 -47.91 65.26 Favored 'General case' 0 N--CA 1.467 0.406 0 CA-C-N 119.082 0.856 . . . . 0.38 111.862 177.951 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 13.0 t80 -57.69 -47.6 81.89 Favored 'General case' 0 CA--C 1.513 -0.462 0 O-C-N 121.684 -0.635 . . . . 1.89 110.643 177.451 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 2.3 tt0 -57.55 -29.01 64.05 Favored 'General case' 0 N--CA 1.443 -0.794 0 CA-C-N 114.874 -1.057 . . . . 1.49 110.6 -178.512 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 1.9 t80 -60.83 -60.81 3.21 Favored 'General case' 0 N--CA 1.456 -0.14 0 C-N-CA 124.558 1.143 . . . . 1.08 110.078 -178.562 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 3.6 mp -58.88 -42.19 85.06 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.227 0 N-CA-C 108.501 -0.926 . . . . 0.94 108.501 178.07 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 1.1 m-20 -56.54 -40.02 74.39 Favored 'General case' 0 CA--C 1.534 0.35 0 CA-C-N 117.812 0.278 . . . . 1.68 111.577 -179.833 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -63.84 -49.78 71.48 Favored 'General case' 0 C--O 1.231 0.099 0 C-N-CA 125.416 1.486 . . . . 2.65 108.796 -178.5 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 23.0 mm100 -75.85 79.86 2.76 Favored 'General case' 0 N--CA 1.453 -0.304 0 N-CA-C 109.489 -0.56 . . . . 2.84 109.489 173.376 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 6.8 pt -48.41 113.52 0.22 Allowed 'Isoleucine or valine' 0 N--CA 1.453 -0.293 0 C-N-CA 123.084 0.554 . . . . 5.97 109.523 176.884 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 52.8 pttt -43.03 -46.54 5.61 Favored 'General case' 0 C--O 1.224 -0.258 0 C-N-CA 124.278 1.031 . . . . 10.43 111.978 -173.63 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 102' ' ' PHE . . . . . . . . . . . . . 24.6 t80 33.69 49.61 0.26 Allowed 'General case' 0 CA--C 1.532 0.277 0 C-N-CA 127.238 2.215 . . . . 6.83 112.367 173.492 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -134.34 129.94 53.64 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.693 0 N-CA-C 103.547 -2.76 . . . . 4.55 103.547 179.379 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 104' ' ' ILE . . . . . . . . . . . . . 15.2 tt -140.85 145.09 25.87 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.557 0 N-CA-C 105.878 -1.897 . . . . 8.34 105.878 -179.35 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 10.2 p-10 -147.63 171.62 15.32 Favored 'General case' 0 C--N 1.327 -0.389 0 N-CA-C 108.527 -0.916 . . . . 7.74 108.527 -171.378 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--O 1.248 0.975 0 N-CA-C 105.591 -2.003 . . . . 9.61 105.591 165.056 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 1' ' ' GLY . . . . . 0.47 ' HA3' ' OE1' ' A' ' 17' ' ' GLU . . . . . . . . 0 N--CA 1.471 1.026 0 N-CA-C 109.691 -1.364 . . . . 11.67 109.691 . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 8.1 t -59.54 178.35 0.16 Allowed 'General case' 0 CA--C 1.532 0.285 0 C-N-CA 124.583 1.153 . . . . 11.69 111.017 173.774 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -152.71 139.34 18.77 Favored 'General case' 0 N--CA 1.453 -0.284 0 N-CA-C 107.916 -1.142 . . . . 15.18 107.916 -178.18 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 155.98 -165.32 32.64 Favored Glycine 0 N--CA 1.451 -0.366 0 N-CA-C 108.592 -1.803 . . . . 11.04 108.592 -179.473 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 34.5 m -103.99 -161.81 0.13 Allowed 'Isoleucine or valine' 0 N--CA 1.44 -0.934 0 N-CA-C 106.98 -1.489 . . . . 11.59 106.98 159.727 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 8.3 pt-20 -79.18 119.13 21.84 Favored 'General case' 0 N--CA 1.448 -0.528 0 CA-C-O 122.016 0.912 . . . . 9.3 111.024 173.986 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -156.49 43.02 0.38 Allowed 'General case' 0 N--CA 1.449 -0.52 0 C-N-CA 124.299 1.04 . . . . 7.34 110.26 177.765 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 21.2 mmm180 73.77 -69.52 0.18 Allowed 'General case' 0 N--CA 1.467 0.402 0 C-N-CA 124.976 1.31 . . . . 8.57 109.868 -179.794 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 3.2 m120 -45.74 -37.37 5.85 Favored 'General case' 0 CA--C 1.517 -0.324 0 C-N-CA 125.541 1.537 . . . . 3.1 113.889 179.17 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 14.3 t70 -64.55 -51.14 64.35 Favored 'General case' 0 N--CA 1.448 -0.558 0 CA-C-N 117.67 0.214 . . . . 2.5 110.805 177.39 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 9.2 m -65.3 -51.45 60.6 Favored 'General case' 0 N--CA 1.454 -0.272 0 CA-C-O 121.805 0.812 . . . . 1.7 110.231 -175.807 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 12' ' ' GLU . . . . . 0.47 ' HA ' HD11 ' A' ' 15' ' ' ILE . 9.3 pt-20 -72.12 -26.64 62.2 Favored 'General case' 0 N--CA 1.451 -0.417 0 CA-C-N 115.773 -0.649 . . . . 3.01 110.538 -175.651 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -65.62 -47.67 75.02 Favored Glycine 0 CA--C 1.527 0.806 0 N-CA-C 110.742 -0.943 . . . . 0.9 110.742 169.335 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 17.3 t80 -60.98 -49.19 78.44 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 118.09 0.945 . . . . 3.01 109.779 -175.061 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 15' ' ' ILE . . . . . 0.47 HD11 ' HA ' ' A' ' 12' ' ' GLU . 1.7 pt -67.86 -32.19 55.4 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.208 0 O-C-N 121.269 -0.894 . . . . 0.61 112.833 175.624 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 16' ' ' HIS . . . . . 0.422 ' CD2' ' HG3' ' A' ' 69' ' ' GLU . 1.6 t-80 -57.18 -54.36 47.65 Favored 'General case' 0 C--N 1.341 0.206 0 N-CA-C 106.693 -1.595 . . . . 0.55 106.693 175.752 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 17' ' ' GLU . . . . . 0.47 ' OE1' ' HA3' ' A' ' 1' ' ' GLY . 33.3 mt-10 -52.2 -47.64 65.48 Favored 'General case' 0 N--CA 1.454 -0.27 0 C-N-CA 125.278 1.431 . . . . 2.6 109.766 -179.555 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -52.8 -50.84 62.8 Favored 'General case' 0 C--O 1.227 -0.107 0 C-N-CA 123.344 0.658 . . . . 3.29 111.558 174.824 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -49.13 -46.17 33.9 Favored Glycine 0 CA--C 1.526 0.732 0 N-CA-C 110.632 -0.987 . . . . 0.43 110.632 176.676 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 2.0 t-160 -62.59 -46.47 88.13 Favored 'General case' 0 N--CA 1.45 -0.45 0 O-C-N 122.061 -0.67 . . . . 1.83 111.028 178.316 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -61.25 -28.97 69.55 Favored 'General case' 0 N--CA 1.455 -0.224 0 C-N-CA 123.376 0.67 . . . . 0.66 110.856 -178.636 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 80.4 t -65.92 -41.26 89.57 Favored 'Isoleucine or valine' 0 C--O 1.234 0.264 0 O-C-N 121.037 -1.039 . . . . 0.74 110.069 176.61 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -65.81 -20.73 66.36 Favored 'General case' 0 N--CA 1.453 -0.302 0 CA-C-N 116.715 -0.221 . . . . 2.47 111.591 178.232 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 13.0 t70 -73.04 -52.26 15.04 Favored 'General case' 0 N--CA 1.454 -0.235 0 CA-C-O 122.086 0.946 . . . . 2.36 108.483 -175.868 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 61.9 t80 -57.34 -45.41 84.32 Favored 'General case' 0 N--CA 1.455 -0.223 0 CA-C-N 115.581 -0.736 . . . . 2.4 109.763 175.297 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -59.65 -30.16 68.55 Favored 'General case' 0 CA--C 1.535 0.373 0 O-C-N 121.654 -0.654 . . . . 1.13 112.199 176.416 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -74.46 -21.86 78.22 Favored Glycine 0 CA--C 1.524 0.611 0 CA-C-N 119.231 0.923 . . . . 1.51 112.575 179.964 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 1.1 t80 -88.67 -46.4 9.06 Favored 'General case' 0 N--CA 1.456 -0.168 0 CA-C-N 117.569 0.684 . . . . 2.25 110.146 178.34 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -75.73 -35.56 60.2 Favored 'General case' 0 CA--C 1.514 -0.424 0 C-N-CA 124.224 1.009 . . . . 1.74 112.546 -176.369 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 9.1 mt -113.97 -163.01 0.84 Allowed 'General case' 0 N--CA 1.448 -0.574 0 N-CA-C 105.987 -1.857 . . . . 2.81 105.987 -176.874 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 15.6 t0 48.23 74.68 0.16 Allowed 'General case' 0 CA--C 1.539 0.546 0 CA-C-O 122.641 1.21 . . . . 4.42 114.2 169.688 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -72.59 -39.06 67.64 Favored 'General case' 0 N--CA 1.465 0.275 0 O-C-N 120.508 -1.37 . . . . 8.55 112.826 -166.979 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 50.4 t30 -86.61 134.56 33.62 Favored 'General case' 0 C--O 1.224 -0.26 0 N-CA-C 106.895 -1.521 . . . . 6.95 106.895 179.328 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 34.3 tp60 49.7 50.89 17.52 Favored 'General case' 0 CA--C 1.539 0.552 0 C-N-CA 123.034 0.533 . . . . 7.24 110.452 -170.597 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 49.1 m -54.93 102.47 0.07 Allowed 'General case' 0 C--N 1.342 0.273 0 CA-C-N 118.182 0.447 . . . . 8.88 110.075 174.675 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 39.8 t0 -145.72 -77.27 0.2 Allowed 'General case' 0 N--CA 1.452 -0.366 0 N-CA-C 107.1 -1.444 . . . . 5.2 107.1 -172.739 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 4.5 mp -142.51 140.56 31.88 Favored 'General case' 0 C--N 1.339 0.132 0 N-CA-C 107.233 -1.395 . . . . 1.8 107.233 171.194 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 9.6 p -62.31 -12.55 8.72 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.54 0 N-CA-C 112.759 0.651 . . . . 2.38 112.759 -170.892 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 8.1 t -47.21 -36.38 8.74 Favored 'General case' 0 N--CA 1.454 -0.244 0 C-N-CA 125.629 1.572 . . . . 2.89 113.496 179.992 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 37.1 t-20 -88.9 50.49 1.97 Allowed 'General case' 0 CA--C 1.531 0.234 0 CA-C-N 119.784 1.175 . . . . 6.78 110.895 -168.812 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 13.8 t -166.02 -140.25 0.04 OUTLIER 'General case' 0 CA--C 1.536 0.419 0 O-C-N 121.526 -0.734 . . . . 3.11 109.28 -171.01 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 17.88 93.5 0.01 OUTLIER 'General case' 0 N--CA 1.47 0.539 0 C-N-CA 129.088 2.955 . . . . 5.87 114.126 172.549 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 3.7 tttp 100.44 -47.56 0.0 OUTLIER 'General case' 0 N--CA 1.464 0.268 0 C-N-CA 128.066 2.546 . . . . 8.24 107.25 177.143 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 19.7 t80 91.32 98.61 0.02 OUTLIER 'General case' 0 CA--C 1.528 0.115 0 C-N-CA 127.175 2.19 . . . . 4.71 108.864 169.267 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 32.8 pt 43.27 -126.4 0.03 OUTLIER 'Isoleucine or valine' 0 CA--C 1.542 0.645 0 C-N-CA 125.048 1.339 . . . . 4.11 111.796 -173.846 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 26.6 t70 69.06 -72.84 0.1 Allowed 'General case' 0 N--CA 1.468 0.456 0 C-N-CA 127.101 2.161 . . . . 2.63 112.047 174.945 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 8.1 mm -48.34 -53.17 6.67 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.392 0 C-N-CA 126.732 2.013 . . . . 0.85 109.421 175.179 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 32.3 t80 -64.42 -34.24 77.74 Favored 'General case' 0 C--O 1.224 -0.256 0 O-C-N 121.93 -0.481 . . . . 0.45 112.15 176.069 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 49' ' ' LYS . . . . . 0.457 ' HA ' ' HE2' ' A' ' 49' ' ' LYS . 10.3 mmpt? -63.11 -46.45 87.26 Favored 'General case' 0 N--CA 1.453 -0.288 0 O-C-N 120.94 -1.1 . . . . 1.04 110.784 -176.285 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 1.2 mm-40 -81.07 -67.12 0.81 Allowed 'General case' 0 N--CA 1.451 -0.378 0 CA-C-O 122.379 1.085 . . . . 2.9 109.717 179.012 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 51' ' ' GLU . . . . . 0.428 ' OE2' ' HE3' ' A' ' 91' ' ' LYS . 45.1 mm-40 -75.98 -22.79 55.51 Favored 'General case' 0 N--CA 1.451 -0.389 0 CA-C-N 115.589 -0.732 . . . . 3.39 110.952 -165.442 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 52' ' ' GLY . . . . . 0.407 ' HA2' ' CD1' ' A' ' 66' ' ' PHE . . . -71.99 35.45 0.63 Allowed Glycine 0 CA--C 1.531 1.065 0 C-N-CA 123.784 0.707 . . . . 0.43 113.284 168.008 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 30.0 t -152.1 36.27 0.54 Allowed 'General case' 0 N--CA 1.448 -0.551 0 O-C-N 120.899 -1.354 . . . . 2.15 108.269 156.794 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 4.6 t-20 -134.88 -50.52 0.77 Allowed 'General case' 0 CA--C 1.519 -0.217 0 C-N-CA 122.67 0.388 . . . . 1.76 110.837 -168.545 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 55' ' ' LEU . . . . . 0.431 HD22 HG22 ' A' ' 85' ' ' VAL . 16.0 mt -64.21 -35.03 79.46 Favored 'General case' 0 C--N 1.334 -0.091 0 CA-C-O 120.798 0.332 . . . . 0.51 111.266 -174.3 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER 178.2 165.94 0.76 Allowed 'General case' 0 CA--C 1.531 0.238 0 C-N-CA 124.845 1.258 . . . . 0.71 108.067 -174.81 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 9.0 m -59.11 -36.51 75.3 Favored 'General case' 0 N--CA 1.455 -0.204 0 C-N-CA 123.803 0.841 . . . . 0.92 110.881 170.557 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -59.78 -34.05 72.5 Favored 'General case' 0 C--O 1.223 -0.314 0 C-N-CA 123.825 0.85 . . . . 1.43 109.575 172.367 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -63.18 -11.55 39.81 Favored Glycine 0 C--O 1.223 -0.551 0 O-C-N 121.482 -0.761 . . . . 0.43 112.384 176.663 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 3.1 tmt_? -111.7 -3.79 14.9 Favored 'General case' 0 N--CA 1.452 -0.37 0 CA-C-N 118.515 1.158 . . . . 3.27 112.48 -176.857 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 56.3 p -72.27 -137.75 0.01 OUTLIER 'General case' 0 CA--C 1.538 0.481 0 N-CA-C 108.596 -0.89 . . . . 1.13 108.596 175.944 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 98.5 m-20 -69.76 149.84 47.55 Favored 'General case' 0 CA--C 1.528 0.119 0 O-C-N 119.717 -1.864 . . . . 1.58 108.73 178.199 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 45.0 tt0 -58.6 -27.76 64.96 Favored 'General case' 0 CA--C 1.538 0.516 0 CA-C-O 121.682 0.754 . . . . 3.1 111.222 -179.55 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -62.96 -36.61 84.02 Favored 'General case' 0 N--CA 1.452 -0.339 0 C-N-CA 124.163 0.985 . . . . 0.72 112.826 174.562 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 4.2 mt-10 -75.81 -48.47 21.51 Favored 'General case' 0 CA--C 1.511 -0.55 0 O-C-N 121.322 -0.861 . . . . 1.92 109.175 177.766 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 66' ' ' PHE . . . . . 0.407 ' CD1' ' HA2' ' A' ' 52' ' ' GLY . 41.2 t80 -40.23 -51.73 2.68 Favored 'General case' 0 CA--C 1.535 0.403 0 C-N-CA 123.969 0.908 . . . . 0.3 111.694 171.609 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 59.5 t80 -60.98 -42.99 99.42 Favored 'General case' 0 CA--C 1.538 0.483 0 C-N-CA 122.95 0.5 . . . . 0.48 111.828 175.989 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -60.76 -49.33 77.92 Favored 'General case' 0 CA--C 1.538 0.486 0 O-C-N 120.999 -1.063 . . . . 0.4 111.836 -178.993 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 69' ' ' GLU . . . . . 0.422 ' HG3' ' CD2' ' A' ' 16' ' ' HIS . 2.9 mp0 -58.28 -40.69 82.57 Favored 'General case' 0 CA--C 1.519 -0.219 0 O-C-N 121.437 -0.789 . . . . 4.51 110.644 171.863 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -56.01 -42.29 76.22 Favored 'General case' 0 N--CA 1.449 -0.485 0 C-N-CA 120.294 -0.563 . . . . 0.65 109.594 177.934 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -60.09 -51.47 69.5 Favored 'General case' 0 CA--C 1.528 0.114 0 CA-C-N 119.187 0.903 . . . . 3.6 112.09 174.88 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 20.9 ttt180 -45.85 -67.46 0.28 Allowed 'General case' 0 N--CA 1.467 0.387 0 CA-C-N 118.555 0.616 . . . . 1.85 109.569 175.489 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 73' ' ' LEU . . . . . 0.661 HD12 HG23 ' A' ' 85' ' ' VAL . 0.2 OUTLIER -59.12 -35.25 73.13 Favored 'General case' 0 CA--C 1.509 -0.605 0 C-N-CA 125.603 1.561 . . . . 0.61 111.314 -173.054 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 1.8 tmt? -59.06 -38.55 79.64 Favored 'General case' 0 N--CA 1.445 -0.683 0 CA-C-O 119.783 -0.151 . . . . 2.87 111.164 -177.256 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 23.1 p80 -91.13 -35.95 14.27 Favored 'General case' 0 N--CA 1.454 -0.237 0 CA-C-O 116.467 -1.73 . . . . 1.12 111.915 179.353 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 20.4 m -10.36 117.46 0.01 OUTLIER 'General case' 0 C--N 1.344 0.328 0 C-N-CA 128.532 2.733 . . . . 1.23 115.251 -169.359 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 6.9 p -46.66 -44.01 18.12 Favored 'General case' 0 N--CA 1.452 -0.347 0 C-N-CA 125.814 1.645 . . . . 1.09 110.346 176.585 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 10.5 t0 -68.33 102.68 1.44 Allowed 'General case' 0 N--CA 1.448 -0.558 0 CA-C-O 121.669 0.747 . . . . 2.21 109.243 166.04 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 34.4 p-80 -50.23 -35.54 27.22 Favored 'General case' 0 N--CA 1.455 -0.21 0 CA-C-N 115.832 -0.622 . . . . 4.35 111.986 175.145 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -59.47 -48.28 82.24 Favored 'General case' 0 N--CA 1.448 -0.538 0 CA-C-O 118.278 -0.868 . . . . 0.79 110.399 179.757 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 1.4 tt0 -46.69 -42.6 16.78 Favored 'General case' 0 N--CA 1.465 0.298 0 CA-C-N 119.066 0.848 . . . . 3.37 110.161 177.1 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -63.18 -51.88 64.6 Favored 'General case' 0 CA--C 1.516 -0.351 0 N-CA-C 109.504 -0.554 . . . . 3.08 109.504 -179.982 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 1.4 mm? -65.72 -18.38 65.29 Favored 'General case' 0 N--CA 1.45 -0.431 0 CA-C-O 117.628 -1.177 . . . . 0.58 113.059 178.166 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -67.04 -50.58 61.47 Favored 'General case' 0 CA--C 1.519 -0.218 0 CA-C-N 121.387 1.903 . . . . 1.55 107.141 168.092 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 85' ' ' VAL . . . . . 0.661 HG23 HD12 ' A' ' 73' ' ' LEU . 69.0 t -58.03 -43.53 85.25 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.671 0 CA-C-O 117.471 -1.252 . . . . 0.45 112.008 177.79 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 9.9 mt-30 -68.1 -47.79 67.25 Favored 'General case' 0 C--O 1.225 -0.225 0 CA-C-N 122.305 2.321 . . . . 1.71 111.853 177.972 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 72.4 tttt -57.12 -49.18 76.71 Favored 'General case' 0 N--CA 1.449 -0.506 0 O-C-N 121.568 -0.707 . . . . 2.27 110.602 -173.942 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 25.0 m120 -68.83 -48.76 62.73 Favored 'General case' 0 N--CA 1.453 -0.291 0 N-CA-C 109.622 -0.511 . . . . 1.82 109.622 175.738 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -122.81 77.62 48.88 Favored Pre-proline 0 C--O 1.236 0.393 0 C-N-CA 125.652 1.581 . . . . 0.6 111.656 -170.34 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 57.9 Cg_endo -69.78 4.18 2.35 Favored 'Trans proline' 0 CA--C 1.537 0.632 0 C-N-CA 122.907 2.404 . . . . 1.57 113.187 -176.815 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 91' ' ' LYS . . . . . 0.428 ' HE3' ' OE2' ' A' ' 51' ' ' GLU . 0.5 OUTLIER -122.49 -44.14 2.25 Favored 'General case' 0 N--CA 1.45 -0.448 0 C-N-CA 126.26 1.824 . . . . 3.32 110.143 -171.702 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 5.9 m -58.25 -45.52 87.64 Favored 'General case' 0 N--CA 1.464 0.237 0 O-C-N 120.946 -1.097 . . . . 0.52 111.214 175.668 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 10.9 t80 -58.15 -46.08 86.3 Favored 'General case' 0 CA--C 1.511 -0.556 0 CA-C-O 121.771 0.796 . . . . 2.21 110.83 178.136 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 26.8 tt0 -56.09 -34.75 66.31 Favored 'General case' 0 N--CA 1.44 -0.931 0 CA-C-N 114.284 -1.325 . . . . 2.44 109.834 179.851 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 4.0 t80 -62.7 -57.19 11.85 Favored 'General case' 0 N--CA 1.455 -0.207 0 C-N-CA 124.338 1.055 . . . . 0.98 110.305 -178.083 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 37.3 mm -53.91 -44.62 61.7 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.114 0 N-CA-C 109.591 -0.522 . . . . 1.33 109.591 177.368 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 9.3 t30 -62.56 -30.78 71.57 Favored 'General case' 0 CA--C 1.534 0.335 0 N-CA-C 111.957 0.354 . . . . 1.55 111.957 -179.329 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 7.7 t70 -65.43 -47.07 77.47 Favored 'General case' 0 N--CA 1.462 0.156 0 C-N-CA 124.587 1.155 . . . . 2.46 110.003 175.118 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 6.7 mm100 -81.47 70.85 8.43 Favored 'General case' 0 N--CA 1.453 -0.305 0 CA-C-O 122.162 0.982 . . . . 2.75 110.212 -175.47 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 9.4 tp -69.4 106.67 1.38 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.425 0 N-CA-C 108.765 -0.828 . . . . 4.46 108.765 178.966 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 9.5 ttmm -155.79 151.42 27.21 Favored 'General case' 0 N--CA 1.455 -0.204 0 O-C-N 120.736 -1.227 . . . . 10.81 107.958 174.084 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 102' ' ' PHE . . . . . . . . . . . . . 87.6 m-85 -137.49 135.09 36.49 Favored 'General case' 0 N--CA 1.449 -0.511 0 N-CA-C 105.537 -2.023 . . . . 7.69 105.537 175.273 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 8.8 tp -136.01 140.83 43.26 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.21 0 N-CA-C 106.519 -1.66 . . . . 4.07 106.519 177.744 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 104' ' ' ILE . . . . . . . . . . . . . 26.1 mm 63.66 -73.8 0.08 OUTLIER 'Isoleucine or valine' 0 CA--C 1.533 0.324 0 C-N-CA 124.989 1.316 . . . . 6.98 110.5 -169.938 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 12.9 t-20 75.47 -163.73 0.07 Allowed 'General case' 0 CA--C 1.534 0.338 0 C-N-CA 126.013 1.725 . . . . 8.46 109.506 -178.029 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 22.5 p . . . . . 0 C--O 1.246 0.888 0 N-CA-C 107.437 -1.32 . . . . 9.8 107.437 176.785 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 1' ' ' GLY . . . . . 0.491 ' O ' ' HE3' ' A' ' 3' ' ' LYS . . . . . . . . 0 N--CA 1.472 1.083 0 N-CA-C 109.59 -1.404 . . . . 17.24 109.59 . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 5.5 m 25.56 76.35 0.02 OUTLIER 'General case' 0 CA--C 1.53 0.182 0 C-N-CA 127.64 2.376 . . . . 19.27 116.228 174.114 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 3' ' ' LYS . . . . . 0.491 ' HE3' ' O ' ' A' ' 1' ' ' GLY . 12.1 ptpt -156.34 88.31 1.07 Allowed 'General case' 0 C--O 1.225 -0.232 0 N-CA-C 109.485 -0.561 . . . . 18.72 109.485 170.385 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 70.74 -163.98 53.31 Favored Glycine 0 CA--C 1.522 0.509 0 N-CA-C 111.1 -0.8 . . . . 17.16 111.1 -176.375 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 26.7 m -85.91 -157.89 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.446 -0.628 0 C-N-CA 123.853 0.861 . . . . 17.42 109.492 178.329 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 21.5 mt-10 -82.79 119.28 24.15 Favored 'General case' 0 N--CA 1.443 -0.775 0 N-CA-C 108.924 -0.769 . . . . 12.8 108.924 172.135 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -156.07 37.03 0.34 Allowed 'General case' 0 N--CA 1.452 -0.33 0 C-N-CA 125.484 1.514 . . . . 10.95 109.565 179.197 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 7.3 mmm180 -144.14 121.65 11.74 Favored 'General case' 0 N--CA 1.446 -0.648 0 N-CA-C 106.288 -1.745 . . . . 10.66 106.288 -178.933 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 1.7 m120 -48.78 -32.25 8.32 Favored 'General case' 0 C--O 1.223 -0.324 0 C-N-CA 123.784 0.834 . . . . 2.69 112.653 174.292 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 9.5 t70 -55.07 -58.01 9.38 Favored 'General case' 0 N--CA 1.449 -0.519 0 C-N-CA 124.768 1.227 . . . . 2.36 110.978 173.012 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 66.1 m -64.94 -50.47 66.3 Favored 'General case' 0 N--CA 1.462 0.166 0 CA-C-O 122.115 0.96 . . . . 1.79 111.193 178.822 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 7.4 tt0 -70.52 -22.35 62.63 Favored 'General case' 0 CA--C 1.536 0.42 0 C-N-CA 125.022 1.329 . . . . 3.99 110.45 -169.599 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -79.93 -41.1 12.91 Favored Glycine 0 CA--C 1.525 0.708 0 C-N-CA 125.1 1.333 . . . . 0.68 109.978 168.577 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -52.28 -49.4 64.22 Favored 'General case' 0 C--N 1.333 -0.12 0 CA-C-N 118.599 1.199 . . . . 2.88 110.741 -179.24 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -63.87 -34.33 67.56 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.559 0 N-CA-C 112.747 0.647 . . . . 0.48 112.747 178.891 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 2.1 t-160 -59.79 -54.65 43.82 Favored 'General case' 0 N--CA 1.462 0.128 0 N-CA-C 106.762 -1.57 . . . . 0.46 106.762 176.4 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 41.0 mt-10 -57.28 -39.32 75.45 Favored 'General case' 0 C--O 1.222 -0.349 0 CA-C-O 118.209 -0.901 . . . . 2.46 111.075 179.723 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -51.1 -54.72 22.5 Favored 'General case' 0 CA--C 1.52 -0.203 0 CA-C-N 119.368 0.985 . . . . 3.11 110.45 173.452 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -47.94 -46.26 25.93 Favored Glycine 0 CA--C 1.527 0.792 0 N-CA-C 110.999 -0.84 . . . . 0.44 110.999 176.5 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 2.6 t-80 -63.62 -46.73 84.42 Favored 'General case' 0 N--CA 1.45 -0.462 0 O-C-N 121.98 -0.718 . . . . 1.83 111.794 -179.367 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -59.23 -32.72 70.22 Favored 'General case' 0 N--CA 1.452 -0.342 0 CA-C-N 118.603 0.638 . . . . 0.57 109.352 -179.25 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 45.0 t -68.39 -41.57 83.53 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.267 0 C-N-CA 119.923 -0.711 . . . . 0.8 110.201 177.092 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 2.0 t70 -59.53 -29.16 67.69 Favored 'General case' 0 C--O 1.23 0.07 0 CA-C-O 121.284 0.564 . . . . 2.16 110.974 173.86 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 10.3 t70 -70.49 -49.56 47.1 Favored 'General case' 0 N--CA 1.45 -0.427 0 N-CA-C 108.602 -0.888 . . . . 2.19 108.602 -173.65 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 25' ' ' TYR . . . . . 0.439 ' CD2' HD11 ' A' ' 103' ' ' ILE . 0.2 OUTLIER -64.2 -49.4 72.16 Favored 'General case' 0 N--CA 1.453 -0.284 0 C-N-CA 123.547 0.739 . . . . 4.55 110.787 178.171 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -54.61 -41.5 70.06 Favored 'General case' 0 N--CA 1.454 -0.267 0 O-C-N 121.983 -0.448 . . . . 1.02 110.382 178.795 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -60.39 -58.36 14.34 Favored Glycine 0 C--O 1.224 -0.531 0 N-CA-C 109.664 -1.374 . . . . 1.13 109.664 175.728 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -46.73 -42.64 17.02 Favored 'General case' 0 C--N 1.33 -0.242 0 C-N-CA 124.49 1.116 . . . . 2.87 112.044 -175.187 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 3.0 mm? -84.83 -30.11 24.8 Favored 'General case' 0 N--CA 1.445 -0.696 0 C-N-CA 124.146 0.978 . . . . 1.71 113.439 -177.729 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 11.8 mt -124.82 64.78 1.11 Allowed 'General case' 0 CA--C 1.529 0.146 0 CA-C-N 119.375 0.989 . . . . 1.9 109.949 -165.457 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 1.6 t70 -144.8 171.11 14.88 Favored 'General case' 0 CA--C 1.529 0.147 0 CA-C-O 121.237 0.541 . . . . 4.32 110.48 -178.162 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 3.2 mmtm -101.82 -40.24 7.02 Favored 'General case' 0 N--CA 1.452 -0.35 0 C-N-CA 125.686 1.594 . . . . 7.21 110.287 168.69 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 7.4 t30 -98.4 138.55 35.46 Favored 'General case' 0 N--CA 1.454 -0.246 0 N-CA-C 107.598 -1.26 . . . . 6.68 107.598 -179.205 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 1.4 tt0 -66.95 -20.18 65.85 Favored 'General case' 0 CA--C 1.535 0.372 0 O-C-N 121.509 -0.744 . . . . 12.0 111.229 179.845 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 1.8 p -109.94 66.12 0.63 Allowed 'General case' 0 N--CA 1.448 -0.528 0 C-N-CA 125.178 1.391 . . . . 7.72 109.724 -177.15 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -154.87 -179.52 8.11 Favored 'General case' 0 CA--C 1.537 0.445 0 C-N-CA 124.658 1.183 . . . . 6.89 107.962 173.845 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 5.4 mp -138.47 164.89 28.21 Favored 'General case' 0 N--CA 1.464 0.246 0 C-N-CA 124.071 0.949 . . . . 2.33 108.577 176.371 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 9.3 p -59.58 -43.55 91.24 Favored 'Isoleucine or valine' 0 C--N 1.342 0.276 0 CA-C-N 118.509 0.595 . . . . 2.54 110.339 -175.942 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 59.7 p 48.51 -156.98 0.07 Allowed 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 124.87 1.268 . . . . 3.81 112.123 179.97 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 26.6 t30 -75.09 69.09 1.95 Allowed 'General case' 0 CA--C 1.532 0.28 0 O-C-N 120.509 -1.369 . . . . 6.71 109.963 173.417 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 8.4 t -77.59 -176.75 4.44 Favored 'General case' 0 CA--C 1.534 0.357 0 O-C-N 121.57 -0.706 . . . . 3.55 109.39 170.518 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 33.5 mtmt 56.71 -77.14 0.01 OUTLIER 'General case' 0 N--CA 1.467 0.383 0 C-N-CA 124.868 1.267 . . . . 6.59 110.987 -161.897 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.3 -45.59 92.84 Favored 'General case' 0 C--O 1.224 -0.272 0 CA-C-N 118.801 0.728 . . . . 8.18 111.15 -178.95 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 3.8 t80 64.39 74.99 0.39 Allowed 'General case' 0 CA--C 1.531 0.246 0 C-N-CA 123.611 0.765 . . . . 5.49 111.576 174.424 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . 0.265 3.9 mt 65.65 90.74 0.05 OUTLIER 'Isoleucine or valine' 0 CA--C 1.539 0.545 0 C-N-CA 125.4 1.48 . . . . 2.94 110.967 -178.335 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 6.6 t70 -164.57 -66.56 0.04 OUTLIER 'General case' 0 N--CA 1.465 0.292 0 C-N-CA 125.692 1.597 . . . . 2.75 107.374 -179.133 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 4.3 mm -54.28 -55.79 12.98 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.396 0 C-N-CA 126.038 1.735 . . . . 0.49 109.689 -179.894 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 30.4 t80 -62.28 -26.02 68.17 Favored 'General case' 0 C--O 1.225 -0.219 0 O-C-N 120.498 -1.376 . . . . 0.38 112.181 175.664 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 49' ' ' LYS . . . . . 0.486 ' HA ' ' HE2' ' A' ' 49' ' ' LYS . 10.9 mmpt? -70.15 -47.21 62.66 Favored 'General case' 0 N--CA 1.45 -0.433 0 O-C-N 120.164 -1.585 . . . . 0.99 110.877 -178.066 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 16.4 tp10 -89.25 -60.61 1.9 Allowed 'General case' 0 C--N 1.332 -0.179 0 CA-C-O 121.519 0.676 . . . . 2.48 109.449 -176.504 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 51' ' ' GLU . . . . . 0.443 ' OE2' ' HE2' ' A' ' 91' ' ' LYS . 29.3 mp0 -71.32 -26.99 63.08 Favored 'General case' 0 C--O 1.235 0.324 0 O-C-N 121.185 -0.947 . . . . 2.61 110.699 -174.534 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 52' ' ' GLY . . . . . 0.443 ' HA2' ' CD1' ' A' ' 66' ' ' PHE . . . -72.45 42.59 0.84 Allowed Glycine 0 CA--C 1.53 1.016 0 C-N-CA 124.152 0.882 . . . . 0.36 114.562 171.619 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 28.2 t -151.51 34.24 0.56 Allowed 'General case' 0 N--CA 1.451 -0.409 0 O-C-N 121.109 -1.23 . . . . 2.05 109.087 151.432 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 1.5 m-20 -132.25 -47.68 0.92 Allowed 'General case' 0 CA--C 1.519 -0.237 0 N-CA-C 112.246 0.462 . . . . 1.78 112.246 -172.238 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 25.0 mt -59.42 -36.89 76.72 Favored 'General case' 0 N--CA 1.464 0.26 0 CA-C-O 121.033 0.444 . . . . 0.42 111.411 -172.294 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -177.56 171.76 1.87 Allowed 'General case' 0 C--N 1.33 -0.245 0 N-CA-C 107.126 -1.435 . . . . 0.64 107.126 -175.871 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 31.2 m -63.15 -33.7 76.03 Favored 'General case' 0 CA--C 1.53 0.179 0 O-C-N 121.693 -0.629 . . . . 1.0 110.834 169.101 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 1.8 m-85 -65.63 -19.2 65.82 Favored 'General case' 0 N--CA 1.466 0.361 0 CA-C-N 119.191 0.905 . . . . 1.21 111.502 171.041 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -69.21 -9.81 61.28 Favored Glycine 0 N--CA 1.443 -0.845 0 CA-C-O 118.656 -1.08 . . . . 0.42 111.31 173.607 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 58.3 ttt180 -116.35 -11.5 11.21 Favored 'General case' 0 N--CA 1.454 -0.232 0 CA-C-N 119.211 1.506 . . . . 3.68 112.657 -174.33 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 32.4 p -72.85 -123.61 0.0 OUTLIER 'General case' 0 CA--C 1.533 0.317 0 C-N-CA 123.227 0.611 . . . . 1.12 109.724 -178.378 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 14.3 t30 -76.3 149.19 37.11 Favored 'General case' 0 N--CA 1.451 -0.405 0 O-C-N 120.215 -1.553 . . . . 1.98 107.537 177.219 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -57.12 -33.32 67.24 Favored 'General case' 0 CA--C 1.534 0.336 0 CA-C-O 121.79 0.805 . . . . 2.86 110.321 178.832 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -60.14 -34.81 74.05 Favored 'General case' 0 N--CA 1.45 -0.445 0 O-C-N 121.684 -0.635 . . . . 0.42 112.592 177.656 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 7.0 mt-10 -76.25 -42.29 46.22 Favored 'General case' 0 CA--C 1.516 -0.34 0 O-C-N 121.694 -0.628 . . . . 2.14 110.174 178.491 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 66' ' ' PHE . . . . . 0.443 ' CD1' ' HA2' ' A' ' 52' ' ' GLY . 36.8 t80 -48.94 -53.84 18.01 Favored 'General case' 0 N--CA 1.453 -0.289 0 C-N-CA 123.786 0.834 . . . . 0.34 111.183 171.626 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 72.3 t80 -61.79 -45.92 91.79 Favored 'General case' 0 CA--C 1.534 0.347 0 C-N-CA 123.028 0.531 . . . . 0.51 110.483 -179.988 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -60.54 -48.22 82.74 Favored 'General case' 0 CA--C 1.538 0.517 0 O-C-N 121.378 -0.826 . . . . 0.29 112.186 -177.226 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 5.7 mm-40 -57.47 -41.53 80.79 Favored 'General case' 0 N--CA 1.458 -0.067 0 C-N-CA 123.74 0.816 . . . . 4.15 110.095 172.256 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -57.48 -45.16 85.15 Favored 'General case' 0 N--CA 1.451 -0.401 0 CA-C-O 118.664 -0.684 . . . . 0.32 109.801 -179.92 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 50.1 t80 -55.99 -49.87 72.43 Favored 'General case' 0 N--CA 1.465 0.287 0 CA-C-N 119.167 0.894 . . . . 2.24 112.004 174.607 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 11.6 ttt180 -47.46 -61.35 1.96 Allowed 'General case' 0 CA--C 1.533 0.327 0 N-CA-C 109.107 -0.701 . . . . 2.1 109.107 175.405 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 73' ' ' LEU . . . . . 0.607 ' CB ' HG21 ' A' ' 85' ' ' VAL . 0.1 OUTLIER -65.36 -23.37 66.97 Favored 'General case' 0 C--N 1.328 -0.362 0 C-N-CA 124.414 1.086 . . . . 0.55 111.607 -173.411 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -65.05 -40.8 95.28 Favored 'General case' 0 C--N 1.326 -0.425 0 C-N-CA 122.933 0.493 . . . . 2.84 110.719 179.109 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 13.8 p80 -95.41 -18.68 20.53 Favored 'General case' 0 C--O 1.227 -0.083 0 CA-C-O 116.936 -1.506 . . . . 0.9 113.478 -178.603 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 7.6 m -25.67 118.04 0.06 Allowed 'General case' 0 CA--C 1.516 -0.342 0 C-N-CA 126.419 1.888 . . . . 1.05 113.59 -171.603 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 6.2 p -46.08 -44.19 15.3 Favored 'General case' 0 N--CA 1.451 -0.424 0 C-N-CA 125.746 1.619 . . . . 1.09 109.985 177.607 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 13.4 t0 -70.03 103.81 2.38 Favored 'General case' 0 N--CA 1.451 -0.408 0 CA-C-O 122.034 0.921 . . . . 1.92 109.738 166.274 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 1.4 p80 -45.49 -37.32 5.19 Favored 'General case' 0 CA--C 1.531 0.239 0 CA-C-N 115.569 -0.741 . . . . 4.65 112.746 172.017 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -65.22 -42.07 93.82 Favored 'General case' 0 N--CA 1.449 -0.477 0 CA-C-O 118.68 -0.676 . . . . 0.59 110.879 -178.699 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 1.2 tt0 -48.83 -41.41 32.84 Favored 'General case' 0 N--CA 1.463 0.188 0 CA-C-N 118.896 0.771 . . . . 2.99 109.794 174.377 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 14.9 mtp180 -65.01 -52.53 55.55 Favored 'General case' 0 CA--C 1.517 -0.317 0 N-CA-C 109.332 -0.618 . . . . 2.31 109.332 -179.714 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 1.4 mm? -62.5 -21.79 65.77 Favored 'General case' 0 C--O 1.222 -0.345 0 CA-C-O 118.315 -0.85 . . . . 0.5 112.838 177.752 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 30.4 mttt -67.45 -42.91 82.31 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 120.907 1.685 . . . . 1.75 108.424 174.467 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 85' ' ' VAL . . . . . 0.607 HG21 ' CB ' ' A' ' 73' ' ' LEU . 84.0 t -60.69 -64.9 0.53 Allowed 'Isoleucine or valine' 0 C--O 1.219 -0.503 0 CA-C-O 118.032 -0.985 . . . . 0.62 109.815 170.639 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -48.72 -42.67 35.9 Favored 'General case' 0 CA--C 1.533 0.309 0 CA-C-N 120.309 1.413 . . . . 2.1 112.31 -174.622 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 35.6 tttm -62.52 -49.35 75.69 Favored 'General case' 0 N--CA 1.448 -0.56 0 C-N-CA 123.933 0.893 . . . . 2.21 111.891 178.793 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 70.6 m-80 -84.79 -4.96 59.3 Favored 'General case' 0 CA--C 1.531 0.219 0 CA-C-N 118.332 0.515 . . . . 1.9 111.973 -179.465 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -162.02 62.78 1.44 Allowed Pre-proline 0 N--CA 1.448 -0.539 0 C-N-CA 124.274 1.029 . . . . 0.45 110.005 -166.343 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 30.2 Cg_endo -60.08 -35.07 93.95 Favored 'Trans proline' 0 N--CA 1.454 -0.836 0 C-N-CA 122.516 2.144 . . . . 2.43 110.446 -174.754 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 91' ' ' LYS . . . . . 0.443 ' HE2' ' OE2' ' A' ' 51' ' ' GLU . 0.2 OUTLIER -81.65 -39.55 24.23 Favored 'General case' 0 N--CA 1.451 -0.379 0 C-N-CA 124.813 1.245 . . . . 2.63 112.639 -177.525 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 3.5 m -60.96 -45.99 92.52 Favored 'General case' 0 N--CA 1.464 0.262 0 CA-C-N 120.303 1.411 . . . . 0.39 110.342 179.04 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 5.1 t80 -58.84 -47.96 83.01 Favored 'General case' 0 CA--C 1.51 -0.571 0 CA-C-O 121.068 0.461 . . . . 1.97 110.835 176.835 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 44.9 tt0 -56.22 -31.22 63.3 Favored 'General case' 0 N--CA 1.441 -0.887 0 CA-C-N 115.327 -0.851 . . . . 1.48 110.767 177.841 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 3.6 t80 -61.12 -58.78 6.96 Favored 'General case' 0 N--CA 1.455 -0.205 0 CA-C-N 118.702 0.683 . . . . 0.93 110.417 -176.07 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 3.3 mp -57.15 -41.58 78.1 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.206 0 N-CA-C 108.625 -0.88 . . . . 0.79 108.625 176.237 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 7.7 t-20 -59.65 -35.14 73.82 Favored 'General case' 0 CA--C 1.542 0.662 0 N-CA-C 112.342 0.497 . . . . 1.86 112.342 -177.726 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 21.0 t70 -57.41 -43.81 84.05 Favored 'General case' 0 CA--C 1.516 -0.356 0 C-N-CA 125.214 1.406 . . . . 2.47 109.66 176.423 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 70.3 mm-40 -88.76 65.9 7.85 Favored 'General case' 0 N--CA 1.443 -0.785 0 CA-C-O 121.52 0.676 . . . . 3.43 109.857 -173.709 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 5.7 tp -69.17 88.14 0.19 Allowed 'Isoleucine or valine' 0 CA--C 1.537 0.477 0 CA-C-O 122.032 0.92 . . . . 4.41 110.359 -176.406 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 101' ' ' LYS . . . . . 0.427 ' CE ' ' H ' ' A' ' 102' ' ' PHE . 0.1 OUTLIER -152.57 -175.76 5.43 Favored 'General case' 0 C--N 1.333 -0.131 0 O-C-N 120.644 -1.285 . . . . 8.7 107.755 177.235 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 102' ' ' PHE . . . . . 0.427 ' H ' ' CE ' ' A' ' 101' ' ' LYS . 39.0 p90 -147.56 163.78 35.51 Favored 'General case' 0 C--N 1.327 -0.401 0 C-N-CA 125.665 1.586 . . . . 6.57 106.745 -177.604 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 103' ' ' ILE . . . . . 0.439 HD11 ' CD2' ' A' ' 25' ' ' TYR . 9.5 tp -116.59 157.82 17.33 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.238 0 N-CA-C 108.739 -0.838 . . . . 3.69 108.739 179.272 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 104' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -135.74 141.49 41.9 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.51 0 N-CA-C 107.019 -1.474 . . . . 6.0 107.019 179.674 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 52.4 t30 65.49 107.96 0.04 OUTLIER 'General case' 0 CA--C 1.532 0.252 0 C-N-CA 125.651 1.58 . . . . 10.85 111.764 -174.709 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 13.3 p . . . . . 0 C--O 1.253 1.265 0 CA-C-O 115.122 -2.371 . . . . 12.77 109.693 178.017 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.471 0.995 0 N-CA-C 109.492 -1.443 . . . . 16.01 109.492 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 2' ' ' SER . . . . . 0.486 ' O ' ' HE2' ' A' ' 3' ' ' LYS . 7.0 m -147.08 64.08 1.17 Allowed 'General case' 0 CA--C 1.516 -0.334 0 CA-C-N 118.115 0.957 . . . . 15.33 109.429 178.466 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 3' ' ' LYS . . . . . 0.486 ' HE2' ' O ' ' A' ' 2' ' ' SER . 0.3 OUTLIER -158.8 154.02 25.48 Favored 'General case' 0 N--CA 1.45 -0.457 0 N-CA-C 108.14 -1.059 . . . . 20.57 108.14 -179.15 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 173.37 164.02 27.95 Favored Glycine 0 CA--C 1.519 0.333 0 N-CA-C 108.167 -1.973 . . . . 13.83 108.167 177.322 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 14.4 m -89.37 175.94 0.69 Allowed 'Isoleucine or valine' 0 N--CA 1.445 -0.702 0 N-CA-C 107.911 -1.144 . . . . 13.56 107.911 158.038 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 8.1 pt-20 -82.33 120.76 25.82 Favored 'General case' 0 N--CA 1.45 -0.446 0 CA-C-O 121.499 0.666 . . . . 9.58 111.915 -177.561 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -111.32 26.78 10.32 Favored 'General case' 0 N--CA 1.453 -0.324 0 C-N-CA 125.236 1.414 . . . . 8.87 110.995 -177.692 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 18.9 mtp180 66.94 -69.51 0.13 Allowed 'General case' 0 N--CA 1.466 0.335 0 C-N-CA 125.133 1.373 . . . . 7.08 110.861 -174.571 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 3.5 m120 -48.9 -49.21 40.94 Favored 'General case' 0 C--O 1.224 -0.241 0 O-C-N 121.02 -1.05 . . . . 3.34 112.055 177.62 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -75.53 -26.97 58.5 Favored 'General case' 0 C--O 1.218 -0.591 0 C-N-CA 119.273 -0.971 . . . . 2.56 111.633 -179.434 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 30.5 t -65.76 -66.56 0.53 Allowed 'General case' 0 N--CA 1.451 -0.419 0 CA-C-N 119.369 0.986 . . . . 2.43 109.333 178.622 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 12' ' ' GLU . . . . . 0.438 ' HA ' HD11 ' A' ' 15' ' ' ILE . 3.8 mp0 -74.55 -30.42 61.74 Favored 'General case' 0 N--CA 1.448 -0.528 0 N-CA-C 109.311 -0.625 . . . . 4.68 109.311 -173.938 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -61.81 -53.28 44.55 Favored Glycine 0 CA--C 1.524 0.62 0 N-CA-C 111.045 -0.822 . . . . 0.67 111.045 171.566 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 84.3 t80 -57.02 -53.15 61.34 Favored 'General case' 0 CA--C 1.517 -0.319 0 CA-C-N 118.771 1.285 . . . . 3.19 110.197 -175.139 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 15' ' ' ILE . . . . . 0.438 HD11 ' HA ' ' A' ' 12' ' ' GLU . 0.9 OUTLIER -62.99 -33.72 62.26 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.407 0 O-C-N 121.755 -0.59 . . . . 0.51 112.194 -179.906 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 1.9 t60 -58.99 -57.51 12.75 Favored 'General case' 0 C--N 1.342 0.259 0 N-CA-C 107.303 -1.369 . . . . 0.61 107.303 175.954 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 44.0 mt-10 -55.64 -35.44 65.92 Favored 'General case' 0 C--O 1.222 -0.389 0 C-N-CA 124.262 1.025 . . . . 2.56 110.72 -179.805 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 6.2 t80 -58.64 -49.66 76.71 Favored 'General case' 0 N--CA 1.453 -0.292 0 C-N-CA 124.097 0.959 . . . . 2.78 109.8 177.521 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -48.52 -46.93 29.73 Favored Glycine 0 CA--C 1.527 0.837 0 N-CA-C 110.959 -0.856 . . . . 0.44 110.959 171.128 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 1.9 t-80 -62.5 -44.99 95.03 Favored 'General case' 0 N--CA 1.453 -0.299 0 O-C-N 121.516 -0.991 . . . . 1.88 111.742 -179.526 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -62.59 -29.56 70.69 Favored 'General case' 0 N--CA 1.451 -0.377 0 O-C-N 121.483 -0.761 . . . . 0.58 109.806 -179.695 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 90.1 t -66.29 -40.07 85.87 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.147 0 O-C-N 121.36 -0.838 . . . . 0.79 110.697 175.432 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 18.8 t0 -59.36 -30.53 68.47 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-O 121.785 0.802 . . . . 2.0 110.863 173.936 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 11.8 t70 -69.37 -51.58 35.34 Favored 'General case' 0 N--CA 1.451 -0.393 0 N-CA-C 108.258 -1.016 . . . . 1.87 108.258 -176.107 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 48.9 t80 -59.38 -50.66 73.12 Favored 'General case' 0 N--CA 1.454 -0.263 0 C-N-CA 123.09 0.556 . . . . 2.6 110.512 179.021 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -52.91 -42.45 65.37 Favored 'General case' 0 N--CA 1.451 -0.394 0 N-CA-C 110.285 -0.265 . . . . 1.41 110.285 179.671 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -69.67 -46.9 52.18 Favored Glycine 0 C--O 1.226 -0.401 0 N-CA-C 111.464 -0.654 . . . . 1.65 111.464 -178.351 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 0.9 OUTLIER -54.09 -47.47 71.71 Favored 'General case' 0 N--CA 1.455 -0.207 0 C-N-CA 123.606 0.762 . . . . 2.52 109.422 -177.298 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -74.31 -33.02 63.08 Favored 'General case' 0 N--CA 1.447 -0.603 0 C-N-CA 123.254 0.621 . . . . 2.04 112.531 -177.821 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 12.3 mt -118.74 37.06 4.2 Favored 'General case' 0 CA--C 1.532 0.257 0 CA-C-N 118.834 0.743 . . . . 2.38 110.245 -166.723 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 4.7 t70 -64.9 146.0 55.53 Favored 'General case' 0 CA--C 1.533 0.31 0 C-N-CA 123.244 0.618 . . . . 6.79 110.986 177.997 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 32' ' ' LYS . . . . . 0.447 ' HA ' ' HE2' ' A' ' 32' ' ' LYS . 0.0 OUTLIER 179.71 -43.44 0.01 OUTLIER 'General case' 0 N--CA 1.464 0.233 0 C-N-CA 126.404 1.882 . . . . 7.34 109.33 162.268 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 24.1 t-20 -78.95 168.05 20.26 Favored 'General case' 0 CA--C 1.532 0.288 0 C-N-CA 123.686 0.794 . . . . 9.06 110.068 -173.08 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 3.1 mm-40 -66.57 8.04 0.28 Allowed 'General case' 0 CA--C 1.537 0.445 0 N-CA-C 114.194 1.183 . . . . 7.69 114.194 177.714 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 18.1 p -142.27 111.9 6.71 Favored 'General case' 0 N--CA 1.447 -0.607 0 N-CA-C 106.882 -1.525 . . . . 6.9 106.882 169.3 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -58.64 -54.4 47.44 Favored 'General case' 0 C--O 1.224 -0.266 0 C-N-CA 124.367 1.067 . . . . 6.38 108.863 -178.278 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 10.8 mp -51.34 118.67 3.43 Favored 'General case' 0 C--O 1.233 0.226 0 C-N-CA 124.862 1.265 . . . . 2.26 109.82 -175.992 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 55.9 t -84.16 75.67 1.11 Allowed 'Isoleucine or valine' 0 N--CA 1.454 -0.253 0 CA-C-O 122.279 1.037 . . . . 3.41 108.496 -176.337 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 15.0 t -138.21 -54.44 0.64 Allowed 'General case' 0 N--CA 1.454 -0.27 0 CA-C-N 115.489 -0.778 . . . . 4.52 109.601 172.474 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 11.5 p-10 -83.32 62.76 6.88 Favored 'General case' 0 CA--C 1.537 0.469 0 O-C-N 120.787 -1.195 . . . . 5.77 111.258 -172.952 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 22.3 t -137.38 -56.94 0.7 Allowed 'General case' 0 CA--C 1.534 0.337 0 O-C-N 121.425 -0.797 . . . . 3.05 111.95 -168.841 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 6.6 mmtp -62.94 93.95 0.06 Allowed 'General case' 0 N--CA 1.465 0.314 0 O-C-N 121.311 -0.868 . . . . 6.24 109.007 177.51 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 35.2 mttp 73.76 133.69 0.05 OUTLIER 'General case' 0 N--CA 1.464 0.255 0 C-N-CA 127.179 2.192 . . . . 6.27 108.347 -170.101 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 7.0 m-85 -59.78 105.81 0.42 Allowed 'General case' 0 N--CA 1.456 -0.166 0 N-CA-C 108.709 -0.848 . . . . 4.79 108.709 176.315 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER 35.47 64.78 0.09 OUTLIER 'Isoleucine or valine' 0 CA--C 1.542 0.664 0 C-N-CA 126.514 1.925 . . . . 2.97 111.847 175.272 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 6.3 t70 -103.01 -55.05 2.49 Favored 'General case' 0 N--CA 1.47 0.533 0 CA-C-O 121.775 0.798 . . . . 2.51 110.068 -179.392 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 4.5 mm -54.8 -50.02 64.4 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.385 0 C-N-CA 124.901 1.28 . . . . 0.49 108.643 -176.418 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 36.1 t80 -66.92 -26.99 67.12 Favored 'General case' 0 N--CA 1.453 -0.314 0 O-C-N 121.617 -0.677 . . . . 0.67 112.724 177.067 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 49' ' ' LYS . . . . . 0.488 ' HA ' ' HE2' ' A' ' 49' ' ' LYS . 0.2 OUTLIER -68.44 -48.59 64.18 Favored 'General case' 0 N--CA 1.452 -0.367 0 O-C-N 120.591 -1.318 . . . . 1.31 111.047 -175.994 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 7.6 mm-40 -86.77 -62.17 1.57 Allowed 'General case' 0 C--N 1.33 -0.258 0 N-CA-C 109.059 -0.719 . . . . 2.65 109.059 179.155 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 4.2 mm-40 -69.9 -33.58 72.38 Favored 'General case' 0 CA--C 1.535 0.373 0 O-C-N 121.643 -0.661 . . . . 2.05 109.546 -167.719 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -68.92 34.97 0.29 Allowed Glycine 0 CA--C 1.53 0.997 0 C-N-CA 125.926 1.727 . . . . 0.38 114.213 169.041 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 23.0 t -146.9 35.94 0.93 Allowed 'General case' 0 N--CA 1.447 -0.601 0 O-C-N 120.917 -1.343 . . . . 1.79 108.845 157.433 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 1.1 t-20 -141.25 -43.58 0.37 Allowed 'General case' 0 CA--C 1.52 -0.204 0 N-CA-C 112.817 0.673 . . . . 1.79 112.817 -173.985 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 55' ' ' LEU . . . . . 0.524 HD21 ' HB2' ' A' ' 89' ' ' ALA . 17.0 mt -60.58 -37.04 80.04 Favored 'General case' 0 N--CA 1.461 0.124 0 CA-C-O 120.876 0.369 . . . . 0.35 111.385 -174.56 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER 178.93 168.86 0.93 Allowed 'General case' 0 C--N 1.33 -0.25 0 C-N-CA 125.386 1.474 . . . . 0.44 107.319 -178.21 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 18.7 m -60.43 -36.42 78.13 Favored 'General case' 0 N--CA 1.454 -0.24 0 O-C-N 121.742 -0.599 . . . . 1.11 110.569 168.701 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -67.81 -8.34 35.18 Favored 'General case' 0 N--CA 1.465 0.308 0 C-N-CA 122.806 0.443 . . . . 1.17 112.066 174.209 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -92.47 -0.39 70.03 Favored Glycine 0 N--CA 1.443 -0.846 0 CA-C-O 118.787 -1.007 . . . . 0.47 110.825 175.2 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 1.2 ttt180 -123.11 -2.93 8.57 Favored 'General case' 0 C--O 1.227 -0.087 0 CA-C-N 119.003 1.401 . . . . 2.28 112.175 -178.746 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 12.1 p -68.63 -106.72 0.0 OUTLIER 'General case' 0 N--CA 1.453 -0.275 0 C-N-CA 125.038 1.335 . . . . 1.51 109.644 175.877 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 2.2 t-20 -93.25 151.22 19.94 Favored 'General case' 0 N--CA 1.447 -0.599 0 N-CA-C 108.312 -0.995 . . . . 2.45 108.312 177.071 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 22.7 tt0 -61.23 -29.49 69.86 Favored 'General case' 0 CA--C 1.535 0.401 0 CA-C-N 118.769 0.713 . . . . 3.15 109.974 176.914 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -64.91 -36.43 84.33 Favored 'General case' 0 N--CA 1.452 -0.357 0 N-CA-C 112.797 0.666 . . . . 0.52 112.797 174.959 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 11.3 mt-10 -75.47 -37.75 60.07 Favored 'General case' 0 CA--C 1.511 -0.531 0 O-C-N 121.367 -0.833 . . . . 2.28 110.178 178.473 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 48.8 t80 -53.2 -51.54 61.79 Favored 'General case' 0 N--CA 1.447 -0.607 0 C-N-CA 123.604 0.762 . . . . 0.33 110.472 173.685 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 84.8 t80 -60.59 -46.71 89.22 Favored 'General case' 0 CA--C 1.534 0.35 0 CA-C-O 121.204 0.526 . . . . 0.47 111.121 177.512 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -60.81 -50.96 71.33 Favored 'General case' 0 CA--C 1.541 0.606 0 O-C-N 121.4 -0.813 . . . . 0.3 112.342 -176.553 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 24.8 mm-40 -54.01 -43.71 70.32 Favored 'General case' 0 CA--C 1.52 -0.192 0 C-N-CA 124.425 1.09 . . . . 4.35 110.487 169.6 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -56.36 -42.25 77.49 Favored 'General case' 0 N--CA 1.451 -0.413 0 CA-C-O 118.414 -0.803 . . . . 0.33 109.768 -178.649 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 22.9 t80 -58.09 -52.21 66.51 Favored 'General case' 0 N--CA 1.465 0.323 0 CA-C-N 119.233 0.924 . . . . 2.99 111.578 173.055 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 28.1 ttt180 -46.8 -51.2 16.95 Favored 'General case' 0 CA--C 1.533 0.303 0 C-N-CA 122.738 0.415 . . . . 2.21 110.148 177.584 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 73' ' ' LEU . . . . . 0.634 HD12 HG23 ' A' ' 85' ' ' VAL . 0.1 OUTLIER -72.51 -30.19 64.27 Favored 'General case' 0 C--N 1.327 -0.377 0 C-N-CA 124.698 1.199 . . . . 0.44 111.035 -176.132 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 4.0 tmm? -62.78 -37.91 88.52 Favored 'General case' 0 C--N 1.33 -0.245 0 C-N-CA 123.784 0.834 . . . . 2.63 111.015 -179.374 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 23.4 p80 -87.57 -47.59 8.59 Favored 'General case' 0 C--O 1.224 -0.278 0 CA-C-O 116.832 -1.556 . . . . 1.07 109.826 179.201 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 5.2 m -0.09 104.75 0.01 OUTLIER 'General case' 0 N--CA 1.47 0.557 0 C-N-CA 128.297 2.639 . . . . 1.05 113.624 -173.454 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 2.1 p -45.7 -41.62 10.71 Favored 'General case' 0 N--CA 1.452 -0.372 0 C-N-CA 125.685 1.594 . . . . 0.97 111.621 -177.086 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 59.4 t0 -69.48 103.5 2.06 Favored 'General case' 0 N--CA 1.455 -0.223 0 C-N-CA 118.589 -1.244 . . . . 2.11 109.129 167.381 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 1.7 p80 -42.03 -36.57 1.16 Allowed 'General case' 0 CA--C 1.53 0.177 0 C-N-CA 124.462 1.105 . . . . 4.42 112.63 172.581 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -58.1 -48.84 78.97 Favored 'General case' 0 N--CA 1.451 -0.38 0 C-N-CA 122.644 0.378 . . . . 0.65 111.011 178.91 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -53.62 -38.55 64.13 Favored 'General case' 0 C--O 1.232 0.181 0 C-N-CA 123.407 0.683 . . . . 3.85 110.964 179.073 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 3.3 mtp-105 -65.4 -51.4 60.65 Favored 'General case' 0 C--N 1.328 -0.334 0 C-N-CA 120.167 -0.613 . . . . 3.11 109.702 178.383 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 83' ' ' LEU . . . . . 0.415 HD13 ' HA ' ' A' ' 83' ' ' LEU . 0.8 OUTLIER -60.53 -26.7 67.07 Favored 'General case' 0 N--CA 1.452 -0.344 0 CA-C-O 118.656 -0.688 . . . . 0.51 112.695 177.752 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 37.6 mttt -65.14 -42.39 93.86 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 119.691 1.132 . . . . 1.6 108.489 175.814 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 85' ' ' VAL . . . . . 0.634 HG23 HD12 ' A' ' 73' ' ' LEU . 78.5 t -62.77 -60.34 2.91 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.485 0 CA-C-O 117.4 -1.286 . . . . 0.4 111.612 171.138 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 11.9 mt-30 -49.11 -46.55 45.01 Favored 'General case' 0 N--CA 1.468 0.446 0 CA-C-N 121.19 1.814 . . . . 1.94 111.619 -175.86 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 18.5 tttt -60.25 -52.33 65.73 Favored 'General case' 0 N--CA 1.449 -0.494 0 C-N-CA 123.737 0.815 . . . . 2.36 110.57 178.803 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 19.3 m-20 -84.25 5.38 26.86 Favored 'General case' 0 CA--C 1.533 0.293 0 C-N-CA 123.296 0.638 . . . . 1.07 111.516 -174.629 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 89' ' ' ALA . . . . . 0.524 ' HB2' HD21 ' A' ' 55' ' ' LEU . . . -164.47 77.93 1.47 Allowed Pre-proline 0 N--CA 1.448 -0.553 0 C-N-CA 125.324 1.45 . . . . 0.38 108.894 -177.696 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 96.8 Cg_endo -80.65 47.42 2.55 Favored 'Trans proline' 0 CA--C 1.539 0.76 0 C-N-CA 124.211 3.274 . . . . 1.81 111.624 -175.101 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 4.0 ptmt -169.06 -51.14 0.02 OUTLIER 'General case' 0 C--O 1.225 -0.233 0 C-N-CA 126.436 1.894 . . . . 2.44 109.643 -176.889 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 3.2 m -53.19 -45.61 68.66 Favored 'General case' 0 N--CA 1.464 0.231 0 CA-C-N 119.09 0.859 . . . . 0.32 111.817 179.913 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 9.1 t80 -60.2 -47.27 86.69 Favored 'General case' 0 CA--C 1.514 -0.408 0 CA-C-O 121.572 0.701 . . . . 2.49 110.039 178.527 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 2.0 tt0 -57.89 -30.14 65.62 Favored 'General case' 0 N--CA 1.442 -0.834 0 CA-C-N 114.746 -1.115 . . . . 1.93 110.471 179.253 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 3.9 t80 -64.49 -57.41 9.3 Favored 'General case' 0 N--CA 1.455 -0.196 0 C-N-CA 124.715 1.206 . . . . 0.96 109.917 -175.723 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 3.2 mp -58.79 -41.99 84.18 Favored 'Isoleucine or valine' 0 C--O 1.226 -0.136 0 N-CA-C 108.326 -0.99 . . . . 0.78 108.326 176.108 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 7.7 t30 -59.66 -31.34 69.45 Favored 'General case' 0 CA--C 1.536 0.44 0 N-CA-C 111.617 0.228 . . . . 1.42 111.617 -179.496 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 2.4 t0 -66.2 -53.05 42.02 Favored 'General case' 0 C--N 1.338 0.095 0 C-N-CA 126.132 1.773 . . . . 2.31 108.829 175.672 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 52.5 mm-40 -86.15 70.37 10.56 Favored 'General case' 0 N--CA 1.452 -0.368 0 CA-C-O 122.501 1.143 . . . . 3.0 110.292 -177.253 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 7.3 tp -69.17 110.02 2.39 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.45 0 CA-C-N 115.464 -0.789 . . . . 3.76 109.393 176.688 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 22.2 tptt -148.8 96.84 2.63 Favored 'General case' 0 N--CA 1.458 -0.041 0 O-C-N 120.776 -1.203 . . . . 9.45 110.011 171.197 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 102' ' ' PHE . . . . . . . . . . . . . 72.4 m-85 -77.73 79.42 4.22 Favored 'General case' 0 N--CA 1.455 -0.217 0 N-CA-C 109.051 -0.722 . . . . 8.77 109.051 172.922 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 3.5 tp -81.21 138.96 18.75 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.198 0 N-CA-C 107.095 -1.446 . . . . 4.08 107.095 168.863 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 104' ' ' ILE . . . . . . . . . . . . . 19.1 tt -155.93 120.02 0.46 Allowed 'Isoleucine or valine' 0 N--CA 1.453 -0.282 0 N-CA-C 108.327 -0.99 . . . . 7.98 108.327 175.278 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 5.1 p-10 -164.68 166.63 19.86 Favored 'General case' 0 C--N 1.33 -0.277 0 N-CA-C 107.589 -1.263 . . . . 9.6 107.589 176.165 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 64.2 m . . . . . 0 C--O 1.252 1.219 0 CA-C-O 116.582 -1.675 . . . . 12.2 107.425 160.011 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.472 1.078 0 N-CA-C 108.839 -1.704 . . . . 10.89 108.839 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 18.9 m -143.04 146.37 33.77 Favored 'General case' 0 C--O 1.238 0.497 0 N-CA-C 108.585 -0.895 . . . . 12.1 108.585 173.482 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -170.06 112.12 0.45 Allowed 'General case' 0 CA--C 1.529 0.167 0 CA-C-N 118.229 0.468 . . . . 14.77 110.66 172.842 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 92.47 -156.4 23.27 Favored Glycine 0 C--N 1.334 0.447 0 N-CA-C 110.613 -0.995 . . . . 12.2 110.613 175.992 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 34.3 m -80.22 -160.15 0.05 OUTLIER 'Isoleucine or valine' 0 N--CA 1.442 -0.843 0 N-CA-C 107.652 -1.24 . . . . 12.98 107.652 161.826 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -103.07 122.69 45.18 Favored 'General case' 0 N--CA 1.443 -0.812 0 N-CA-C 108.572 -0.899 . . . . 8.65 108.572 173.365 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 7' ' ' LEU . . . . . 0.41 HD22 ' N ' ' A' ' 7' ' ' LEU . 1.9 mm? -111.7 35.73 3.55 Favored 'General case' 0 N--CA 1.454 -0.26 0 C-N-CA 125.409 1.484 . . . . 8.24 108.448 -177.841 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER 71.15 -60.74 0.5 Allowed 'General case' 0 C--O 1.222 -0.354 0 C-N-CA 125.663 1.585 . . . . 9.64 109.893 -162.518 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 32.5 m-20 -55.05 -45.26 75.26 Favored 'General case' 0 C--O 1.224 -0.275 0 CA-C-N 119.279 0.945 . . . . 3.31 112.313 -174.246 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 5.9 t70 -74.34 -25.71 59.7 Favored 'General case' 0 C--O 1.223 -0.327 0 C-N-CA 119.009 -1.076 . . . . 2.69 111.2 -178.735 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -68.88 -65.07 0.75 Allowed 'General case' 0 CA--C 1.534 0.327 0 CA-C-O 121.975 0.893 . . . . 1.99 109.632 175.835 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 12' ' ' GLU . . . . . 0.459 ' HA ' HD11 ' A' ' 15' ' ' ILE . 49.5 mt-10 -61.72 -38.04 86.41 Favored 'General case' 0 N--CA 1.455 -0.196 0 C-N-CA 126.376 1.87 . . . . 3.33 109.038 -176.236 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -62.55 -56.35 22.05 Favored Glycine 0 N--CA 1.45 -0.423 0 C-N-CA 124.701 1.143 . . . . 0.64 110.295 176.441 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 39.8 t80 -52.34 -56.42 15.0 Favored 'General case' 0 C--O 1.225 -0.197 0 CA-C-N 117.911 0.855 . . . . 3.69 110.206 -178.02 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 15' ' ' ILE . . . . . 0.459 HD11 ' HA ' ' A' ' 12' ' ' GLU . 0.7 OUTLIER -65.72 -31.93 55.92 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.21 0 O-C-N 121.761 -0.587 . . . . 0.38 112.111 -177.778 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 9.1 t60 -60.78 -54.74 41.46 Favored 'General case' 0 CA--C 1.532 0.254 0 N-CA-C 107.388 -1.338 . . . . 0.5 107.388 177.647 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 22.4 mt-10 -53.2 -39.37 63.65 Favored 'General case' 0 C--O 1.222 -0.353 0 C-N-CA 123.773 0.829 . . . . 2.14 110.639 174.977 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 5.1 t80 -58.05 -47.67 82.43 Favored 'General case' 0 CA--C 1.52 -0.182 0 C-N-CA 123.757 0.823 . . . . 2.84 110.259 -178.407 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -49.07 -48.73 31.29 Favored Glycine 0 CA--C 1.524 0.621 0 N-CA-C 110.508 -1.037 . . . . 0.43 110.508 171.068 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 5.6 t-80 -60.69 -45.53 93.84 Favored 'General case' 0 N--CA 1.451 -0.384 0 O-C-N 122.002 -0.705 . . . . 1.84 112.0 -178.4 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -66.32 -27.24 67.76 Favored 'General case' 0 N--CA 1.452 -0.354 0 O-C-N 121.606 -0.684 . . . . 0.62 110.032 -179.599 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 55.8 t -73.44 -37.83 51.7 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.185 0 C-N-CA 119.406 -0.918 . . . . 0.79 110.187 174.586 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 7.0 t0 -57.73 -31.15 66.16 Favored 'General case' 0 N--CA 1.453 -0.319 0 C-N-CA 122.718 0.407 . . . . 1.89 110.954 174.464 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 9.9 t70 -63.52 -54.82 30.35 Favored 'General case' 0 N--CA 1.457 -0.093 0 N-CA-C 108.098 -1.075 . . . . 2.03 108.098 -176.125 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 0.9 OUTLIER -54.89 -51.21 66.69 Favored 'General case' 0 N--CA 1.456 -0.168 0 CA-C-N 115.308 -0.86 . . . . 2.58 109.362 177.183 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -56.16 -40.33 73.69 Favored 'General case' 0 N--CA 1.447 -0.576 0 CA-C-O 119.1 -0.476 . . . . 1.09 111.081 -177.167 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -84.89 -14.69 69.21 Favored Glycine 0 CA--C 1.525 0.663 0 C-N-CA 123.723 0.678 . . . . 1.29 112.403 -174.977 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 1.2 t80 -74.95 -45.05 44.95 Favored 'General case' 0 N--CA 1.453 -0.291 0 CA-C-N 117.898 0.849 . . . . 2.01 108.952 174.178 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 3.2 mm? -82.64 -36.41 26.07 Favored 'General case' 0 N--CA 1.449 -0.502 0 C-N-CA 125.151 1.38 . . . . 1.64 112.658 -177.126 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 10.2 mt -124.66 124.2 41.68 Favored 'General case' 0 N--CA 1.452 -0.338 0 N-CA-C 107.172 -1.418 . . . . 2.24 107.172 -168.461 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 2.2 t70 69.33 169.86 0.3 Allowed 'General case' 0 CA--C 1.54 0.581 0 N-CA-C 109.122 -0.696 . . . . 5.08 109.122 -165.254 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 32.7 mtpt -156.11 119.75 4.37 Favored 'General case' 0 N--CA 1.463 0.177 0 N-CA-C 107.004 -1.48 . . . . 9.29 107.004 172.075 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 43.5 t-20 -152.53 174.75 13.53 Favored 'General case' 0 CA--C 1.532 0.28 0 N-CA-C 107.471 -1.307 . . . . 7.13 107.471 178.862 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 10.2 tt0 -64.5 -11.95 39.2 Favored 'General case' 0 CA--C 1.537 0.458 0 CA-C-N 119.595 1.089 . . . . 9.49 111.449 173.062 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -121.65 99.26 6.36 Favored 'General case' 0 N--CA 1.446 -0.659 0 N-CA-C 105.614 -1.995 . . . . 7.19 105.614 171.87 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 1.2 p30 -78.5 81.07 4.86 Favored 'General case' 0 C--N 1.328 -0.365 0 C-N-CA 125.664 1.585 . . . . 6.81 109.194 179.397 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 5.4 mp -141.59 140.68 33.41 Favored 'General case' 0 CA--C 1.53 0.18 0 N-CA-C 107.197 -1.409 . . . . 2.71 107.197 174.36 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 6.0 p -83.11 34.15 0.05 OUTLIER 'Isoleucine or valine' 0 CA--C 1.538 0.493 0 C-N-CA 124.553 1.141 . . . . 2.63 110.941 -177.523 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 71.7 p -115.61 79.62 1.32 Allowed 'General case' 0 N--CA 1.449 -0.489 0 O-C-N 120.54 -1.35 . . . . 4.03 108.068 -170.49 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 19.1 t-20 -173.16 -42.78 0.01 OUTLIER 'General case' 0 C--N 1.333 -0.133 0 C-N-CA 123.815 0.846 . . . . 5.88 109.712 -179.039 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 65.9 p -65.0 166.48 9.27 Favored 'General case' 0 CA--C 1.541 0.603 0 C-N-CA 126.012 1.725 . . . . 3.43 112.311 -172.577 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 56.7 mttm 49.98 82.5 0.05 Allowed 'General case' 0 N--CA 1.47 0.548 0 C-N-CA 125.98 1.712 . . . . 6.07 112.015 -168.39 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER 67.51 116.99 0.03 OUTLIER 'General case' 0 N--CA 1.468 0.475 0 C-N-CA 126.84 2.056 . . . . 6.97 108.031 -168.76 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 2.2 m-85 -47.35 109.07 0.18 Allowed 'General case' 0 CA--C 1.527 0.092 0 C-N-CA 123.755 0.822 . . . . 5.51 109.435 178.05 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 47.6 pt 44.14 72.2 0.08 OUTLIER 'Isoleucine or valine' 0 C--O 1.219 -0.517 0 C-N-CA 125.751 1.621 . . . . 2.71 111.293 176.262 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 10.2 t70 -102.07 -59.87 1.63 Allowed 'General case' 0 N--CA 1.466 0.373 0 O-C-N 120.578 -1.326 . . . . 2.56 110.451 -173.253 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 2.9 mm -51.42 -48.16 34.55 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.226 0 C-N-CA 126.911 2.084 . . . . 0.44 109.526 176.78 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 48' ' ' PHE . . . . . 0.407 ' O ' ' HA3' ' A' ' 52' ' ' GLY . 20.0 t80 -63.42 -31.92 73.21 Favored 'General case' 0 N--CA 1.45 -0.436 0 O-C-N 121.039 -1.038 . . . . 0.51 112.229 177.917 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 49' ' ' LYS . . . . . 0.51 ' HA ' ' HE2' ' A' ' 49' ' ' LYS . 10.8 mmpt? -69.97 -45.52 67.18 Favored 'General case' 0 C--N 1.33 -0.265 0 O-C-N 119.662 -1.899 . . . . 1.11 110.543 -177.954 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 7.2 mm-40 -79.95 -65.76 0.96 Allowed 'General case' 0 N--CA 1.452 -0.344 0 CA-C-O 121.901 0.858 . . . . 2.32 109.526 -176.906 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 14.0 mp0 -73.53 -28.32 61.82 Favored 'General case' 0 CA--C 1.533 0.314 0 O-C-N 121.492 -0.755 . . . . 2.65 110.64 -172.33 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 52' ' ' GLY . . . . . 0.407 ' HA3' ' O ' ' A' ' 48' ' ' PHE . . . -68.99 33.5 0.29 Allowed Glycine 0 CA--C 1.533 1.158 0 C-N-CA 124.944 1.259 . . . . 0.34 114.498 168.285 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 32.6 t -149.61 44.16 0.93 Allowed 'General case' 0 N--CA 1.447 -0.58 0 O-C-N 120.79 -1.418 . . . . 1.58 107.56 158.84 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -148.48 -42.41 0.16 Allowed 'General case' 0 CA--C 1.516 -0.334 0 N-CA-C 114.003 1.112 . . . . 2.1 114.003 -176.078 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 19.0 mt -61.89 -38.69 89.27 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-O 120.954 0.407 . . . . 0.41 110.778 -176.737 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 1.2 t 178.63 172.76 0.73 Allowed 'General case' 0 CA--C 1.531 0.236 0 C-N-CA 125.41 1.484 . . . . 0.48 107.678 -176.325 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 10.7 m -60.86 -34.66 74.94 Favored 'General case' 0 N--CA 1.453 -0.303 0 O-C-N 121.671 -0.643 . . . . 0.96 110.408 168.45 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 1.6 m-85 -67.5 -10.82 55.25 Favored 'General case' 0 N--CA 1.464 0.242 0 N-CA-C 112.332 0.493 . . . . 1.45 112.332 173.831 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -83.1 -9.37 84.25 Favored Glycine 0 N--CA 1.443 -0.879 0 N-CA-C 110.825 -0.91 . . . . 0.39 110.825 173.775 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 3.4 tmt_? -120.96 -6.39 9.54 Favored 'General case' 0 CA--C 1.526 0.03 0 CA-C-N 118.994 1.397 . . . . 2.55 112.767 -173.81 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 19.5 p -67.56 -145.32 0.01 OUTLIER 'General case' 0 CA--C 1.54 0.575 0 C-N-CA 124.689 1.196 . . . . 0.75 108.947 169.277 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 32.5 m-80 -62.36 148.75 44.27 Favored 'General case' 0 N--CA 1.456 -0.158 0 O-C-N 119.318 -2.114 . . . . 2.21 109.261 178.269 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 58.2 tt0 -60.37 -27.86 67.74 Favored 'General case' 0 CA--C 1.537 0.449 0 CA-C-O 121.819 0.819 . . . . 2.78 111.065 -179.565 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -59.32 -40.92 87.79 Favored 'General case' 0 N--CA 1.452 -0.362 0 C-N-CA 124.643 1.177 . . . . 0.5 112.507 171.564 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 10.4 mt-10 -70.41 -47.09 62.42 Favored 'General case' 0 N--CA 1.446 -0.631 0 CA-C-O 118.211 -0.899 . . . . 2.04 109.828 176.927 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 48.7 t80 -45.86 -51.92 12.21 Favored 'General case' 0 N--CA 1.454 -0.249 0 C-N-CA 124.042 0.937 . . . . 0.34 111.576 175.23 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 60.1 t80 -65.11 -43.81 90.81 Favored 'General case' 0 CA--C 1.538 0.5 0 O-C-N 121.426 -0.796 . . . . 0.38 110.98 178.27 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -62.73 -53.89 47.47 Favored 'General case' 0 CA--C 1.541 0.611 0 O-C-N 121.023 -1.048 . . . . 0.28 113.156 -176.23 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -57.78 -40.15 79.14 Favored 'General case' 0 C--N 1.332 -0.154 0 O-C-N 120.435 -1.416 . . . . 3.83 110.738 171.388 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -56.76 -39.41 73.95 Favored 'General case' 0 N--CA 1.451 -0.378 0 CA-C-O 118.282 -0.866 . . . . 0.46 110.951 176.899 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 58.6 t80 -57.61 -49.82 75.18 Favored 'General case' 0 N--CA 1.465 0.299 0 CA-C-N 120.195 1.361 . . . . 3.85 111.05 172.375 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 38.0 ttp85 -49.5 -57.7 6.55 Favored 'General case' 0 C--N 1.341 0.218 0 N-CA-C 109.235 -0.654 . . . . 3.27 109.235 178.256 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 73' ' ' LEU . . . . . 0.592 ' HB3' HG21 ' A' ' 85' ' ' VAL . 0.1 OUTLIER -64.09 -29.6 70.72 Favored 'General case' 0 N--CA 1.451 -0.409 0 C-N-CA 124.34 1.056 . . . . 0.5 110.834 -174.704 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 1.4 ttp -60.7 -41.44 95.19 Favored 'General case' 0 C--O 1.234 0.271 0 C-N-CA 123.042 0.537 . . . . 2.4 110.116 -179.582 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 75' ' ' HIS . . . . . 0.419 ' CE1' HD12 ' A' ' 15' ' ' ILE . 5.8 p80 -97.48 -9.79 26.53 Favored 'General case' 0 N--CA 1.454 -0.266 0 CA-C-O 116.238 -1.839 . . . . 0.88 113.97 -177.598 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 8.0 m -36.19 123.78 0.75 Allowed 'General case' 0 CA--C 1.516 -0.363 0 CA-C-N 120.363 1.438 . . . . 1.08 111.505 -169.026 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 2.1 p -48.95 -42.82 38.75 Favored 'General case' 0 N--CA 1.45 -0.467 0 CA-C-N 113.318 -1.765 . . . . 1.07 109.068 -179.791 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 14.9 t0 -70.52 104.19 2.7 Favored 'General case' 0 N--CA 1.445 -0.705 0 CA-C-O 122.439 1.114 . . . . 1.78 109.764 165.879 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 18.1 p-80 -45.39 -38.84 6.29 Favored 'General case' 0 N--CA 1.453 -0.284 0 CA-C-N 115.064 -0.971 . . . . 4.34 112.763 170.909 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -63.35 -44.64 94.26 Favored 'General case' 0 N--CA 1.451 -0.391 0 O-C-N 121.537 -0.727 . . . . 0.71 110.179 -177.82 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 1.8 tt0 -47.61 -43.16 25.54 Favored 'General case' 0 C--O 1.231 0.127 0 C-N-CA 123.948 0.899 . . . . 2.76 110.389 175.185 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 4.5 mtp180 -62.79 -51.0 68.78 Favored 'General case' 0 CA--C 1.516 -0.359 0 N-CA-C 108.774 -0.824 . . . . 2.7 108.774 -179.405 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 1.6 mm? -63.68 -18.62 64.17 Favored 'General case' 0 N--CA 1.455 -0.211 0 CA-C-O 118.194 -0.907 . . . . 0.45 113.355 176.664 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 1.9 mptm? -65.93 -47.46 74.65 Favored 'General case' 0 CA--C 1.521 -0.164 0 CA-C-N 120.856 1.662 . . . . 1.8 107.998 169.234 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 85' ' ' VAL . . . . . 0.592 HG21 ' HB3' ' A' ' 73' ' ' LEU . 84.8 t -60.58 -59.07 4.74 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.6 0 CA-C-O 118.401 -0.809 . . . . 0.45 110.206 175.19 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -52.69 -48.62 66.42 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 120.075 1.307 . . . . 2.32 111.959 -175.803 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 18.5 pttt -65.19 -41.07 94.91 Favored 'General case' 0 CA--C 1.533 0.32 0 O-C-N 120.931 -1.106 . . . . 2.66 110.676 -177.975 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 37.8 m-20 -74.81 -20.68 59.67 Favored 'General case' 0 CA--C 1.534 0.335 0 C-N-CA 122.712 0.405 . . . . 0.91 111.013 -179.208 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -157.43 67.11 3.88 Favored Pre-proline 0 N--CA 1.45 -0.459 0 C-N-CA 125.932 1.693 . . . . 0.5 108.959 -163.549 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 25.4 Cg_endo -60.33 -28.84 87.6 Favored 'Trans proline' 0 N--CA 1.455 -0.786 0 C-N-CA 122.255 1.97 . . . . 2.56 110.919 -173.486 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -89.31 -43.8 10.69 Favored 'General case' 0 N--CA 1.451 -0.387 0 C-N-CA 126.215 1.806 . . . . 2.25 111.941 -174.561 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 4.9 m -56.86 -44.52 82.26 Favored 'General case' 0 N--CA 1.465 0.28 0 CA-C-N 120.168 1.349 . . . . 0.39 110.909 178.791 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 13.5 t80 -55.39 -49.42 72.39 Favored 'General case' 0 CA--C 1.512 -0.498 0 C-N-CA 120.123 -0.631 . . . . 1.84 110.631 176.008 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 9.8 tt0 -59.22 -30.09 67.98 Favored 'General case' 0 N--CA 1.445 -0.693 0 CA-C-N 115.594 -0.73 . . . . 2.23 110.894 -179.508 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 4.6 t80 -61.46 -57.86 10.47 Favored 'General case' 0 C--O 1.231 0.12 0 C-N-CA 123.781 0.833 . . . . 1.16 109.047 -176.687 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 3.4 mp -58.45 -42.48 84.39 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.254 0 N-CA-C 108.681 -0.859 . . . . 0.88 108.681 175.983 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -57.44 -35.69 70.44 Favored 'General case' 0 CA--C 1.532 0.266 0 CA-C-N 118.445 0.566 . . . . 1.97 111.515 -177.73 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -70.31 -39.88 74.53 Favored 'General case' 0 CA--C 1.532 0.253 0 C-N-CA 123.509 0.724 . . . . 2.09 109.416 179.263 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 7.6 mm-40 -65.19 -60.48 2.96 Favored 'General case' 0 CA--C 1.535 0.393 0 C-N-CA 124.413 1.085 . . . . 3.15 112.428 179.601 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 1.2 pt -70.45 86.84 0.27 Allowed 'Isoleucine or valine' 0 CA--C 1.527 0.074 0 O-C-N 121.478 -0.764 . . . . 6.01 111.135 -172.034 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 8.5 tttt -134.05 109.42 8.95 Favored 'General case' 0 N--CA 1.45 -0.457 0 N-CA-C 107.738 -1.208 . . . . 10.5 107.738 -171.991 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 102' ' ' PHE . . . . . . . . . . . . . 30.6 p90 42.1 29.92 0.16 Allowed 'General case' 0 CA--C 1.537 0.462 0 C-N-CA 126.16 1.784 . . . . 8.48 113.609 -177.754 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 11.2 tp -97.85 65.18 0.31 Allowed 'Isoleucine or valine' 0 N--CA 1.454 -0.238 0 CA-C-O 122.073 0.94 . . . . 5.37 108.719 -170.933 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 104' ' ' ILE . . . . . . . . . . . . . 39.3 pt -131.06 154.67 41.08 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.134 0 N-CA-C 109.042 -0.725 . . . . 8.93 109.042 -177.698 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 16.3 t-20 -153.55 116.85 4.6 Favored 'General case' 0 N--CA 1.451 -0.384 0 N-CA-C 107.155 -1.424 . . . . 7.41 107.155 175.088 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 14.1 p . . . . . 0 C--O 1.247 0.921 0 N-CA-C 106.871 -1.529 . . . . 9.1 106.871 -179.162 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.468 0.797 0 N-CA-C 109.586 -1.405 . . . . 17.73 109.586 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 2.7 p -65.88 148.38 51.87 Favored 'General case' 0 N--CA 1.451 -0.409 0 C-N-CA 124.755 1.222 . . . . 17.04 111.911 -173.487 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 5.2 ptpt -171.06 170.8 6.05 Favored 'General case' 0 N--CA 1.465 0.305 0 C-N-CA 125.77 1.628 . . . . 21.57 108.032 166.058 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 148.73 177.08 22.65 Favored Glycine 0 C--N 1.332 0.358 0 N-CA-C 110.111 -1.196 . . . . 15.83 110.111 172.878 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 21.6 m -83.91 -160.27 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.445 -0.715 0 N-CA-C 108.912 -0.773 . . . . 16.89 108.912 170.952 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 10.6 pt-20 -85.25 115.44 23.03 Favored 'General case' 0 N--CA 1.446 -0.64 0 CA-C-O 122.575 1.179 . . . . 12.34 110.958 173.297 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 7' ' ' LEU . . . . . 0.459 HD22 ' H ' ' A' ' 7' ' ' LEU . 0.0 OUTLIER -146.99 50.6 1.1 Allowed 'General case' 0 N--CA 1.447 -0.596 0 C-N-CA 126.199 1.799 . . . . 10.95 107.461 173.687 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 38.5 mtp180 53.86 39.75 30.75 Favored 'General case' 0 C--O 1.226 -0.182 0 C-N-CA 124.133 0.973 . . . . 6.37 111.996 -174.9 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 3.3 m-20 -52.8 -31.6 39.55 Favored 'General case' 0 C--O 1.219 -0.53 0 N-CA-C 112.374 0.509 . . . . 4.26 112.374 -179.108 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 2.6 t70 -62.46 -55.69 25.2 Favored 'General case' 0 C--N 1.324 -0.533 0 C-N-CA 123.058 0.543 . . . . 2.34 111.27 175.199 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 12.1 t -71.05 -48.95 49.88 Favored 'General case' 0 C--N 1.33 -0.248 0 N-CA-C 109.338 -0.616 . . . . 1.9 109.338 -171.651 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -67.39 -34.35 77.1 Favored 'General case' 0 C--O 1.221 -0.436 0 N-CA-C 107.957 -1.127 . . . . 5.86 107.957 179.661 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -60.35 -46.42 94.34 Favored Glycine 0 C--O 1.22 -0.724 0 N-CA-C 109.711 -1.355 . . . . 1.17 109.711 178.866 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -57.56 -57.48 12.5 Favored 'General case' 0 N--CA 1.454 -0.271 0 CA-C-N 118.422 1.111 . . . . 3.03 110.312 -177.174 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 15' ' ' ILE . . . . . 0.456 HD12 ' CE1' ' A' ' 75' ' ' HIS . 0.4 OUTLIER -66.91 -31.59 54.14 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.336 0 O-C-N 121.265 -0.897 . . . . 0.67 111.849 -176.933 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 2.5 t-160 -63.32 -57.64 9.74 Favored 'General case' 0 N--CA 1.45 -0.46 0 N-CA-C 106.878 -1.527 . . . . 0.77 106.878 -179.411 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 42.4 mt-10 -57.88 -32.51 67.77 Favored 'General case' 0 N--CA 1.446 -0.641 0 C-N-CA 124.573 1.149 . . . . 2.96 110.552 177.408 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 4.3 t80 -55.95 -49.75 72.67 Favored 'General case' 0 C--N 1.332 -0.161 0 CA-C-N 120.388 1.449 . . . . 3.21 110.02 174.481 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -51.95 -47.11 54.74 Favored Glycine 0 CA--C 1.526 0.749 0 N-CA-C 111.308 -0.717 . . . . 0.76 111.308 173.499 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 3.4 t-80 -65.89 -50.66 63.68 Favored 'General case' 0 N--CA 1.452 -0.348 0 O-C-N 121.608 -0.936 . . . . 1.96 111.69 -174.374 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -57.54 -31.2 65.86 Favored 'General case' 0 N--CA 1.446 -0.647 0 C-N-CA 124.672 1.189 . . . . 0.68 109.624 -179.184 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 71.4 t -67.69 -45.84 83.9 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.238 0 C-N-CA 118.663 -1.215 . . . . 1.05 110.944 173.439 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 2.2 t70 -59.77 -28.27 67.26 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 121.136 0.494 . . . . 2.18 111.57 175.217 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 24' ' ' ASP . . . . . 0.55 ' HA ' HD13 ' A' ' 37' ' ' LEU . 11.2 t70 -74.45 -50.26 19.1 Favored 'General case' 0 N--CA 1.452 -0.367 0 N-CA-C 108.061 -1.089 . . . . 2.22 108.061 -172.805 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 26.5 t80 -59.12 -49.88 76.17 Favored 'General case' 0 N--CA 1.448 -0.529 0 CA-C-N 115.388 -0.824 . . . . 2.65 108.99 177.553 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -51.65 -40.06 59.29 Favored 'General case' 0 N--CA 1.45 -0.475 0 CA-C-O 119.213 -0.422 . . . . 1.33 111.129 173.814 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -75.74 -25.01 68.35 Favored Glycine 0 CA--C 1.524 0.599 0 CA-C-N 118.909 0.777 . . . . 1.77 113.448 -176.265 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 1.4 t80 -82.33 -39.95 22.11 Favored 'General case' 0 N--CA 1.455 -0.176 0 CA-C-N 118.342 1.071 . . . . 3.04 109.661 178.09 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -80.71 -30.63 36.28 Favored 'General case' 0 N--CA 1.452 -0.363 0 C-N-CA 124.405 1.082 . . . . 2.54 112.932 -177.411 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 9.1 mt -123.36 132.68 54.05 Favored 'General case' 0 N--CA 1.449 -0.478 0 N-CA-C 106.654 -1.61 . . . . 2.37 106.654 -170.248 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 1.7 t70 66.63 -155.2 0.24 Allowed 'General case' 0 CA--C 1.536 0.44 0 N-CA-C 109.087 -0.709 . . . . 4.55 109.087 -169.614 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 9.7 tmtt? -148.7 175.01 11.57 Favored 'General case' 0 C--O 1.227 -0.109 0 N-CA-C 107.472 -1.307 . . . . 11.96 107.472 172.223 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 54.1 t30 -62.53 101.52 0.25 Allowed 'General case' 0 N--CA 1.454 -0.26 0 O-C-N 121.187 -0.945 . . . . 8.86 109.766 178.211 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -130.62 -38.93 1.29 Allowed 'General case' 0 CA--C 1.53 0.179 0 C-N-CA 125.321 1.449 . . . . 7.97 109.964 -176.935 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 5.7 t -132.73 -85.13 0.47 Allowed 'General case' 0 N--CA 1.454 -0.267 0 N-CA-C 108.467 -0.938 . . . . 6.9 108.467 177.737 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 68.4 t0 -151.15 109.0 3.68 Favored 'General case' 0 C--O 1.226 -0.172 0 N-CA-C 106.278 -1.749 . . . . 7.62 106.278 176.233 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 37' ' ' LEU . . . . . 0.55 HD13 ' HA ' ' A' ' 24' ' ' ASP . 46.2 mt 43.38 -141.83 0.16 Allowed 'General case' 0 CA--C 1.543 0.71 0 C-N-CA 125.146 1.378 . . . . 3.78 112.573 178.066 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 5.5 p -85.41 -39.22 13.73 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.289 0 CA-C-N 119.41 1.005 . . . . 2.72 109.861 178.38 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 11.5 p 40.56 -166.82 0.0 OUTLIER 'General case' 0 CA--C 1.537 0.473 0 C-N-CA 128.567 2.747 . . . . 3.6 113.988 -176.516 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 8.2 t30 -74.7 88.13 2.21 Favored 'General case' 0 N--CA 1.453 -0.293 0 O-C-N 120.133 -1.604 . . . . 7.08 109.623 179.053 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 1.3 p -97.77 23.48 7.87 Favored 'General case' 0 N--CA 1.447 -0.603 0 CA-C-N 114.198 -1.365 . . . . 3.4 110.583 179.368 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 11.5 tttt -82.72 -77.4 0.24 Allowed 'General case' 0 C--N 1.344 0.328 0 O-C-N 120.966 -1.083 . . . . 8.28 110.895 -177.934 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -97.3 5.47 49.9 Favored 'General case' 0 CA--C 1.532 0.284 0 O-C-N 121.285 -0.884 . . . . 6.88 110.563 -177.952 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER 85.1 86.95 0.02 OUTLIER 'General case' 0 C--N 1.342 0.251 0 C-N-CA 126.95 2.1 . . . . 4.79 108.287 172.625 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 14.5 tt 38.39 70.54 0.07 OUTLIER 'Isoleucine or valine' 0 CA--C 1.539 0.556 0 C-N-CA 125.953 1.701 . . . . 2.49 112.49 -177.966 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 19.7 t70 -131.78 -60.65 0.92 Allowed 'General case' 0 N--CA 1.464 0.26 0 C-N-CA 124.209 1.004 . . . . 2.14 110.367 -163.85 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 2.3 mm -45.52 -49.04 4.0 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.546 0 CA-C-O 122.749 1.262 . . . . 0.62 109.671 169.277 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 28.7 t80 -65.76 -28.36 68.97 Favored 'General case' 0 N--CA 1.452 -0.356 0 O-C-N 120.397 -1.439 . . . . 0.45 112.386 -179.754 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 49' ' ' LYS . . . . . 0.458 ' HA ' ' HE2' ' A' ' 49' ' ' LYS . 0.6 OUTLIER -65.04 -55.29 19.78 Favored 'General case' 0 N--CA 1.454 -0.263 0 O-C-N 120.049 -1.657 . . . . 0.92 109.801 174.764 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 6.4 mm-40 -74.0 -70.74 0.37 Allowed 'General case' 0 N--CA 1.451 -0.421 0 N-CA-C 108.687 -0.857 . . . . 2.24 108.687 -173.337 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 51' ' ' GLU . . . . . 0.546 ' OE2' ' HE2' ' A' ' 91' ' ' LYS . 18.5 mp0 -70.21 -31.36 68.75 Favored 'General case' 0 C--O 1.235 0.32 0 O-C-N 121.544 -0.722 . . . . 2.56 110.693 -171.577 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 52' ' ' GLY . . . . . 0.451 ' HA2' ' CD1' ' A' ' 66' ' ' PHE . . . -69.92 35.96 0.39 Allowed Glycine 0 CA--C 1.53 1.0 0 C-N-CA 124.59 1.09 . . . . 0.3 114.155 170.341 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 33.2 p -142.39 20.14 2.05 Favored 'General case' 0 N--CA 1.449 -0.517 0 O-C-N 120.81 -1.406 . . . . 2.01 111.535 157.915 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -134.04 -35.16 0.96 Allowed 'General case' 0 C--N 1.342 0.24 0 N-CA-C 112.871 0.693 . . . . 2.58 112.871 -171.629 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 29.4 mt -61.89 -39.18 91.06 Favored 'General case' 0 N--CA 1.465 0.293 0 CA-C-N 119.302 0.955 . . . . 0.41 110.927 -175.817 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 1.2 t 178.2 173.65 0.62 Allowed 'General case' 0 CA--C 1.531 0.233 0 C-N-CA 125.463 1.505 . . . . 0.5 107.564 -179.146 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 14.7 m -58.64 -36.39 74.02 Favored 'General case' 0 N--CA 1.453 -0.306 0 O-C-N 121.712 -0.617 . . . . 0.92 110.819 168.526 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -68.54 -12.43 61.26 Favored 'General case' 0 N--CA 1.467 0.381 0 CA-C-N 118.401 0.546 . . . . 1.02 112.191 175.001 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -86.45 -4.98 82.82 Favored Glycine 0 N--CA 1.444 -0.783 0 CA-C-O 118.596 -1.113 . . . . 0.36 110.927 173.047 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -120.4 1.95 10.74 Favored 'General case' 0 CA--C 1.529 0.169 0 CA-C-N 119.402 1.601 . . . . 3.16 112.129 -178.447 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 14.9 p -76.18 -145.99 0.03 OUTLIER 'General case' 0 CA--C 1.539 0.543 0 N-CA-C 108.605 -0.887 . . . . 0.79 108.605 170.759 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 1.6 m120 -58.16 149.57 23.53 Favored 'General case' 0 C--N 1.34 0.19 0 CA-C-N 120.532 1.515 . . . . 1.75 109.087 177.224 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -58.55 -34.42 71.0 Favored 'General case' 0 CA--C 1.533 0.317 0 CA-C-O 121.739 0.78 . . . . 2.89 110.366 178.479 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -59.31 -34.0 71.78 Favored 'General case' 0 N--CA 1.451 -0.42 0 O-C-N 121.536 -0.728 . . . . 0.52 112.922 175.277 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 12.5 mt-10 -74.19 -42.62 59.54 Favored 'General case' 0 N--CA 1.45 -0.427 0 O-C-N 121.278 -0.889 . . . . 1.85 110.408 174.932 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 66' ' ' PHE . . . . . 0.451 ' CD1' ' HA2' ' A' ' 52' ' ' GLY . 57.9 t80 -49.91 -50.45 46.1 Favored 'General case' 0 N--CA 1.455 -0.206 0 C-N-CA 123.173 0.589 . . . . 0.47 111.115 173.709 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 76.3 t80 -63.42 -42.44 98.72 Favored 'General case' 0 CA--C 1.537 0.448 0 O-C-N 121.589 -0.694 . . . . 0.6 111.28 178.291 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -70.97 -39.55 72.47 Favored 'General case' 0 CA--C 1.535 0.396 0 O-C-N 121.095 -1.003 . . . . 0.42 111.802 -172.616 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -76.71 -31.72 57.37 Favored 'General case' 0 N--CA 1.449 -0.484 0 O-C-N 121.281 -0.887 . . . . 3.27 109.232 179.121 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -55.02 -47.28 74.92 Favored 'General case' 0 C--O 1.222 -0.355 0 O-C-N 121.684 -0.635 . . . . 0.5 109.394 167.944 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -50.47 -47.41 57.03 Favored 'General case' 0 N--CA 1.468 0.442 0 CA-C-N 119.289 0.95 . . . . 3.54 112.212 172.098 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 49.5 ttp85 -53.35 -52.17 60.1 Favored 'General case' 0 CA--C 1.534 0.345 0 CA-C-N 118.71 0.687 . . . . 3.03 109.95 176.659 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 73' ' ' LEU . . . . . 0.576 ' CB ' HG21 ' A' ' 85' ' ' VAL . 0.2 OUTLIER -71.44 -25.36 62.28 Favored 'General case' 0 C--N 1.327 -0.372 0 C-N-CA 123.88 0.872 . . . . 0.59 111.717 -173.888 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 38.9 mmm -62.16 -39.74 93.67 Favored 'General case' 0 C--O 1.234 0.265 0 C-N-CA 124.751 1.22 . . . . 3.09 110.537 178.829 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 75' ' ' HIS . . . . . 0.456 ' CE1' HD12 ' A' ' 15' ' ' ILE . 8.7 p80 -96.87 -8.56 30.58 Favored 'General case' 0 N--CA 1.455 -0.185 0 CA-C-O 116.24 -1.838 . . . . 1.14 113.151 -177.857 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 3.2 m -33.71 119.74 0.39 Allowed 'General case' 0 C--N 1.344 0.343 0 C-N-CA 124.763 1.225 . . . . 1.19 111.089 -170.476 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 1.3 p -51.02 -42.26 60.32 Favored 'General case' 0 N--CA 1.45 -0.43 0 CA-C-N 113.481 -1.691 . . . . 1.21 108.863 -177.938 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 78' ' ' ASP . . . . . 0.483 ' OD2' ' HB3' ' A' ' 80' ' ' ALA . 12.6 t0 -71.4 110.06 5.78 Favored 'General case' 0 N--CA 1.447 -0.613 0 CA-C-O 121.998 0.904 . . . . 1.91 109.344 164.578 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 6.9 p80 -50.41 -37.43 37.76 Favored 'General case' 0 N--CA 1.452 -0.347 0 CA-C-N 115.867 -0.606 . . . . 4.55 111.866 172.719 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 80' ' ' ALA . . . . . 0.483 ' HB3' ' OD2' ' A' ' 78' ' ' ASP . . . -60.17 -47.73 84.69 Favored 'General case' 0 N--CA 1.454 -0.255 0 CA-C-N 118.413 0.551 . . . . 0.83 110.224 -177.327 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 13.6 mt-10 -47.95 -41.29 24.59 Favored 'General case' 0 N--CA 1.453 -0.278 0 C-N-CA 124.057 0.943 . . . . 2.87 111.212 175.748 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 4.2 mtp180 -63.4 -48.16 79.01 Favored 'General case' 0 C--N 1.329 -0.317 0 N-CA-C 108.968 -0.753 . . . . 2.62 108.968 178.623 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 1.5 mm? -62.37 -23.71 66.96 Favored 'General case' 0 N--CA 1.452 -0.334 0 CA-C-O 117.513 -1.232 . . . . 0.67 112.932 175.88 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -63.42 -43.19 98.17 Favored 'General case' 0 N--CA 1.462 0.156 0 CA-C-N 121.678 2.035 . . . . 1.51 108.122 171.407 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 85' ' ' VAL . . . . . 0.576 HG21 ' CB ' ' A' ' 73' ' ' LEU . 86.5 t -62.22 -62.29 1.22 Allowed 'Isoleucine or valine' 0 C--O 1.218 -0.579 0 CA-C-O 117.405 -1.283 . . . . 0.59 110.629 173.696 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 1.9 mt-30 -48.86 -49.78 37.87 Favored 'General case' 0 N--CA 1.464 0.264 0 CA-C-N 120.946 1.703 . . . . 1.95 111.464 -175.628 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 51.9 tttt -55.41 -51.78 65.74 Favored 'General case' 0 N--CA 1.445 -0.707 0 C-N-CA 123.422 0.689 . . . . 2.14 111.138 178.769 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 85.7 m-20 -80.39 -5.79 57.01 Favored 'General case' 0 CA--C 1.531 0.239 0 CA-C-O 119.481 -0.295 . . . . 1.13 111.703 -176.722 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -163.92 68.0 1.57 Allowed Pre-proline 0 N--CA 1.448 -0.545 0 C-N-CA 124.223 1.009 . . . . 0.38 110.418 -167.364 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 59.5 Cg_endo -70.57 0.33 6.41 Favored 'Trans proline' 0 N--CA 1.457 -0.648 0 C-N-CA 123.057 2.504 . . . . 1.7 112.76 -174.629 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 91' ' ' LYS . . . . . 0.546 ' HE2' ' OE2' ' A' ' 51' ' ' GLU . 0.4 OUTLIER -115.81 -41.97 3.15 Favored 'General case' 0 N--CA 1.453 -0.315 0 C-N-CA 125.248 1.419 . . . . 2.95 110.15 -178.812 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 2.5 m -57.6 -44.77 85.66 Favored 'General case' 0 C--O 1.226 -0.14 0 CA-C-N 119.591 1.087 . . . . 0.49 110.74 174.66 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 9.0 t80 -60.64 -48.33 82.28 Favored 'General case' 0 CA--C 1.511 -0.556 0 CA-C-O 121.75 0.786 . . . . 1.96 110.655 179.526 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 30.3 tt0 -54.93 -34.52 63.28 Favored 'General case' 0 N--CA 1.44 -0.936 0 CA-C-N 114.762 -1.108 . . . . 1.57 110.369 177.313 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 5.5 t80 -59.82 -59.65 5.1 Favored 'General case' 0 N--CA 1.454 -0.235 0 C-N-CA 124.363 1.065 . . . . 1.0 110.573 -174.157 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 3.7 mp -60.81 -38.54 79.21 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.231 0 N-CA-C 109.04 -0.726 . . . . 0.91 109.04 176.653 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 4.3 t30 -60.46 -28.67 68.5 Favored 'General case' 0 CA--C 1.533 0.291 0 O-C-N 121.781 -0.575 . . . . 1.41 111.66 -178.965 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -68.92 -57.51 5.41 Favored 'General case' 0 N--CA 1.456 -0.146 0 C-N-CA 124.725 1.21 . . . . 2.21 109.076 174.976 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 32.4 mm-40 -80.44 89.42 5.6 Favored 'General case' 0 N--CA 1.451 -0.421 0 CA-C-O 121.378 0.608 . . . . 2.79 110.521 -177.033 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -51.28 139.76 6.48 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.42 0 CA-C-O 121.829 0.823 . . . . 5.18 112.386 -179.874 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -87.69 119.1 27.68 Favored 'General case' 0 N--CA 1.455 -0.184 0 O-C-N 121.279 -0.888 . . . . 11.21 109.759 -176.648 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 102' ' ' PHE . . . . . . . . . . . . . 4.5 t80 -153.83 99.71 2.3 Favored 'General case' 0 N--CA 1.454 -0.251 0 N-CA-C 107.646 -1.242 . . . . 6.6 107.646 173.266 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -145.69 130.13 11.86 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.287 0 N-CA-C 106.692 -1.596 . . . . 4.33 106.692 179.981 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 104' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER 59.46 175.48 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.535 0.4 0 C-N-CA 124.687 1.195 . . . . 6.84 110.876 -171.563 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -155.5 174.25 15.52 Favored 'General case' 0 C--N 1.331 -0.215 0 N-CA-C 107.261 -1.385 . . . . 7.08 107.261 162.235 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 16.4 m . . . . . 0 C--O 1.252 1.196 0 CA-C-O 117.18 -1.391 . . . . 9.28 109.3 168.216 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.469 0.866 0 N-CA-C 108.363 -1.895 . . . . 11.29 108.363 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -135.16 168.06 19.84 Favored 'General case' 0 C--N 1.332 -0.191 0 C-N-CA 124.481 1.113 . . . . 11.82 109.585 -163.242 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -166.16 158.04 13.95 Favored 'General case' 0 N--CA 1.463 0.209 0 N-CA-C 109.658 -0.497 . . . . 14.41 109.658 175.672 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 101.8 -158.39 18.5 Favored Glycine 0 C--N 1.331 0.298 0 N-CA-C 110.125 -1.19 . . . . 11.67 110.125 176.177 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 27.7 m -84.78 -158.71 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.442 -0.833 0 N-CA-C 107.753 -1.202 . . . . 12.22 107.753 163.822 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 11.3 pt-20 -99.69 119.11 37.59 Favored 'General case' 0 N--CA 1.445 -0.681 0 CA-C-O 121.998 0.904 . . . . 9.18 111.25 174.426 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 1.9 mm? -108.71 36.5 2.83 Favored 'General case' 0 N--CA 1.454 -0.271 0 C-N-CA 124.062 0.945 . . . . 7.63 109.46 -177.89 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 4.3 mmm-85 67.78 -77.57 0.05 OUTLIER 'General case' 0 N--CA 1.465 0.321 0 N-CA-C 108.263 -1.014 . . . . 7.93 108.263 -168.314 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 3.6 m-20 -44.52 -42.04 6.9 Favored 'General case' 0 C--O 1.224 -0.255 0 C-N-CA 125.5 1.52 . . . . 2.83 112.682 178.014 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 22.5 t70 -66.85 -46.13 76.02 Favored 'General case' 0 C--O 1.224 -0.274 0 C-N-CA 119.635 -0.826 . . . . 2.32 111.184 -179.934 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -64.13 -56.44 14.84 Favored 'General case' 0 C--O 1.233 0.225 0 CA-C-O 122.334 1.064 . . . . 1.57 110.041 -177.041 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 12' ' ' GLU . . . . . 0.41 ' HA ' HD11 ' A' ' 15' ' ' ILE . 9.2 pt-20 -69.31 -28.97 66.73 Favored 'General case' 0 N--CA 1.453 -0.322 0 C-N-CA 123.75 0.82 . . . . 3.1 109.821 -175.998 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -61.91 -45.79 95.44 Favored Glycine 0 CA--C 1.525 0.686 0 C-N-CA 124.287 0.946 . . . . 0.79 110.969 169.278 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -59.51 -55.37 35.47 Favored 'General case' 0 C--N 1.333 -0.117 0 CA-C-N 118.011 0.905 . . . . 3.38 109.081 -174.465 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 15' ' ' ILE . . . . . 0.41 HD11 ' HA ' ' A' ' 12' ' ' GLU . 0.4 OUTLIER -67.71 -27.69 39.0 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.25 0 O-C-N 121.656 -0.652 . . . . 0.49 111.588 179.316 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 6.6 t60 -60.79 -47.9 84.24 Favored 'General case' 0 CA--C 1.534 0.351 0 N-CA-C 107.369 -1.345 . . . . 0.68 107.369 175.36 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 32.7 mt-10 -59.42 -40.7 87.55 Favored 'General case' 0 CA--C 1.528 0.111 0 O-C-N 121.254 -0.904 . . . . 2.03 111.186 177.439 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 2.4 m-85 -50.73 -47.33 59.31 Favored 'General case' 0 CA--C 1.519 -0.229 0 CA-C-N 118.938 0.79 . . . . 3.44 110.764 173.478 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -48.81 -43.68 30.35 Favored Glycine 0 CA--C 1.533 1.192 0 CA-C-N 118.352 0.524 . . . . 0.79 111.88 176.71 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 58.0 m-70 -62.12 -49.52 75.56 Favored 'General case' 0 C--O 1.226 -0.169 0 O-C-N 121.435 -1.038 . . . . 3.56 111.768 174.481 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -59.17 -27.39 65.64 Favored 'General case' 0 CA--C 1.533 0.319 0 O-C-N 122.043 -0.41 . . . . 0.58 111.214 -178.758 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 71.4 t -68.07 -42.96 85.57 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.19 0 O-C-N 121.029 -1.044 . . . . 1.06 110.477 175.311 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 4.3 m-20 -61.22 -20.28 62.62 Favored 'General case' 0 N--CA 1.462 0.17 0 N-CA-C 111.747 0.277 . . . . 1.96 111.747 173.489 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 12.1 t70 -71.97 -54.52 9.7 Favored 'General case' 0 N--CA 1.452 -0.355 0 N-CA-C 108.778 -0.823 . . . . 2.1 108.778 -178.798 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 18.1 t80 -64.34 -51.26 64.23 Favored 'General case' 0 CA--C 1.52 -0.207 0 CA-C-N 116.472 -0.331 . . . . 2.59 110.513 -178.236 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 26' ' ' ALA . . . . . 0.683 ' HB3' HG11 ' A' ' 38' ' ' VAL . . . -56.58 -31.31 64.12 Favored 'General case' 0 N--CA 1.452 -0.352 0 CA-C-O 118.269 -0.872 . . . . 0.97 111.185 175.356 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -60.86 -66.42 2.7 Favored Glycine 0 CA--C 1.524 0.616 0 CA-C-N 119.166 0.894 . . . . 1.43 111.506 172.625 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 1.2 t80 -54.69 -35.41 63.58 Favored 'General case' 0 CA--C 1.535 0.367 0 O-C-N 122.029 -0.689 . . . . 2.24 111.511 -171.09 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -85.33 -30.49 23.66 Favored 'General case' 0 N--CA 1.449 -0.494 0 N-CA-C 113.92 1.082 . . . . 1.46 113.92 -179.87 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 10.8 mt -127.14 111.37 13.92 Favored 'General case' 0 C--O 1.221 -0.4 0 CA-C-N 119.823 1.192 . . . . 1.91 108.354 -167.672 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . 0.41 0.4 OUTLIER 79.28 -165.4 0.03 OUTLIER 'General case' 0 CA--C 1.539 0.526 0 C-N-CA 124.81 1.244 . . . . 4.35 108.853 -162.387 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 179.71 -25.6 0.0 OUTLIER 'General case' 0 N--CA 1.471 0.597 0 C-N-CA 125.505 1.522 . . . . 6.82 110.366 -177.301 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 1.9 p30 -129.26 162.31 28.2 Favored 'General case' 0 N--CA 1.434 -1.235 0 C-N-CA 125.779 1.631 . . . . 7.53 107.146 179.622 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 22.5 tp60 74.49 34.73 0.75 Allowed 'General case' 0 CA--C 1.537 0.446 0 C-N-CA 124.449 1.1 . . . . 9.54 111.718 -176.375 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER 100.93 118.71 0.01 OUTLIER 'General case' 0 C--O 1.219 -0.541 0 C-N-CA 130.266 3.426 . . . . 5.47 107.177 179.548 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -68.94 -38.04 79.23 Favored 'General case' 0 N--CA 1.466 0.366 0 C-N-CA 122.584 0.354 . . . . 6.91 111.472 -171.953 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 7.6 mp -68.19 143.99 55.13 Favored 'General case' 0 C--O 1.226 -0.132 0 N-CA-C 107.835 -1.172 . . . . 2.34 107.835 174.484 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 38' ' ' VAL . . . . . 0.683 HG11 ' HB3' ' A' ' 26' ' ' ALA . 13.8 p -75.55 24.7 0.05 OUTLIER 'Isoleucine or valine' 0 CA--C 1.555 1.158 0 C-N-CA 123.44 0.696 . . . . 2.11 112.214 -178.612 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 10.9 t -68.69 140.03 55.42 Favored 'General case' 0 CA--C 1.535 0.385 0 O-C-N 120.25 -1.531 . . . . 3.24 108.751 -178.743 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 57.4 t30 50.87 60.7 3.69 Favored 'General case' 0 CA--C 1.531 0.216 0 C-N-CA 125.243 1.417 . . . . 5.06 113.27 179.484 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 73.8 m -125.9 171.7 10.51 Favored 'General case' 0 N--CA 1.455 -0.213 0 C-N-CA 122.992 0.517 . . . . 3.7 110.116 178.389 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 66.89 -73.39 0.08 Allowed 'General case' 0 C--O 1.225 -0.193 0 C-N-CA 125.768 1.627 . . . . 6.73 111.363 -173.32 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 12.2 tptt -72.43 -23.42 61.07 Favored 'General case' 0 C--O 1.223 -0.29 0 CA-C-N 118.643 0.656 . . . . 6.59 112.014 -178.867 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER 59.76 55.52 3.91 Favored 'General case' 0 CA--C 1.534 0.346 0 C-N-CA 123.369 0.668 . . . . 5.17 111.886 168.543 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . 0.309 0.1 OUTLIER 83.05 80.13 0.02 OUTLIER 'Isoleucine or valine' 0 CA--C 1.539 0.539 0 C-N-CA 127.103 2.161 . . . . 3.43 110.147 173.735 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 28.8 t0 -157.36 -66.39 0.1 Allowed 'General case' 0 N--CA 1.464 0.249 0 O-C-N 121.016 -1.053 . . . . 2.29 109.057 -173.972 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 8.2 mm -52.13 -54.17 15.3 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.413 0 C-N-CA 125.404 1.482 . . . . 0.56 109.5 177.966 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 36.5 t80 -64.0 -24.8 67.85 Favored 'General case' 0 N--CA 1.453 -0.305 0 O-C-N 121.346 -0.847 . . . . 0.51 113.206 178.372 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 49' ' ' LYS . . . . . 0.47 ' CA ' ' HE2' ' A' ' 49' ' ' LYS . 1.0 OUTLIER -66.77 -53.66 30.78 Favored 'General case' 0 N--CA 1.456 -0.168 0 C-N-CA 118.186 -1.406 . . . . 1.08 109.304 -178.85 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -84.49 -59.78 2.27 Favored 'General case' 0 N--CA 1.451 -0.385 0 N-CA-C 108.734 -0.839 . . . . 2.45 108.734 -172.812 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 51' ' ' GLU . . . . . 0.462 ' OE2' ' HE2' ' A' ' 91' ' ' LYS . 18.1 mm-40 -71.15 -31.24 67.45 Favored 'General case' 0 C--O 1.235 0.306 0 O-C-N 122.058 -0.401 . . . . 2.31 110.268 -170.44 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 52' ' ' GLY . . . . . 0.436 ' HA2' ' CD1' ' A' ' 66' ' ' PHE . . . -68.08 40.52 0.26 Allowed Glycine 0 CA--C 1.528 0.864 0 C-N-CA 126.644 2.069 . . . . 0.36 114.464 171.318 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 9.3 p -156.61 34.83 0.31 Allowed 'General case' 0 N--CA 1.449 -0.504 0 O-C-N 120.806 -1.409 . . . . 1.5 109.901 155.725 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 35.9 t-20 -135.6 -46.83 0.68 Allowed 'General case' 0 CA--C 1.521 -0.147 0 O-C-N 122.174 -0.329 . . . . 1.65 111.722 -169.74 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 55' ' ' LEU . . . . . 0.525 HD21 ' HB2' ' A' ' 89' ' ' ALA . 17.8 mt -55.85 -40.47 72.91 Favored 'General case' 0 CA--C 1.53 0.18 0 CA-C-O 120.825 0.345 . . . . 0.47 111.196 -178.873 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 2.8 t 178.07 173.76 0.6 Allowed 'General case' 0 CA--C 1.533 0.301 0 C-N-CA 125.67 1.588 . . . . 0.57 107.766 -174.483 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 9.6 p -61.75 -36.29 80.59 Favored 'General case' 0 N--CA 1.456 -0.173 0 C-N-CA 123.499 0.72 . . . . 2.57 109.959 170.307 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -62.16 -14.4 36.94 Favored 'General case' 0 CA--C 1.537 0.446 0 N-CA-C 112.332 0.493 . . . . 1.13 112.332 174.342 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -87.12 -13.25 66.52 Favored Glycine 0 N--CA 1.446 -0.693 0 CA-C-O 118.802 -0.999 . . . . 0.39 111.603 177.649 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 71.5 ttt-85 -101.94 -17.7 16.01 Favored 'General case' 0 N--CA 1.461 0.077 0 CA-C-N 119.23 1.515 . . . . 2.29 112.252 176.985 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 1.4 p -60.01 -170.01 0.01 OUTLIER 'General case' 0 CA--C 1.538 0.489 0 C-N-CA 123.064 0.546 . . . . 0.89 110.529 168.736 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 83.6 m-20 -48.89 148.28 2.32 Favored 'General case' 0 N--CA 1.464 0.227 0 O-C-N 121.428 -0.795 . . . . 2.22 110.529 -174.751 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -60.34 -31.23 70.11 Favored 'General case' 0 C--O 1.224 -0.273 0 C-N-CA 120.526 -0.47 . . . . 2.93 110.7 -174.056 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -54.64 -38.35 66.76 Favored 'General case' 0 N--CA 1.453 -0.297 0 N-CA-C 113.013 0.745 . . . . 0.45 113.013 173.675 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 1.6 mt-10 -74.56 -44.79 49.3 Favored 'General case' 0 CA--C 1.505 -0.784 0 CA-C-O 118.622 -0.704 . . . . 2.22 110.148 178.569 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 66' ' ' PHE . . . . . 0.436 ' CD1' ' HA2' ' A' ' 52' ' ' GLY . 49.1 t80 -50.22 -47.33 54.93 Favored 'General case' 0 N--CA 1.45 -0.457 0 O-C-N 123.896 0.748 . . . . 0.34 111.594 174.397 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 67' ' ' PHE . . . . . 0.427 ' O ' ' HB3' ' A' ' 70' ' ' ALA . 76.8 t80 -64.75 -45.01 88.21 Favored 'General case' 0 N--CA 1.452 -0.327 0 O-C-N 121.421 -0.799 . . . . 0.38 110.355 175.605 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -64.83 -54.44 31.0 Favored 'General case' 0 CA--C 1.537 0.456 0 O-C-N 121.446 -0.784 . . . . 0.36 112.619 -172.023 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -55.1 -36.62 65.88 Favored 'General case' 0 N--CA 1.456 -0.126 0 C-N-CA 124.207 1.003 . . . . 3.59 111.071 169.534 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 70' ' ' ALA . . . . . 0.427 ' HB3' ' O ' ' A' ' 67' ' ' PHE . . . -53.18 -52.12 59.87 Favored 'General case' 0 C--O 1.22 -0.496 0 CA-C-N 118.913 0.779 . . . . 0.46 109.644 170.635 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 4.7 t80 -51.71 -49.81 61.73 Favored 'General case' 0 C--O 1.233 0.209 0 CA-C-N 119.764 1.165 . . . . 2.53 111.682 179.981 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 25.1 ttt180 -46.89 -58.66 3.71 Favored 'General case' 0 CA--C 1.536 0.434 0 CA-C-N 118.005 0.366 . . . . 1.88 110.341 172.389 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 73' ' ' LEU . . . . . 0.589 HD12 ' CG2' ' A' ' 85' ' ' VAL . 0.1 OUTLIER -67.31 -33.24 74.85 Favored 'General case' 0 C--N 1.329 -0.293 0 C-N-CA 123.607 0.763 . . . . 0.46 110.565 -170.317 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 74' ' ' MET . . . . . 0.558 ' CE ' HG11 ' A' ' 85' ' ' VAL . 0.0 OUTLIER -61.5 -39.74 92.08 Favored 'General case' 0 CA--C 1.52 -0.199 0 C-N-CA 124.853 1.261 . . . . 6.34 109.939 -178.865 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 14.1 p80 -88.45 -33.29 17.9 Favored 'General case' 0 N--CA 1.453 -0.294 0 CA-C-O 116.702 -1.618 . . . . 1.05 110.991 -177.458 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 17.5 m -14.45 116.62 0.02 OUTLIER 'General case' 0 C--N 1.345 0.403 0 C-N-CA 128.561 2.744 . . . . 1.13 113.537 -167.204 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 7.7 p -45.29 -44.37 11.38 Favored 'General case' 0 N--CA 1.452 -0.365 0 C-N-CA 126.172 1.789 . . . . 1.21 110.017 -179.657 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 11.0 t0 -70.68 108.2 4.29 Favored 'General case' 0 N--CA 1.447 -0.624 0 CA-C-O 121.822 0.82 . . . . 2.03 109.614 168.054 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 57.8 m80 -52.27 -32.68 38.35 Favored 'General case' 0 N--CA 1.456 -0.155 0 CA-C-N 115.936 -0.574 . . . . 5.86 111.519 174.676 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -61.64 -51.19 69.49 Favored 'General case' 0 N--CA 1.449 -0.478 0 CA-C-O 118.325 -0.845 . . . . 0.81 110.37 177.935 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 1.9 mt-10 -47.26 -40.92 17.63 Favored 'General case' 0 N--CA 1.464 0.264 0 CA-C-N 119.331 0.969 . . . . 3.03 110.419 178.049 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -62.91 -52.57 62.53 Favored 'General case' 0 CA--C 1.515 -0.386 0 C-N-CA 120.108 -0.637 . . . . 3.13 110.145 178.581 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -61.98 -24.59 67.11 Favored 'General case' 0 N--CA 1.453 -0.319 0 CA-C-O 117.49 -1.243 . . . . 0.5 112.677 177.491 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 1.1 mptm? -61.29 -42.46 98.69 Favored 'General case' 0 C--O 1.225 -0.232 0 CA-C-N 121.166 1.803 . . . . 1.27 107.567 172.517 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 85' ' ' VAL . . . . . 0.589 ' CG2' HD12 ' A' ' 73' ' ' LEU . 93.0 t -69.26 -55.36 15.62 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.473 0 CA-C-O 118.21 -0.9 . . . . 0.43 112.308 176.19 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -50.8 -41.38 57.16 Favored 'General case' 0 CA--C 1.531 0.243 0 CA-C-N 120.676 1.58 . . . . 2.16 111.237 -178.013 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 34.9 tttt -62.88 -60.62 3.22 Favored 'General case' 0 N--CA 1.448 -0.54 0 C-N-CA 124.747 1.219 . . . . 1.94 110.919 175.67 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 3.0 m120 -76.7 0.34 20.78 Favored 'General case' 0 CA--C 1.53 0.187 0 C-N-CA 123.539 0.735 . . . . 1.21 112.075 -174.069 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 89' ' ' ALA . . . . . 0.525 ' HB2' HD21 ' A' ' 55' ' ' LEU . . . -158.33 68.58 3.68 Favored Pre-proline 0 N--CA 1.448 -0.53 0 C-N-CA 124.443 1.097 . . . . 0.53 108.7 -171.434 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 89.2 Cg_endo -80.3 56.64 6.15 Favored 'Trans proline' 0 CA--C 1.536 0.58 0 C-N-CA 124.378 3.386 . . . . 2.0 110.568 -173.3 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 91' ' ' LYS . . . . . 0.462 ' HE2' ' OE2' ' A' ' 51' ' ' GLU . 0.0 OUTLIER 176.18 -53.76 0.01 OUTLIER 'General case' 0 C--O 1.227 -0.127 0 C-N-CA 126.681 1.992 . . . . 2.6 109.669 -168.626 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 2.7 m -55.19 -46.51 75.84 Favored 'General case' 0 CA--C 1.518 -0.272 0 CA-C-N 118.855 0.752 . . . . 0.39 110.486 179.138 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 3.0 t80 -57.76 -49.02 77.97 Favored 'General case' 0 CA--C 1.506 -0.72 0 N-CA-C 109.677 -0.49 . . . . 2.27 109.677 178.246 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 3.8 tt0 -53.92 -33.78 57.67 Favored 'General case' 0 N--CA 1.443 -0.789 0 O-C-N 124.072 0.857 . . . . 2.25 110.694 -177.631 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 4.6 t80 -60.56 -56.25 23.56 Favored 'General case' 0 CA--C 1.529 0.173 0 C-N-CA 123.355 0.662 . . . . 0.92 109.945 -175.865 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 2.3 mp -61.67 -41.28 89.79 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.293 0 N-CA-C 108.853 -0.795 . . . . 0.91 108.853 176.817 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 11.7 t30 -58.7 -36.34 74.08 Favored 'General case' 0 CA--C 1.533 0.304 0 C-N-CA 123.143 0.577 . . . . 1.69 110.953 -175.896 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -62.76 -44.59 95.8 Favored 'General case' 0 CA--C 1.529 0.171 0 C-N-CA 126.588 1.955 . . . . 2.73 109.128 175.865 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 23.3 mm-40 -86.23 78.84 9.26 Favored 'General case' 0 N--CA 1.453 -0.276 0 O-C-N 121.079 -1.013 . . . . 3.45 110.507 174.12 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 1.9 tt -77.33 51.61 0.06 OUTLIER 'Isoleucine or valine' 0 CA--C 1.541 0.599 0 C-N-CA 123.828 0.851 . . . . 4.76 111.165 171.594 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 32.9 ttmt -159.51 157.49 30.09 Favored 'General case' 0 N--CA 1.457 -0.124 0 O-C-N 120.454 -1.404 . . . . 8.81 107.442 174.671 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 102' ' ' PHE . . . . . . . . . . . . . 38.6 p90 -151.65 -178.35 6.66 Favored 'General case' 0 C--N 1.33 -0.26 0 N-CA-C 108.711 -0.848 . . . . 8.35 108.711 -175.63 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 18.2 tt -61.29 141.45 17.44 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.308 0 C-N-CA 122.605 0.362 . . . . 5.39 110.121 179.632 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 104' ' ' ILE . . . . . . . . . . . . . 8.4 pt -72.24 165.64 2.88 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.305 0 O-C-N 121.78 -0.575 . . . . 6.86 110.089 175.836 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 96.8 m-20 61.33 100.81 0.03 OUTLIER 'General case' 0 N--CA 1.463 0.211 0 C-N-CA 126.388 1.875 . . . . 8.02 111.572 -176.321 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 19.0 p . . . . . 0 C--O 1.247 0.939 0 N-CA-C 106.963 -1.495 . . . . 9.01 106.963 -178.223 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.47 0.928 0 N-CA-C 107.697 -2.161 . . . . 15.78 107.697 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 2.1 m -153.09 -179.73 7.95 Favored 'General case' 0 N--CA 1.451 -0.383 0 N-CA-C 108.38 -0.97 . . . . 16.67 108.38 -165.089 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 32.6 ttpt -139.03 -80.31 0.32 Allowed 'General case' 0 N--CA 1.454 -0.231 0 N-CA-C 109.127 -0.694 . . . . 23.62 109.127 175.509 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -109.01 94.14 0.82 Allowed Glycine 0 C--N 1.332 0.351 0 N-CA-C 108.655 -1.778 . . . . 15.31 108.655 175.025 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 27.1 m -123.94 -152.1 0.12 Allowed 'Isoleucine or valine' 0 N--CA 1.438 -1.03 0 N-CA-C 107.57 -1.27 . . . . 12.05 107.57 172.635 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 17.4 mt-10 -107.26 97.93 7.63 Favored 'General case' 0 N--CA 1.449 -0.508 0 CA-C-O 122.133 0.968 . . . . 8.41 111.397 -177.598 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 7' ' ' LEU . . . . . 0.479 HD22 ' N ' ' A' ' 7' ' ' LEU . 1.4 mm? -84.33 40.74 0.79 Allowed 'General case' 0 N--CA 1.449 -0.499 0 CA-C-N 115.325 -0.852 . . . . 10.98 110.703 -178.028 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 7.6 mtm-85 -131.97 -92.49 0.39 Allowed 'General case' 0 N--CA 1.438 -1.052 0 C-N-CA 127.023 2.129 . . . . 7.68 105.41 178.6 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 8.1 m120 -65.72 -44.71 85.22 Favored 'General case' 0 CA--C 1.515 -0.391 0 N-CA-C 113.657 0.984 . . . . 4.51 113.657 -175.328 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 6.8 t70 -63.36 -44.56 94.46 Favored 'General case' 0 C--O 1.224 -0.279 0 CA-C-N 119.006 0.821 . . . . 2.49 109.394 179.706 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 58.5 m -60.03 -54.92 40.27 Favored 'General case' 0 CA--C 1.532 0.254 0 O-C-N 121.291 -0.881 . . . . 1.77 113.245 177.287 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 34.2 mt-10 -59.46 -40.65 87.57 Favored 'General case' 0 C--N 1.329 -0.3 0 C-N-CA 126.415 1.886 . . . . 3.81 109.451 -177.127 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -55.73 -56.7 22.46 Favored Glycine 0 CA--C 1.528 0.886 0 N-CA-C 110.644 -0.983 . . . . 0.88 110.644 170.256 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -52.44 -55.49 21.53 Favored 'General case' 0 C--N 1.333 -0.151 0 C-N-CA 124.477 1.111 . . . . 3.56 110.82 -175.034 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 1.1 pt -70.67 -27.14 29.85 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.283 0 O-C-N 121.613 -0.679 . . . . 0.81 112.479 -178.322 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 1.1 t-160 -58.31 -57.76 11.48 Favored 'General case' 0 CA--C 1.529 0.163 0 N-CA-C 105.894 -1.891 . . . . 0.62 105.894 174.015 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 43.5 mt-10 -55.4 -43.35 75.14 Favored 'General case' 0 N--CA 1.456 -0.158 0 C-N-CA 123.967 0.907 . . . . 2.47 110.663 -178.859 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 16.1 t80 -53.53 -51.49 62.67 Favored 'General case' 0 N--CA 1.455 -0.176 0 C-N-CA 123.493 0.717 . . . . 2.23 110.533 177.273 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -48.64 -43.56 29.02 Favored Glycine 0 CA--C 1.525 0.676 0 N-CA-C 111.347 -0.701 . . . . 0.73 111.347 174.889 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 20' ' ' HIS . . . . . 0.435 ' CE1' ' HB1' ' A' ' 64' ' ' ALA . 3.5 t-80 -61.18 -48.94 79.22 Favored 'General case' 0 N--CA 1.45 -0.466 0 O-C-N 121.967 -0.726 . . . . 1.86 111.047 178.299 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -58.63 -32.41 69.01 Favored 'General case' 0 N--CA 1.454 -0.232 0 CA-C-N 118.279 0.49 . . . . 1.19 110.346 177.802 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 41.4 t -67.6 -33.83 64.46 Favored 'Isoleucine or valine' 0 N--CA 1.46 0.059 0 O-C-N 121.256 -0.902 . . . . 1.21 111.537 179.13 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 12.1 t0 -57.19 -32.4 66.43 Favored 'General case' 0 CA--C 1.533 0.295 0 CA-C-O 122.082 0.944 . . . . 1.96 110.688 174.309 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 7.4 t0 -66.98 -51.31 56.64 Favored 'General case' 0 N--CA 1.454 -0.273 0 CA-C-O 122.555 1.169 . . . . 2.04 108.243 -177.864 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 1.2 t80 -52.78 -42.97 65.53 Favored 'General case' 0 N--CA 1.457 -0.125 0 CA-C-N 114.945 -1.025 . . . . 3.35 110.743 174.52 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -61.14 -33.23 73.07 Favored 'General case' 0 N--CA 1.449 -0.485 0 CA-C-O 118.693 -0.67 . . . . 0.95 111.377 -179.878 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -72.72 -32.65 61.21 Favored Glycine 0 CA--C 1.523 0.565 0 CA-C-N 118.929 0.786 . . . . 1.65 111.759 177.342 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -72.56 -44.07 62.6 Favored 'General case' 0 N--CA 1.453 -0.304 0 O-C-N 121.667 -0.902 . . . . 2.81 110.611 -179.312 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 2.0 mm? -83.84 -34.93 24.55 Favored 'General case' 0 N--CA 1.45 -0.434 0 C-N-CA 124.081 0.953 . . . . 2.54 112.807 -174.861 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 1.9 mt -125.38 165.9 17.55 Favored 'General case' 0 N--CA 1.449 -0.518 0 N-CA-C 107.973 -1.121 . . . . 2.57 107.973 -170.164 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 1.6 t70 68.48 162.07 0.2 Allowed 'General case' 0 CA--C 1.534 0.365 0 C-N-CA 123.803 0.841 . . . . 4.77 109.484 -163.745 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 1.4 tptm -128.79 -7.79 5.03 Favored 'General case' 0 C--N 1.331 -0.219 0 O-C-N 120.947 -1.096 . . . . 8.96 110.993 179.798 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 36.0 t-20 -85.35 166.17 16.66 Favored 'General case' 0 N--CA 1.446 -0.66 0 N-CA-C 108.028 -1.101 . . . . 6.47 108.028 177.31 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -65.73 -6.9 13.01 Favored 'General case' 0 CA--C 1.537 0.48 0 N-CA-C 112.802 0.667 . . . . 6.76 112.802 173.757 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 12.1 m -72.12 88.19 1.1 Allowed 'General case' 0 N--CA 1.448 -0.566 0 C-N-CA 123.596 0.758 . . . . 6.14 110.549 176.124 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 10.5 m-20 -62.99 168.94 3.62 Favored 'General case' 0 CA--C 1.533 0.326 0 C-N-CA 122.742 0.417 . . . . 6.88 110.113 166.651 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 7.1 mp 68.74 106.26 0.05 Allowed 'General case' 0 CA--C 1.531 0.233 0 C-N-CA 127.527 2.331 . . . . 2.1 110.8 -172.2 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 53.9 t -87.11 76.43 1.32 Allowed 'Isoleucine or valine' 0 N--CA 1.455 -0.222 0 CA-C-O 123.108 1.432 . . . . 2.98 108.181 178.781 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -113.91 116.04 28.65 Favored 'General case' 0 N--CA 1.442 -0.871 0 N-CA-C 107.158 -1.423 . . . . 3.31 107.158 -177.482 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 61.0 m-80 41.72 51.17 4.01 Favored 'General case' 0 N--CA 1.467 0.386 0 C-N-CA 125.061 1.344 . . . . 6.93 114.488 -178.863 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 22.4 t -62.58 -74.13 0.1 Allowed 'General case' 0 CA--C 1.539 0.529 0 C-N-CA 122.856 0.462 . . . . 3.14 110.737 177.061 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -53.13 -54.75 31.1 Favored 'General case' 0 N--CA 1.472 0.626 0 O-C-N 120.741 -1.224 . . . . 7.16 112.92 -171.83 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -72.0 -19.91 61.79 Favored 'General case' 0 C--O 1.223 -0.34 0 CA-C-O 118.706 -0.664 . . . . 7.14 112.063 -178.671 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER 63.75 85.5 0.13 Allowed 'General case' 0 N--CA 1.451 -0.382 0 C-N-CA 125.402 1.481 . . . . 5.07 112.266 170.732 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 15.5 tt 41.75 74.56 0.06 OUTLIER 'Isoleucine or valine' 0 CA--C 1.539 0.545 0 C-N-CA 125.989 1.715 . . . . 2.36 111.794 -178.832 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 19.8 t70 -134.9 -55.97 0.82 Allowed 'General case' 0 N--CA 1.465 0.319 0 C-N-CA 123.43 0.692 . . . . 2.11 110.784 -170.808 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 5.9 mm -56.53 -46.49 82.45 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.315 0 CA-C-O 122.943 1.354 . . . . 0.69 109.102 175.873 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 24.7 t80 -63.62 -23.14 67.26 Favored 'General case' 0 N--CA 1.451 -0.401 0 O-C-N 120.561 -1.337 . . . . 0.59 112.187 177.085 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 49' ' ' LYS . . . . . 0.485 ' HA ' ' CE ' ' A' ' 49' ' ' LYS . 0.9 OUTLIER -71.85 -48.96 42.38 Favored 'General case' 0 N--CA 1.448 -0.549 0 O-C-N 120.053 -1.655 . . . . 1.43 110.343 -179.653 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 21.8 tp10 -90.31 -55.82 3.45 Favored 'General case' 0 C--N 1.331 -0.208 0 O-C-N 123.541 0.526 . . . . 2.48 109.619 -173.04 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 33.0 mp0 -75.67 -28.43 58.7 Favored 'General case' 0 C--O 1.236 0.359 0 O-C-N 121.25 -0.906 . . . . 2.6 110.904 -176.261 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 52' ' ' GLY . . . . . 0.475 ' HA2' ' CD1' ' A' ' 66' ' ' PHE . . . -70.92 45.72 0.71 Allowed Glycine 0 CA--C 1.531 1.055 0 C-N-CA 125.805 1.669 . . . . 0.38 114.843 169.935 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 46.8 t -162.66 46.13 0.14 Allowed 'General case' 0 N--CA 1.449 -0.476 0 N-CA-C 107.182 -1.414 . . . . 2.07 107.182 157.636 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 4.8 t-20 -147.45 -50.85 0.19 Allowed 'General case' 0 CA--C 1.519 -0.243 0 N-CA-C 111.746 0.276 . . . . 1.49 111.746 -170.116 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 28.0 mt -59.97 -37.07 78.55 Favored 'General case' 0 N--CA 1.462 0.14 0 CA-C-O 120.885 0.374 . . . . 0.46 111.048 -176.907 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -178.0 170.52 1.85 Allowed 'General case' 0 C--N 1.33 -0.277 0 N-CA-C 107.81 -1.181 . . . . 0.43 107.81 -175.982 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 11.6 t -63.02 -35.23 79.52 Favored 'General case' 0 CA--C 1.533 0.312 0 C-N-CA 123.195 0.598 . . . . 1.99 109.713 170.184 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -67.1 -9.52 40.43 Favored 'General case' 0 N--CA 1.466 0.342 0 O-C-N 121.737 -0.602 . . . . 1.23 112.237 172.811 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -85.58 -5.08 84.94 Favored Glycine 0 C--O 1.22 -0.745 0 CA-C-O 118.797 -1.002 . . . . 0.51 111.287 173.195 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -114.11 -16.66 12.07 Favored 'General case' 0 C--N 1.334 -0.07 0 CA-C-N 119.291 1.546 . . . . 2.71 112.239 -175.583 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 24.1 p -64.45 -149.72 0.01 OUTLIER 'General case' 0 CA--C 1.54 0.565 0 C-N-CA 125.629 1.571 . . . . 0.93 109.881 176.299 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 15.9 m120 -58.3 143.8 43.48 Favored 'General case' 0 N--CA 1.455 -0.184 0 O-C-N 119.298 -2.126 . . . . 2.96 109.212 177.307 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 66.3 tt0 -56.55 -29.03 61.5 Favored 'General case' 0 CA--C 1.534 0.335 0 CA-C-O 121.785 0.802 . . . . 3.11 111.466 -178.52 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 64' ' ' ALA . . . . . 0.435 ' HB1' ' CE1' ' A' ' 20' ' ' HIS . . . -60.23 -39.82 88.03 Favored 'General case' 0 N--CA 1.449 -0.49 0 C-N-CA 123.349 0.659 . . . . 0.72 112.224 175.126 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 9.6 mt-10 -70.91 -42.0 70.52 Favored 'General case' 0 N--CA 1.451 -0.384 0 O-C-N 121.365 -0.834 . . . . 2.37 110.757 176.443 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 66' ' ' PHE . . . . . 0.475 ' CD1' ' HA2' ' A' ' 52' ' ' GLY . 49.8 t80 -49.98 -52.5 33.32 Favored 'General case' 0 N--CA 1.454 -0.23 0 C-N-CA 122.858 0.463 . . . . 0.53 110.861 174.753 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 75.9 t80 -60.92 -41.81 96.88 Favored 'General case' 0 CA--C 1.534 0.346 0 C-N-CA 122.508 0.323 . . . . 0.77 110.827 177.716 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -63.95 -45.67 88.14 Favored 'General case' 0 CA--C 1.54 0.577 0 O-C-N 121.209 -0.932 . . . . 0.49 111.838 -176.109 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 18.8 mm-40 -58.42 -43.9 88.84 Favored 'General case' 0 CA--C 1.521 -0.143 0 C-N-CA 124.447 1.099 . . . . 4.28 110.187 171.38 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -52.07 -54.5 29.54 Favored 'General case' 0 N--CA 1.454 -0.257 0 N-CA-C 108.359 -0.978 . . . . 0.42 108.359 178.021 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 39.4 t80 -50.45 -51.13 49.58 Favored 'General case' 0 N--CA 1.456 -0.173 0 C-N-CA 123.551 0.74 . . . . 2.15 111.986 179.616 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 13.6 ttt180 -47.55 -57.93 4.84 Favored 'General case' 0 CA--C 1.534 0.354 0 CA-C-N 118.62 0.646 . . . . 2.05 110.094 176.154 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 73' ' ' LEU . . . . . 0.626 HD12 HG23 ' A' ' 85' ' ' VAL . 0.1 OUTLIER -67.4 -24.47 65.67 Favored 'General case' 0 C--O 1.222 -0.355 0 C-N-CA 125.132 1.373 . . . . 0.61 110.984 -172.505 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 74' ' ' MET . . . . . 0.442 ' HG3' HG21 ' A' ' 96' ' ' ILE . 33.4 mmt -57.0 -45.72 82.8 Favored 'General case' 0 N--CA 1.468 0.437 0 CA-C-N 119.041 0.837 . . . . 5.59 111.486 178.409 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 6.6 p80 -95.94 -29.36 14.21 Favored 'General case' 0 C--N 1.334 -0.102 0 CA-C-O 116.388 -1.768 . . . . 2.68 113.556 -175.589 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 81.3 p -13.18 117.08 0.02 OUTLIER 'General case' 0 C--N 1.344 0.337 0 C-N-CA 127.87 2.468 . . . . 2.18 113.672 -173.047 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 1.9 p -44.93 -42.39 8.07 Favored 'General case' 0 C--N 1.33 -0.276 0 C-N-CA 125.173 1.389 . . . . 1.14 110.87 176.994 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 11.1 t0 -66.98 103.03 1.06 Allowed 'General case' 0 N--CA 1.452 -0.374 0 N-CA-C 108.857 -0.794 . . . . 2.32 108.857 166.206 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 4.6 t-80 -59.87 -23.05 63.11 Favored 'General case' 0 CA--C 1.531 0.237 0 O-C-N 121.522 -0.736 . . . . 5.71 111.679 179.896 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -66.09 -46.17 78.63 Favored 'General case' 0 N--CA 1.451 -0.41 0 CA-C-O 118.525 -0.75 . . . . 0.78 110.918 176.493 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 1.1 mt-10 -47.77 -38.85 16.46 Favored 'General case' 0 N--CA 1.465 0.306 0 CA-C-N 119.025 0.829 . . . . 3.25 109.908 177.655 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 11.3 mtp180 -62.19 -54.54 39.52 Favored 'General case' 0 CA--C 1.517 -0.32 0 N-CA-C 108.822 -0.807 . . . . 2.65 108.822 -178.439 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 1.5 mm? -65.36 -19.08 65.79 Favored 'General case' 0 N--CA 1.451 -0.409 0 CA-C-O 118.095 -0.955 . . . . 0.61 112.726 178.2 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 24.3 mttt -68.73 -43.6 75.59 Favored 'General case' 0 CA--C 1.517 -0.302 0 CA-C-N 120.885 1.675 . . . . 1.57 108.317 172.351 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 85' ' ' VAL . . . . . 0.626 HG23 HD12 ' A' ' 73' ' ' LEU . 92.8 t -61.23 -62.34 1.16 Allowed 'Isoleucine or valine' 0 C--O 1.217 -0.633 0 CA-C-O 118.413 -0.803 . . . . 0.37 109.893 171.584 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -50.09 -46.13 53.27 Favored 'General case' 0 C--O 1.224 -0.249 0 CA-C-N 120.213 1.37 . . . . 2.34 112.082 -175.084 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 41.7 tttt -58.91 -53.37 59.18 Favored 'General case' 0 N--CA 1.448 -0.529 0 O-C-N 121.459 -0.776 . . . . 2.13 110.879 177.299 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 64.4 m-20 -79.82 -7.15 58.52 Favored 'General case' 0 C--N 1.33 -0.258 0 C-N-CA 122.386 0.274 . . . . 0.91 111.486 -174.449 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -164.88 62.94 0.96 Allowed Pre-proline 0 N--CA 1.447 -0.576 0 C-N-CA 124.558 1.143 . . . . 0.52 109.624 -163.709 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 20.8 Cg_endo -57.6 -41.13 74.4 Favored 'Trans proline' 0 N--CA 1.454 -0.813 0 C-N-CA 122.54 2.16 . . . . 2.58 109.884 -173.123 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 1.2 ptpt -74.29 -43.13 58.11 Favored 'General case' 0 N--CA 1.453 -0.325 0 C-N-CA 126.584 1.954 . . . . 2.32 113.222 -178.789 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 3.7 m -59.04 -45.74 89.99 Favored 'General case' 0 CA--C 1.517 -0.296 0 CA-C-N 119.924 1.238 . . . . 0.4 110.048 179.967 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 2.5 t80 -59.27 -46.39 88.65 Favored 'General case' 0 CA--C 1.512 -0.502 0 C-N-CA 120.123 -0.631 . . . . 1.92 110.162 175.577 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 2.8 tt0 -52.36 -32.72 39.75 Favored 'General case' 0 N--CA 1.448 -0.552 0 CA-C-N 115.532 -0.758 . . . . 1.6 111.066 179.942 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 2.3 t80 -58.15 -62.56 1.74 Allowed 'General case' 0 N--CA 1.456 -0.166 0 C-N-CA 124.091 0.956 . . . . 1.21 110.191 -178.269 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 96' ' ' ILE . . . . . 0.442 HG21 ' HG3' ' A' ' 74' ' ' MET . 3.5 mp -63.05 -36.08 74.35 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.286 0 N-CA-C 109.218 -0.66 . . . . 1.11 109.218 -179.762 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 7.3 t-20 -57.96 -39.0 77.05 Favored 'General case' 0 CA--C 1.536 0.426 0 CA-C-N 117.953 0.342 . . . . 2.11 110.743 -179.486 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 6.9 t0 -57.88 -38.16 75.25 Favored 'General case' 0 N--CA 1.463 0.197 0 C-N-CA 125.225 1.41 . . . . 2.19 110.141 177.327 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 28.5 mm100 -78.87 70.51 5.22 Favored 'General case' 0 N--CA 1.448 -0.567 0 CA-C-O 121.684 0.754 . . . . 2.7 109.436 179.245 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 2.3 tp -67.84 162.09 3.58 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.434 0 N-CA-C 108.884 -0.784 . . . . 5.3 108.884 -179.655 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 17.9 mmtp 52.62 81.59 0.08 Allowed 'General case' 0 C--N 1.339 0.147 0 CA-C-O 121.99 0.9 . . . . 9.38 109.674 -167.56 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 102' ' ' PHE . . . . . . . . . . . . . 70.5 m-85 -50.05 155.42 0.94 Allowed 'General case' 0 N--CA 1.451 -0.376 0 CA-C-N 114.449 -1.25 . . . . 10.92 110.194 171.195 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 6.7 tp -55.2 129.41 16.49 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.515 0 N-CA-C 109.461 -0.57 . . . . 3.59 109.461 -174.703 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 104' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -63.53 155.7 5.49 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.489 0 N-CA-C 108.905 -0.776 . . . . 6.08 108.905 177.826 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 2.5 m-20 67.59 89.53 0.1 Allowed 'General case' 0 CA--C 1.528 0.104 0 C-N-CA 126.043 1.737 . . . . 6.56 110.968 -177.232 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 8.4 m . . . . . 0 C--O 1.252 1.223 0 CA-C-O 116.692 -1.623 . . . . 9.65 109.971 164.912 . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.47 0.906 0 N-CA-C 108.868 -1.693 . . . . 13.51 108.868 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 2.0 m -50.54 152.76 1.82 Allowed 'General case' 0 N--CA 1.455 -0.193 0 CA-C-N 117.711 0.756 . . . . 14.09 110.866 173.12 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -141.68 150.19 41.57 Favored 'General case' 0 N--CA 1.454 -0.252 0 N-CA-C 108.155 -1.054 . . . . 16.9 108.155 175.712 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 159.69 -159.68 30.81 Favored Glycine 0 N--CA 1.45 -0.415 0 N-CA-C 108.291 -1.924 . . . . 15.18 108.291 -174.801 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -67.38 -175.69 0.12 Allowed 'Isoleucine or valine' 0 N--CA 1.454 -0.265 0 CA-C-O 120.943 0.401 . . . . 16.2 111.151 173.99 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 4.6 pt-20 -82.35 117.51 22.47 Favored 'General case' 0 N--CA 1.444 -0.729 0 CA-C-O 122.85 1.309 . . . . 11.21 111.297 173.612 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 7' ' ' LEU . . . . . 0.414 HD22 ' H ' ' A' ' 7' ' ' LEU . 0.0 OUTLIER -154.2 53.34 0.68 Allowed 'General case' 0 N--CA 1.442 -0.86 0 C-N-CA 125.997 1.719 . . . . 10.27 107.284 174.49 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 16.3 mmm180 64.48 36.64 8.63 Favored 'General case' 0 CA--C 1.531 0.216 0 C-N-CA 123.216 0.607 . . . . 7.0 111.134 179.31 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 7.3 m-20 -50.82 -36.04 35.31 Favored 'General case' 0 N--CA 1.468 0.461 0 CA-C-N 118.612 0.642 . . . . 3.33 112.492 -178.974 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 8.0 t70 -61.57 -55.09 34.63 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 120.979 0.419 . . . . 2.27 110.825 175.083 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 7.7 t -65.07 -48.78 72.55 Favored 'General case' 0 N--CA 1.454 -0.225 0 C-N-CA 123.126 0.571 . . . . 1.66 109.972 -171.907 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 12' ' ' GLU . . . . . 0.411 ' HA ' ' CD1' ' A' ' 15' ' ' ILE . 8.5 pt-20 -80.59 -23.34 39.92 Favored 'General case' 0 N--CA 1.453 -0.29 0 CA-C-O 121.172 0.511 . . . . 3.82 110.09 -177.25 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -61.16 -45.81 95.79 Favored Glycine 0 N--CA 1.448 -0.514 0 N-CA-C 109.202 -1.559 . . . . 1.05 109.202 172.198 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 2.9 t80 -59.06 -52.53 65.33 Favored 'General case' 0 N--CA 1.454 -0.273 0 CA-C-N 117.659 0.73 . . . . 2.85 110.699 -176.673 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 15' ' ' ILE . . . . . 0.411 ' CD1' ' HA ' ' A' ' 12' ' ' GLU . 0.7 OUTLIER -67.26 -36.31 76.36 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.499 0 O-C-N 121.229 -0.919 . . . . 0.61 112.184 -178.859 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 3.0 t60 -57.34 -53.7 55.1 Favored 'General case' 0 CA--C 1.531 0.213 0 N-CA-C 107.228 -1.397 . . . . 0.87 107.228 176.383 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 45.8 mt-10 -64.99 -32.21 73.82 Favored 'General case' 0 N--CA 1.449 -0.487 0 C-N-CA 125.105 1.362 . . . . 2.36 111.131 -175.333 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 1.1 m-85 -54.39 -53.84 48.66 Favored 'General case' 0 CA--C 1.517 -0.318 0 CA-C-N 119.56 1.073 . . . . 2.91 110.129 167.762 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -49.76 -47.91 37.65 Favored Glycine 0 CA--C 1.526 0.742 0 N-CA-C 110.825 -0.91 . . . . 0.69 110.825 176.857 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 15.9 t-80 -62.28 -43.7 98.21 Favored 'General case' 0 N--CA 1.447 -0.592 0 O-C-N 122.058 -0.672 . . . . 1.99 112.017 -178.661 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -61.84 -32.28 72.6 Favored 'General case' 0 N--CA 1.451 -0.394 0 N-CA-C 109.224 -0.658 . . . . 0.91 109.224 -178.863 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 84.8 t -71.46 -40.83 72.75 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.164 0 C-N-CA 119.314 -0.954 . . . . 1.0 111.086 176.967 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 15.1 t0 -58.76 -30.54 67.6 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 121.807 0.813 . . . . 1.97 110.981 172.182 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 10.4 t70 -67.68 -49.6 61.97 Favored 'General case' 0 N--CA 1.455 -0.195 0 N-CA-C 107.556 -1.275 . . . . 2.52 107.556 -173.712 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 16.4 t80 -56.92 -46.61 81.88 Favored 'General case' 0 N--CA 1.453 -0.301 0 CA-C-N 115.677 -0.692 . . . . 3.1 110.361 174.048 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -57.51 -33.87 68.5 Favored 'General case' 0 N--CA 1.452 -0.367 0 CA-C-O 118.686 -0.673 . . . . 1.4 111.288 178.11 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -89.42 -13.63 61.27 Favored Glycine 0 CA--C 1.526 0.769 0 CA-C-N 119.028 0.831 . . . . 2.17 112.908 -176.791 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 16.0 t80 -82.69 -49.61 9.6 Favored 'General case' 0 N--CA 1.453 -0.303 0 CA-C-N 118.263 1.031 . . . . 3.38 108.915 173.665 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -78.3 -38.86 41.41 Favored 'General case' 0 CA--C 1.516 -0.341 0 C-N-CA 124.173 0.989 . . . . 2.08 111.716 -176.755 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 3.4 mt -119.42 166.89 12.49 Favored 'General case' 0 N--CA 1.447 -0.611 0 N-CA-C 106.491 -1.67 . . . . 2.53 106.491 -176.935 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 1.3 t0 70.35 117.61 0.04 OUTLIER 'General case' 0 CA--C 1.536 0.417 0 C-N-CA 124.2 1.0 . . . . 5.4 110.339 -177.658 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -118.02 156.73 28.07 Favored 'General case' 0 CA--C 1.518 -0.272 0 O-C-N 120.426 -1.421 . . . . 8.73 107.728 -172.74 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 3.2 t30 63.31 111.7 0.02 OUTLIER 'General case' 0 N--CA 1.451 -0.397 0 C-N-CA 127.371 2.268 . . . . 6.79 109.388 -163.596 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 20.5 tt0 59.59 51.02 6.72 Favored 'General case' 0 CA--C 1.535 0.397 0 C-N-CA 123.528 0.731 . . . . 8.68 109.974 -173.11 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 9.6 p -61.45 99.69 0.11 Allowed 'General case' 0 N--CA 1.454 -0.24 0 C-N-CA 125.07 1.348 . . . . 8.07 108.715 175.721 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 20.6 t70 -147.35 -51.82 0.2 Allowed 'General case' 0 C--N 1.33 -0.242 0 C-N-CA 124.748 1.219 . . . . 6.25 108.975 -171.572 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 37' ' ' LEU . . . . . 0.472 HD13 ' HB2' ' A' ' 64' ' ' ALA . 12.6 mt -141.46 153.05 44.75 Favored 'General case' 0 C--N 1.339 0.15 0 C-N-CA 125.56 1.544 . . . . 3.17 107.872 -177.933 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 6.4 p -88.63 36.46 0.07 OUTLIER 'Isoleucine or valine' 0 N--CA 1.472 0.65 0 CA-C-N 119.822 1.192 . . . . 2.48 111.801 -173.771 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 9.0 t -78.1 12.1 1.99 Allowed 'General case' 0 CA--C 1.543 0.682 0 O-C-N 120.679 -1.263 . . . . 3.91 112.314 -170.237 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 44.6 m-20 -135.13 46.03 2.45 Favored 'General case' 0 N--CA 1.464 0.232 0 CA-C-N 120.64 1.564 . . . . 6.8 110.592 178.371 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 5.2 t -150.91 -166.89 2.66 Favored 'General case' 0 C--O 1.233 0.199 0 O-C-N 120.452 -1.405 . . . . 3.45 110.942 175.661 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 3.7 mmpt? 67.21 -64.14 0.26 Allowed 'General case' 0 N--CA 1.467 0.401 0 C-N-CA 128.246 2.618 . . . . 6.26 113.015 177.319 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -138.95 14.12 2.66 Favored 'General case' 0 C--O 1.222 -0.378 0 C-N-CA 126.452 1.901 . . . . 7.28 110.921 179.412 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 1.6 t80 60.29 71.4 0.57 Allowed 'General case' 0 CA--C 1.533 0.318 0 C-N-CA 124.484 1.114 . . . . 4.9 110.57 177.161 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 18.8 tt 36.16 71.68 0.05 OUTLIER 'Isoleucine or valine' 0 CA--C 1.536 0.416 0 C-N-CA 126.584 1.954 . . . . 2.94 112.32 177.934 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 30.3 t70 -120.34 -48.83 2.29 Favored 'General case' 0 N--CA 1.465 0.289 0 CA-C-O 122.057 0.932 . . . . 2.38 110.232 -172.297 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 3.4 mm -52.06 -51.2 31.62 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.19 0 C-N-CA 124.739 1.216 . . . . 0.64 109.932 175.948 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 25.7 t80 -61.29 -32.74 72.58 Favored 'General case' 0 C--O 1.224 -0.268 0 O-C-N 121.781 -0.575 . . . . 0.89 111.895 175.88 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 49' ' ' LYS . . . . . 0.461 ' HA ' ' HE2' ' A' ' 49' ' ' LYS . 7.6 mmpt? -67.74 -44.05 78.48 Favored 'General case' 0 N--CA 1.451 -0.403 0 O-C-N 120.544 -1.347 . . . . 1.39 110.728 -176.668 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 18.5 mm-40 -82.31 -64.67 1.13 Allowed 'General case' 0 CA--C 1.532 0.274 0 CA-C-O 122.294 1.045 . . . . 3.09 109.749 -179.738 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 21.1 mm-40 -74.18 -28.28 61.21 Favored 'General case' 0 C--O 1.235 0.338 0 C-N-CA 123.281 0.632 . . . . 2.22 110.829 -169.084 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 52' ' ' GLY . . . . . 0.403 ' HA2' ' CD1' ' A' ' 66' ' ' PHE . . . -71.46 38.21 0.58 Allowed Glycine 0 CA--C 1.533 1.165 0 C-N-CA 124.295 0.95 . . . . 0.39 113.287 170.184 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -148.61 33.16 0.78 Allowed 'General case' 0 N--CA 1.451 -0.414 0 C-N-CA 124.518 1.127 . . . . 2.53 108.75 163.195 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 11.3 t-20 -144.37 -43.27 0.25 Allowed 'General case' 0 C--N 1.339 0.14 0 N-CA-C 112.331 0.493 . . . . 1.65 112.331 -169.402 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 18.6 mt -62.64 -36.5 83.0 Favored 'General case' 0 N--CA 1.462 0.133 0 O-C-N 121.753 -0.592 . . . . 0.46 111.239 -176.347 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER 175.06 169.84 0.29 Allowed 'General case' 0 CA--C 1.531 0.23 0 C-N-CA 125.989 1.716 . . . . 0.67 107.48 -177.338 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 14.5 m -61.13 -36.46 79.81 Favored 'General case' 0 N--CA 1.455 -0.2 0 C-N-CA 123.092 0.557 . . . . 1.22 110.557 169.497 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 1.6 m-85 -68.08 -9.23 44.57 Favored 'General case' 0 N--CA 1.466 0.34 0 O-C-N 121.927 -0.483 . . . . 2.23 112.182 173.473 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -90.25 2.41 81.15 Favored Glycine 0 N--CA 1.443 -0.845 0 CA-C-O 118.828 -0.985 . . . . 0.44 111.06 173.54 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 3.2 tmt_? -125.91 -13.79 6.26 Favored 'General case' 0 C--O 1.226 -0.136 0 CA-C-N 119.157 1.479 . . . . 2.52 112.925 -176.888 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 3.6 p -59.67 -104.09 0.0 OUTLIER 'General case' 0 C--N 1.333 -0.148 0 C-N-CA 126.656 1.982 . . . . 1.47 110.583 177.175 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 4.5 t30 -93.53 152.23 19.19 Favored 'General case' 0 N--CA 1.45 -0.462 0 N-CA-C 107.681 -1.229 . . . . 2.08 107.681 175.594 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 1.6 tm-20 -58.58 -35.72 72.85 Favored 'General case' 0 CA--C 1.532 0.271 0 CA-C-O 121.422 0.629 . . . . 3.48 109.737 176.205 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 64' ' ' ALA . . . . . 0.472 ' HB2' HD13 ' A' ' 37' ' ' LEU . . . -61.43 -31.64 71.58 Favored 'General case' 0 N--CA 1.453 -0.298 0 N-CA-C 113.785 1.032 . . . . 0.68 113.785 176.315 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 10.0 mt-10 -76.47 -41.16 48.19 Favored 'General case' 0 CA--C 1.513 -0.446 0 O-C-N 121.546 -0.721 . . . . 2.25 109.534 176.548 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 66' ' ' PHE . . . . . 0.403 ' CD1' ' HA2' ' A' ' 52' ' ' GLY . 49.4 t80 -53.34 -51.63 61.82 Favored 'General case' 0 N--CA 1.451 -0.394 0 C-N-CA 123.027 0.531 . . . . 0.42 111.251 173.804 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 71.2 t80 -64.94 -49.8 68.95 Favored 'General case' 0 N--CA 1.45 -0.468 0 C-N-CA 122.768 0.427 . . . . 0.46 110.425 -178.283 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -60.11 -47.52 85.54 Favored 'General case' 0 CA--C 1.54 0.581 0 O-C-N 121.607 -0.683 . . . . 0.39 112.274 -177.347 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 6.2 mm-40 -59.68 -41.54 90.9 Favored 'General case' 0 C--N 1.332 -0.167 0 C-N-CA 124.425 1.09 . . . . 4.43 110.468 172.823 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -58.28 -41.84 85.23 Favored 'General case' 0 N--CA 1.453 -0.301 0 O-C-N 121.413 -0.804 . . . . 0.39 109.373 179.67 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -54.59 -52.37 62.35 Favored 'General case' 0 C--O 1.232 0.149 0 C-N-CA 124.678 1.191 . . . . 3.21 111.488 172.016 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 7.6 ttt180 -48.58 -61.35 2.07 Favored 'General case' 0 CA--C 1.529 0.173 0 N-CA-C 109.432 -0.581 . . . . 2.32 109.432 177.151 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 73' ' ' LEU . . . . . 0.564 ' CB ' HG21 ' A' ' 85' ' ' VAL . 0.1 OUTLIER -61.06 -28.04 68.78 Favored 'General case' 0 C--N 1.327 -0.411 0 C-N-CA 125.127 1.371 . . . . 0.53 111.233 -176.18 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER -62.64 -40.71 97.87 Favored 'General case' 0 C--O 1.234 0.255 0 CA-C-N 118.745 0.702 . . . . 2.51 110.744 -179.273 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 15.4 p80 -95.96 -20.48 18.7 Favored 'General case' 0 C--O 1.228 -0.067 0 CA-C-O 116.628 -1.653 . . . . 1.01 113.259 -179.109 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 33.2 m -31.92 115.22 0.16 Allowed 'General case' 0 C--O 1.221 -0.425 0 C-N-CA 125.776 1.63 . . . . 1.17 111.823 -172.085 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 1.2 p -45.83 -39.58 8.66 Favored 'General case' 0 C--N 1.329 -0.291 0 C-N-CA 125.908 1.683 . . . . 1.15 110.994 -177.367 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 12.6 t0 -63.48 104.87 0.68 Allowed 'General case' 0 N--CA 1.449 -0.514 0 CA-C-O 121.912 0.863 . . . . 2.48 109.872 167.402 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 9.1 m-70 -52.07 -33.87 41.06 Favored 'General case' 0 N--CA 1.457 -0.118 0 CA-C-O 118.596 -0.716 . . . . 4.67 111.613 175.438 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -59.06 -54.11 50.72 Favored 'General case' 0 N--CA 1.448 -0.534 0 CA-C-O 118.04 -0.981 . . . . 1.05 109.957 178.988 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 4.4 mt-10 -42.73 -46.31 5.07 Favored 'General case' 0 CA--C 1.516 -0.352 0 C-N-CA 124.593 1.157 . . . . 2.71 111.055 178.561 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 12.4 mtp-105 -64.24 -51.2 64.79 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.162 -0.927 . . . . 3.27 109.423 -176.532 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 1.2 mm? -66.39 -18.88 65.62 Favored 'General case' 0 N--CA 1.451 -0.39 0 CA-C-O 117.674 -1.155 . . . . 0.52 113.054 176.708 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -67.37 -44.19 79.56 Favored 'General case' 0 C--O 1.221 -0.445 0 CA-C-N 121.377 1.899 . . . . 1.86 107.106 168.893 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 85' ' ' VAL . . . . . 0.564 HG21 ' CB ' ' A' ' 73' ' ' LEU . 93.8 t -63.95 -46.08 95.05 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.564 0 CA-C-O 117.559 -1.21 . . . . 0.47 111.556 177.069 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 7.2 mt-30 -63.03 -49.62 73.9 Favored 'General case' 0 N--CA 1.463 0.217 0 CA-C-N 121.864 2.12 . . . . 1.72 111.737 178.636 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 44.9 tttt -57.83 -52.26 66.19 Favored 'General case' 0 N--CA 1.449 -0.497 0 O-C-N 121.769 -0.582 . . . . 2.15 110.325 -176.523 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 8.0 m-20 -67.22 -33.3 75.07 Favored 'General case' 0 N--CA 1.453 -0.315 0 C-N-CA 123.704 0.802 . . . . 1.04 110.394 -179.147 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -136.04 84.24 31.54 Favored Pre-proline 0 C--O 1.236 0.373 0 C-N-CA 125.984 1.714 . . . . 0.43 110.233 -173.728 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 97.4 Cg_endo -81.48 48.78 2.98 Favored 'Trans proline' 0 CA--C 1.538 0.683 0 C-N-CA 123.567 2.845 . . . . 1.64 111.333 -175.791 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 2.3 ptmt -168.5 -53.55 0.02 OUTLIER 'General case' 0 N--CA 1.454 -0.231 0 C-N-CA 125.813 1.645 . . . . 2.35 110.173 -174.025 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 6.6 m -51.21 -46.6 62.27 Favored 'General case' 0 N--CA 1.464 0.274 0 CA-C-N 118.874 0.761 . . . . 0.44 111.674 179.404 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 7.6 t80 -57.47 -47.07 82.85 Favored 'General case' 0 CA--C 1.511 -0.544 0 CA-C-O 121.486 0.66 . . . . 1.91 111.149 178.678 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 12.6 tt0 -61.06 -31.1 70.77 Favored 'General case' 0 N--CA 1.441 -0.889 0 CA-C-N 115.052 -0.976 . . . . 1.85 110.185 -179.41 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -60.69 -60.21 4.16 Favored 'General case' 0 N--CA 1.46 0.047 0 C-N-CA 123.663 0.785 . . . . 1.05 109.09 -176.64 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 3.0 mp -53.81 -44.21 59.09 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.302 0 N-CA-C 108.783 -0.821 . . . . 0.79 108.783 175.964 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 52.6 t30 -60.34 -37.58 81.07 Favored 'General case' 0 CA--C 1.535 0.401 0 C-N-CA 120.336 -0.546 . . . . 1.64 112.137 -177.306 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -67.81 -42.55 81.37 Favored 'General case' 0 CA--C 1.533 0.317 0 C-N-CA 126.878 2.071 . . . . 3.15 108.946 -179.999 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 25.4 mm-40 -78.0 87.68 4.16 Favored 'General case' 0 N--CA 1.457 -0.1 0 O-C-N 120.866 -1.147 . . . . 2.71 109.656 170.702 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 2.0 tp -40.63 122.8 0.34 Allowed 'Isoleucine or valine' 0 CA--C 1.535 0.382 0 C-N-CA 124.168 0.987 . . . . 4.57 109.556 174.173 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.92 80.77 0.47 Allowed 'General case' 0 C--O 1.226 -0.153 0 C-N-CA 123.973 0.909 . . . . 9.42 109.542 -174.132 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 102' ' ' PHE . . . . . . . . . . . . . 0.8 OUTLIER -143.65 117.19 9.16 Favored 'General case' 0 N--CA 1.447 -0.583 0 N-CA-C 107.398 -1.334 . . . . 6.21 107.398 -172.198 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 19.1 tt -132.9 -38.77 0.51 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.233 0 C-N-CA 123.975 0.91 . . . . 5.18 110.773 -176.996 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 104' ' ' ILE . . . . . . . . . . . . . 6.6 tp -131.88 -57.73 0.83 Allowed 'Isoleucine or valine' 0 N--CA 1.453 -0.315 0 N-CA-C 108.021 -1.103 . . . . 6.5 108.021 177.235 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 59.3 t30 -154.13 173.17 16.43 Favored 'General case' 0 C--O 1.235 0.315 0 N-CA-C 107.535 -1.283 . . . . 7.64 107.535 174.386 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 20.3 t . . . . . 0 C--O 1.25 1.093 0 CA-C-O 115.739 -2.077 . . . . 10.45 108.285 155.326 . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.473 1.157 0 N-CA-C 110.496 -1.042 . . . . 11.43 110.496 . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -128.66 -44.97 1.33 Allowed 'General case' 0 C--O 1.223 -0.307 0 CA-C-N 117.399 0.599 . . . . 11.43 110.785 -148.785 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 58.18 -153.99 0.37 Allowed 'General case' 0 CA--C 1.538 0.509 0 CA-C-O 117.976 -1.011 . . . . 15.88 108.929 -171.722 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -107.08 -116.41 4.11 Favored Glycine 0 C--N 1.337 0.621 0 CA-C-N 119.469 1.032 . . . . 10.91 110.716 -166.168 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 19.7 m -77.59 -167.68 0.08 OUTLIER 'Isoleucine or valine' 0 N--CA 1.447 -0.62 0 N-CA-C 109.381 -0.6 . . . . 11.54 109.381 175.146 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 2.4 pm0 -76.7 112.48 13.32 Favored 'General case' 0 N--CA 1.443 -0.813 0 CA-C-O 122.767 1.27 . . . . 9.16 112.168 176.979 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 7' ' ' LEU . . . . . 0.46 HD22 ' H ' ' A' ' 7' ' ' LEU . 0.0 OUTLIER -147.88 43.85 1.07 Allowed 'General case' 0 N--CA 1.451 -0.402 0 C-N-CA 124.243 1.017 . . . . 7.38 110.033 175.35 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 42.3 mtp180 72.25 -61.57 0.49 Allowed 'General case' 0 N--CA 1.468 0.456 0 C-N-CA 126.61 1.964 . . . . 8.55 111.829 -179.251 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -50.82 -36.03 35.25 Favored 'General case' 0 CA--C 1.514 -0.426 0 C-N-CA 126.1 1.76 . . . . 3.81 113.578 177.912 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -55.68 -59.78 4.37 Favored 'General case' 0 C--N 1.323 -0.546 0 C-N-CA 123.614 0.766 . . . . 3.83 109.828 170.217 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 6.9 m -63.92 -49.05 74.17 Favored 'General case' 0 N--CA 1.449 -0.522 0 CA-C-O 121.901 0.858 . . . . 2.12 109.801 -168.83 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 6.7 pt-20 -66.22 -34.91 79.09 Favored 'General case' 0 N--CA 1.45 -0.453 0 CA-C-N 115.477 -0.783 . . . . 3.99 109.579 179.459 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -59.07 -45.91 94.55 Favored Glycine 0 CA--C 1.528 0.893 0 N-CA-C 111.526 -0.63 . . . . 0.98 111.526 172.779 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -59.84 -57.88 10.98 Favored 'General case' 0 N--CA 1.451 -0.407 0 C-N-CA 125.144 1.378 . . . . 3.7 108.441 -173.758 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 0.6 OUTLIER -69.41 -24.88 28.01 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.306 0 CA-C-N 115.815 -0.63 . . . . 0.64 112.317 179.631 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 1.0 OUTLIER -59.41 -54.14 50.13 Favored 'General case' 0 N--CA 1.455 -0.215 0 N-CA-C 106.753 -1.573 . . . . 0.48 106.753 175.28 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 2.6 mt-10 -59.45 -35.56 74.27 Favored 'General case' 0 CA--C 1.516 -0.348 0 CA-C-O 118.254 -0.879 . . . . 3.58 111.189 179.22 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 10.0 t80 -52.43 -47.47 66.35 Favored 'General case' 0 C--N 1.333 -0.146 0 CA-C-N 119.001 0.819 . . . . 3.17 110.815 173.984 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -49.75 -48.8 36.03 Favored Glycine 0 CA--C 1.525 0.658 0 N-CA-C 111.478 -0.649 . . . . 0.43 111.478 172.148 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 20' ' ' HIS . . . . . 0.513 ' CE1' ' HB1' ' A' ' 64' ' ' ALA . 1.8 t-160 -63.01 -41.74 99.64 Favored 'General case' 0 N--CA 1.454 -0.274 0 O-C-N 121.66 -0.906 . . . . 1.94 111.663 -178.504 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -62.14 -32.98 73.64 Favored 'General case' 0 N--CA 1.449 -0.482 0 N-CA-C 109.684 -0.487 . . . . 0.72 109.684 178.817 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 93.9 t -67.44 -40.35 84.38 Favored 'Isoleucine or valine' 0 C--O 1.233 0.209 0 C-N-CA 119.611 -0.836 . . . . 0.77 110.121 175.112 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -62.08 -20.02 63.57 Favored 'General case' 0 CA--C 1.527 0.088 0 CA-C-O 119.46 -0.305 . . . . 2.2 111.292 176.145 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 17.6 t70 -63.92 -57.27 10.3 Favored 'General case' 0 N--CA 1.454 -0.241 0 N-CA-C 109.076 -0.713 . . . . 2.91 109.076 -179.377 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 63.7 t80 -54.94 -52.48 62.85 Favored 'General case' 0 CA--C 1.521 -0.168 0 C-N-CA 123.196 0.598 . . . . 3.87 110.217 178.844 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -58.92 -34.69 72.01 Favored 'General case' 0 N--CA 1.45 -0.47 0 C-N-CA 120.364 -0.534 . . . . 0.93 111.282 -177.721 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -69.21 -46.97 55.62 Favored Glycine 0 C--O 1.224 -0.509 0 N-CA-C 110.359 -1.096 . . . . 1.1 110.359 178.209 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -54.67 -48.22 72.64 Favored 'General case' 0 N--CA 1.454 -0.254 0 C-N-CA 125.084 1.353 . . . . 2.23 110.029 -176.993 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 3.2 mm? -76.14 -41.03 51.26 Favored 'General case' 0 N--CA 1.445 -0.678 0 C-N-CA 123.847 0.859 . . . . 1.97 111.871 -178.423 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 11.2 mt -112.42 52.12 0.79 Allowed 'General case' 0 N--CA 1.454 -0.247 0 N-CA-C 107.713 -1.217 . . . . 2.37 107.713 -170.955 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 24.5 t0 -72.43 149.27 44.39 Favored 'General case' 0 CA--C 1.53 0.21 0 CA-C-N 115.525 -0.762 . . . . 6.49 110.983 -165.98 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 2.1 pttt -162.63 -43.25 0.04 OUTLIER 'General case' 0 N--CA 1.455 -0.204 0 C-N-CA 124.962 1.305 . . . . 12.45 111.113 -173.718 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 54.8 t-20 -113.89 110.56 20.3 Favored 'General case' 0 N--CA 1.45 -0.438 0 N-CA-C 108.091 -1.077 . . . . 9.09 108.091 -166.582 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 3.1 mt-30 -61.03 -11.62 8.91 Favored 'General case' 0 CA--C 1.534 0.336 0 N-CA-C 113.83 1.048 . . . . 7.69 113.83 -174.554 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 18.7 t -138.11 30.85 2.44 Favored 'General case' 0 N--CA 1.454 -0.23 0 CA-C-N 119.454 1.025 . . . . 8.37 110.806 177.697 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 5.2 t0 -150.73 -168.39 3.09 Favored 'General case' 0 CA--C 1.533 0.312 0 N-CA-C 107.465 -1.309 . . . . 8.06 107.465 167.763 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 3.3 mm? -117.96 -157.07 0.66 Allowed 'General case' 0 CA--C 1.536 0.415 0 N-CA-C 108.228 -1.027 . . . . 2.55 108.228 -175.91 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 14.0 p -57.1 -40.41 72.92 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.275 0 O-C-N 121.076 -1.015 . . . . 2.39 109.879 177.594 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 39' ' ' THR . . . . . . . . . . . . 0.264 1.0 OUTLIER 27.03 84.41 0.01 OUTLIER 'General case' 0 CA--C 1.55 0.979 0 C-N-CA 126.271 1.828 . . . . 2.87 113.218 175.697 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 76.0 m-20 53.86 27.74 7.57 Favored 'General case' 0 CA--C 1.537 0.472 0 C-N-CA 127.255 2.222 . . . . 7.88 116.581 174.983 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 58.1 m -36.19 -56.36 0.76 Allowed 'General case' 0 N--CA 1.47 0.539 0 N-CA-C 116.056 1.872 . . . . 3.19 116.056 -178.155 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 42' ' ' LYS . . . . . 0.414 ' O ' ' HE2' ' A' ' 42' ' ' LYS . 1.2 tmtt? -57.0 -32.64 66.33 Favored 'General case' 0 N--CA 1.465 0.288 0 CA-C-N 119.264 0.938 . . . . 7.04 112.181 -172.054 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 2.1 ttmp? -124.28 63.99 1.08 Allowed 'General case' 0 N--CA 1.453 -0.296 0 N-CA-C 106.388 -1.708 . . . . 7.32 106.388 172.6 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 37.6 p90 -46.32 114.07 0.74 Allowed 'General case' 0 N--CA 1.448 -0.527 0 C-N-CA 125.697 1.599 . . . . 5.31 110.067 -176.608 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . 0.269 0.1 OUTLIER 60.66 73.09 0.1 OUTLIER 'Isoleucine or valine' 0 CA--C 1.542 0.636 0 CA-C-O 123.107 1.432 . . . . 2.82 110.709 173.37 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 10.0 t0 -156.89 -60.73 0.09 Allowed 'General case' 0 N--CA 1.465 0.278 0 O-C-N 120.109 -1.62 . . . . 2.19 109.608 -179.083 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 9.4 mm -51.4 -51.8 22.82 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.481 0 C-N-CA 125.711 1.604 . . . . 0.45 108.651 173.79 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 32.5 t80 -62.5 -32.4 73.3 Favored 'General case' 0 N--CA 1.45 -0.448 0 O-C-N 120.422 -1.424 . . . . 0.41 113.357 175.728 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -63.42 -50.93 67.85 Favored 'General case' 0 N--CA 1.455 -0.186 0 C-N-CA 118.209 -1.396 . . . . 1.42 110.116 -176.135 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 31.3 mt-10 -79.94 -66.59 0.86 Allowed 'General case' 0 N--CA 1.454 -0.275 0 N-CA-C 108.669 -0.863 . . . . 3.71 108.669 -178.699 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 17.1 mp0 -71.83 -28.44 63.57 Favored 'General case' 0 C--O 1.236 0.384 0 O-C-N 121.865 -0.522 . . . . 2.63 110.589 -165.808 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 52' ' ' GLY . . . . . 0.401 ' HA2' ' CD1' ' A' ' 66' ' ' PHE . . . -70.6 38.74 0.48 Allowed Glycine 0 CA--C 1.529 0.91 0 C-N-CA 124.874 1.226 . . . . 0.35 113.686 169.603 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 36.1 p -148.88 29.94 0.81 Allowed 'General case' 0 N--CA 1.446 -0.645 0 O-C-N 120.832 -1.393 . . . . 1.79 109.983 158.328 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 2.7 t-20 -141.04 -42.1 0.39 Allowed 'General case' 0 CA--C 1.52 -0.199 0 N-CA-C 113.005 0.743 . . . . 1.95 113.005 -170.946 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 31.1 mt -59.18 -38.05 78.89 Favored 'General case' 0 N--CA 1.463 0.199 0 CA-C-O 120.874 0.369 . . . . 0.65 111.2 -175.66 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -179.12 171.1 1.38 Allowed 'General case' 0 CA--C 1.533 0.312 0 C-N-CA 125.356 1.462 . . . . 0.78 107.35 -179.585 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 13.3 m -61.63 -36.41 80.69 Favored 'General case' 0 CA--C 1.53 0.209 0 O-C-N 121.648 -0.657 . . . . 0.97 110.506 169.413 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -69.13 -4.31 16.87 Favored 'General case' 0 CA--C 1.533 0.321 0 N-CA-C 112.346 0.499 . . . . 1.32 112.346 172.82 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -91.87 -7.88 64.02 Favored Glycine 0 N--CA 1.444 -0.817 0 CA-C-O 118.66 -1.078 . . . . 0.52 111.071 173.632 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 4.1 tmt_? -111.8 -12.86 13.77 Favored 'General case' 0 C--N 1.338 0.082 0 CA-C-N 119.095 1.447 . . . . 2.92 112.162 -178.656 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 17.6 p -64.57 -161.09 0.01 OUTLIER 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 124.372 1.069 . . . . 0.84 109.542 168.439 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 85.8 m-20 -51.87 147.51 6.88 Favored 'General case' 0 C--N 1.34 0.165 0 O-C-N 120.699 -1.251 . . . . 1.59 111.162 -176.651 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 28.6 tt0 -60.74 -25.0 66.15 Favored 'General case' 0 CA--C 1.536 0.415 0 CA-C-O 121.775 0.798 . . . . 3.32 111.094 -175.829 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 64' ' ' ALA . . . . . 0.513 ' HB1' ' CE1' ' A' ' 20' ' ' HIS . . . -58.39 -47.16 84.77 Favored 'General case' 0 N--CA 1.452 -0.374 0 C-N-CA 124.823 1.249 . . . . 0.48 112.829 169.86 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 12.3 mt-10 -69.48 -42.52 74.7 Favored 'General case' 0 CA--C 1.514 -0.409 0 O-C-N 121.466 -0.771 . . . . 2.08 110.258 179.148 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 66' ' ' PHE . . . . . 0.401 ' CD1' ' HA2' ' A' ' 52' ' ' GLY . 53.9 t80 -49.34 -52.54 27.37 Favored 'General case' 0 N--CA 1.453 -0.297 0 C-N-CA 123.288 0.635 . . . . 0.37 110.814 174.462 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 75.8 t80 -59.78 -43.65 94.3 Favored 'General case' 0 N--CA 1.451 -0.415 0 C-N-CA 122.581 0.352 . . . . 0.39 110.842 177.55 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -62.27 -45.62 92.46 Favored 'General case' 0 CA--C 1.54 0.572 0 O-C-N 121.404 -0.81 . . . . 0.29 111.762 -176.404 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 15.2 mm-40 -59.93 -43.43 94.95 Favored 'General case' 0 CA--C 1.521 -0.141 0 C-N-CA 123.505 0.722 . . . . 4.13 109.651 173.318 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -55.77 -43.51 76.81 Favored 'General case' 0 N--CA 1.451 -0.412 0 N-CA-C 109.791 -0.448 . . . . 0.52 109.791 -179.705 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 7.2 t80 -61.28 -50.4 73.16 Favored 'General case' 0 CA--C 1.531 0.232 0 C-N-CA 123.065 0.546 . . . . 2.61 111.578 178.332 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 17.2 ttt180 -46.76 -59.36 3.1 Favored 'General case' 0 N--CA 1.468 0.426 0 C-N-CA 124.225 1.01 . . . . 2.22 109.789 175.251 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 73' ' ' LEU . . . . . 0.665 HD12 HG23 ' A' ' 85' ' ' VAL . 0.2 OUTLIER -65.16 -27.78 68.95 Favored 'General case' 0 N--CA 1.451 -0.412 0 C-N-CA 124.729 1.212 . . . . 0.58 110.748 -175.351 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 2.0 ttp -58.43 -39.93 81.12 Favored 'General case' 0 C--O 1.234 0.272 0 CA-C-O 121.306 0.574 . . . . 2.59 111.552 -178.052 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 13.7 p-80 -94.46 -42.96 8.58 Favored 'General case' 0 C--O 1.223 -0.31 0 CA-C-O 116.063 -1.923 . . . . 2.15 112.561 178.283 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 53.6 p 3.56 112.58 0.0 OUTLIER 'General case' 0 N--CA 1.472 0.643 0 C-N-CA 128.617 2.767 . . . . 2.22 114.602 -171.288 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 2.3 p -41.05 -44.43 2.43 Favored 'General case' 0 N--CA 1.455 -0.209 0 C-N-CA 125.703 1.601 . . . . 1.19 111.678 178.677 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 57.1 t0 -76.56 106.31 8.13 Favored 'General case' 0 N--CA 1.452 -0.349 0 C-N-CA 117.072 -1.851 . . . . 2.11 108.649 166.886 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 5.3 p-80 -42.44 -35.63 1.09 Allowed 'General case' 0 N--CA 1.454 -0.258 0 C-N-CA 124.474 1.11 . . . . 4.38 112.758 171.415 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -56.61 -47.88 78.67 Favored 'General case' 0 N--CA 1.449 -0.485 0 C-N-CA 123.149 0.58 . . . . 0.97 110.415 -178.955 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -54.37 -34.36 61.02 Favored 'General case' 0 CA--C 1.515 -0.374 0 C-N-CA 122.489 0.316 . . . . 3.75 111.343 -179.286 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 3.5 mtp-105 -63.28 -51.97 63.96 Favored 'General case' 0 N--CA 1.447 -0.588 0 N-CA-C 108.642 -0.873 . . . . 3.43 108.642 177.937 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 83' ' ' LEU . . . . . 0.403 HD13 ' HA ' ' A' ' 83' ' ' LEU . 2.4 mm? -61.42 -25.81 67.45 Favored 'General case' 0 N--CA 1.453 -0.315 0 CA-C-O 118.092 -0.956 . . . . 0.67 112.276 177.908 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 2.4 mptm? -62.53 -46.0 90.42 Favored 'General case' 0 CA--C 1.52 -0.19 0 CA-C-N 120.37 1.441 . . . . 1.41 108.504 173.681 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 85' ' ' VAL . . . . . 0.665 HG23 HD12 ' A' ' 73' ' ' LEU . 86.3 t -62.66 -63.75 0.77 Allowed 'Isoleucine or valine' 0 C--O 1.217 -0.652 0 CA-C-O 118.356 -0.831 . . . . 0.56 109.795 174.712 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -47.82 -51.01 24.28 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 119.53 1.059 . . . . 1.85 111.514 -171.869 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 13.5 pttp -66.06 -40.08 90.63 Favored 'General case' 0 CA--C 1.532 0.276 0 O-C-N 121.991 -0.443 . . . . 3.65 110.722 -177.24 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 55.1 m-20 -82.07 -7.43 59.61 Favored 'General case' 0 CA--C 1.534 0.351 0 CA-C-N 118.178 0.445 . . . . 0.95 111.244 -179.776 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -158.57 74.51 3.65 Favored Pre-proline 0 N--CA 1.448 -0.553 0 C-N-CA 125.477 1.511 . . . . 0.35 108.907 -170.326 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 67.8 Cg_endo -81.6 44.17 1.68 Allowed 'Trans proline' 0 CA--C 1.537 0.641 0 C-N-CA 124.234 3.289 . . . . 1.59 111.254 -174.947 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -160.95 -56.31 0.05 Allowed 'General case' 0 N--CA 1.451 -0.382 0 C-N-CA 125.636 1.574 . . . . 2.57 108.66 -176.1 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 2.5 m -49.22 -48.6 45.35 Favored 'General case' 0 N--CA 1.464 0.256 0 C-N-CA 123.822 0.849 . . . . 0.34 111.359 176.603 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 6.5 t80 -59.55 -51.19 70.89 Favored 'General case' 0 CA--C 1.509 -0.61 0 CA-C-O 121.348 0.594 . . . . 2.07 110.561 -179.301 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 32.2 tt0 -59.93 -28.19 67.41 Favored 'General case' 0 N--CA 1.442 -0.847 0 CA-C-N 114.928 -1.033 . . . . 1.83 110.207 -178.315 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 8.4 t80 -65.35 -56.93 9.87 Favored 'General case' 0 N--CA 1.452 -0.333 0 C-N-CA 124.068 0.947 . . . . 1.6 109.423 -175.136 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 3.4 mp -59.06 -41.51 83.65 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.161 0 N-CA-C 108.924 -0.769 . . . . 0.89 108.924 174.832 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -60.13 -30.44 69.29 Favored 'General case' 0 CA--C 1.536 0.419 0 CA-C-N 118.03 0.377 . . . . 1.69 111.208 -178.85 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 10.3 t70 -70.69 -45.02 65.78 Favored 'General case' 0 CA--C 1.522 -0.102 0 C-N-CA 123.771 0.828 . . . . 2.34 109.302 177.104 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 54.0 mm-40 -63.13 -56.29 18.07 Favored 'General case' 0 N--CA 1.451 -0.405 0 CA-C-N 115.861 -0.609 . . . . 2.76 111.088 -176.501 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -74.36 87.54 0.58 Allowed 'Isoleucine or valine' 0 CA--C 1.532 0.256 0 CA-C-O 121.924 0.869 . . . . 4.97 110.455 -175.997 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 2.8 mmpt? -115.47 -63.29 1.48 Allowed 'General case' 0 CA--C 1.52 -0.206 0 C-N-CA 123.897 0.879 . . . . 10.67 108.659 176.13 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 102' ' ' PHE . . . . . . . . . . . . . 26.3 m-85 -141.81 121.29 13.25 Favored 'General case' 0 N--CA 1.45 -0.462 0 N-CA-C 106.257 -1.757 . . . . 8.82 106.257 172.41 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -133.87 -50.83 0.62 Allowed 'Isoleucine or valine' 0 N--CA 1.455 -0.212 0 N-CA-C 108.011 -1.107 . . . . 6.24 108.011 174.328 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 104' ' ' ILE . . . . . . . . . . . . . 9.5 tt -145.59 179.6 1.09 Allowed 'Isoleucine or valine' 0 N--CA 1.452 -0.337 0 N-CA-C 106.543 -1.651 . . . . 7.15 106.543 169.618 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 49.9 t30 -137.39 139.71 40.91 Favored 'General case' 0 N--CA 1.455 -0.223 0 N-CA-C 107.994 -1.113 . . . . 11.33 107.994 178.462 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 49.3 m . . . . . 0 C--O 1.249 1.056 0 CA-C-O 116.975 -1.488 . . . . 10.29 110.384 -159.147 . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.47 0.958 0 N-CA-C 107.16 -2.376 . . . . 18.29 107.16 . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 14.8 m 61.44 170.5 0.11 Allowed 'General case' 0 CA--C 1.536 0.441 0 O-C-N 124.393 0.702 . . . . 19.41 110.563 -160.315 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 17.4 ptpt -155.4 158.57 38.85 Favored 'General case' 0 N--CA 1.458 -0.071 0 N-CA-C 108.082 -1.081 . . . . 27.79 108.082 174.436 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 161.19 162.88 13.23 Favored Glycine 0 N--CA 1.451 -0.313 0 N-CA-C 109.44 -1.464 . . . . 18.16 109.44 176.581 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 5' ' ' VAL . . . . . 0.514 HG23 HD11 ' A' ' 7' ' ' LEU . 0.2 OUTLIER -74.96 -176.94 0.26 Allowed 'Isoleucine or valine' 0 N--CA 1.445 -0.697 0 CA-C-O 121.184 0.516 . . . . 17.61 110.392 164.564 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 7.8 pt-20 -108.85 109.69 20.85 Favored 'General case' 0 N--CA 1.44 -0.928 0 C-N-CA 123.865 0.866 . . . . 12.7 110.331 -170.832 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 7' ' ' LEU . . . . . 0.514 HD11 HG23 ' A' ' 5' ' ' VAL . 0.0 OUTLIER -150.21 26.18 0.79 Allowed 'General case' 0 N--CA 1.454 -0.271 0 C-N-CA 125.881 1.672 . . . . 11.0 110.974 -175.658 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 41.0 mtp180 -150.35 119.07 6.56 Favored 'General case' 0 N--CA 1.452 -0.352 0 N-CA-C 107.857 -1.164 . . . . 11.29 107.857 172.889 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 2.3 m120 -51.51 -33.65 32.67 Favored 'General case' 0 C--O 1.221 -0.418 0 C-N-CA 123.739 0.816 . . . . 2.97 111.65 169.875 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 7.1 t0 -57.85 -52.13 66.76 Favored 'General case' 0 N--CA 1.447 -0.601 0 C-N-CA 124.04 0.936 . . . . 2.64 110.61 175.438 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 13.4 m -69.41 -46.84 65.88 Favored 'General case' 0 CA--C 1.534 0.355 0 O-C-N 120.968 -1.082 . . . . 1.9 112.338 -179.764 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 1.9 mt-10 -62.81 -36.29 82.69 Favored 'General case' 0 N--CA 1.464 0.225 0 CA-C-O 122.175 0.988 . . . . 3.28 109.8 -179.048 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -65.42 -50.85 53.34 Favored Glycine 0 N--CA 1.449 -0.464 0 N-CA-C 109.231 -1.547 . . . . 0.75 109.231 175.215 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -48.92 -59.11 3.87 Favored 'General case' 0 C--O 1.224 -0.277 0 C-N-CA 124.527 1.131 . . . . 3.71 110.464 -179.114 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 0.5 OUTLIER -61.92 -34.67 64.03 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.348 0 O-C-N 121.709 -0.619 . . . . 0.38 111.948 -176.505 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 6.6 t60 -60.05 -55.52 32.92 Favored 'General case' 0 CA--C 1.532 0.269 0 N-CA-C 107.207 -1.405 . . . . 0.55 107.207 178.051 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 31.7 mt-10 -56.87 -38.29 72.53 Favored 'General case' 0 N--CA 1.453 -0.301 0 C-N-CA 124.152 0.981 . . . . 1.94 111.832 178.654 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 1.7 m-85 -54.94 -49.17 72.01 Favored 'General case' 0 CA--C 1.517 -0.295 0 CA-C-N 119.42 1.009 . . . . 3.08 109.661 176.165 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -50.01 -45.87 41.75 Favored Glycine 0 CA--C 1.525 0.694 0 N-CA-C 110.804 -0.918 . . . . 0.42 110.804 174.866 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 4.0 t-80 -62.16 -45.6 92.69 Favored 'General case' 0 N--CA 1.451 -0.398 0 O-C-N 121.896 -0.767 . . . . 1.79 111.783 179.458 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -64.61 -28.0 69.33 Favored 'General case' 0 N--CA 1.454 -0.271 0 O-C-N 121.199 -0.938 . . . . 0.61 110.228 179.619 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 92.7 t -71.67 -37.45 63.04 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.168 0 O-C-N 120.921 -1.112 . . . . 0.72 109.682 176.242 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 8.6 t70 -56.78 -30.19 63.41 Favored 'General case' 0 C--N 1.334 -0.101 0 CA-C-O 121.179 0.514 . . . . 2.23 111.136 172.895 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 22.7 t70 -68.61 -50.17 53.56 Favored 'General case' 0 N--CA 1.452 -0.346 0 N-CA-C 108.885 -0.783 . . . . 2.13 108.885 -176.536 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 44.2 t80 -58.46 -45.28 88.91 Favored 'General case' 0 N--CA 1.455 -0.206 0 CA-C-N 116.127 -0.488 . . . . 3.1 110.507 177.665 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -57.77 -35.82 71.28 Favored 'General case' 0 N--CA 1.454 -0.245 0 CA-C-O 119.259 -0.401 . . . . 0.99 111.299 176.789 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -62.87 -61.58 6.32 Favored Glycine 0 C--N 1.333 0.376 0 N-CA-C 109.759 -1.336 . . . . 1.22 109.759 176.018 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -50.61 -50.11 54.9 Favored 'General case' 0 N--CA 1.454 -0.247 0 C-N-CA 125.015 1.326 . . . . 2.03 111.069 -174.136 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -76.53 -33.87 58.57 Favored 'General case' 0 CA--C 1.514 -0.44 0 N-CA-C 112.851 0.685 . . . . 1.39 112.851 -175.701 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 10.1 mt -112.99 33.04 5.28 Favored 'General case' 0 N--CA 1.455 -0.22 0 N-CA-C 108.861 -0.792 . . . . 2.31 108.861 -171.127 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 65.8 t0 -57.27 131.42 49.96 Favored 'General case' 0 N--CA 1.452 -0.365 0 C-N-CA 124.362 1.065 . . . . 6.26 108.857 179.511 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 5.1 ptmt -176.83 -43.88 0.01 OUTLIER 'General case' 0 CA--C 1.517 -0.295 0 C-N-CA 124.649 1.18 . . . . 8.84 109.987 -174.859 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -74.91 164.61 26.38 Favored 'General case' 0 N--CA 1.449 -0.509 0 N-CA-C 108.118 -1.067 . . . . 9.12 108.118 175.138 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 1.2 mm-40 -66.3 -27.88 68.26 Favored 'General case' 0 CA--C 1.533 0.319 0 C-N-CA 120.213 -0.595 . . . . 7.29 110.119 172.806 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 3.1 m -59.74 134.1 56.71 Favored 'General case' 0 N--CA 1.449 -0.491 0 C-N-CA 124.522 1.129 . . . . 6.21 112.061 178.165 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 38.5 t70 -67.9 -24.27 65.2 Favored 'General case' 0 CA--C 1.536 0.425 0 C-N-CA 124.9 1.28 . . . . 5.61 112.66 179.846 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 4.2 mp -117.62 175.05 5.82 Favored 'General case' 0 CA--C 1.528 0.097 0 N-CA-C 108.266 -1.013 . . . . 1.96 108.266 175.269 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 11.5 p -71.81 9.21 0.34 Allowed 'Isoleucine or valine' 0 CA--C 1.552 1.032 0 O-C-N 121.173 -0.954 . . . . 2.32 112.917 -177.036 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 10.0 t -59.53 84.59 0.01 OUTLIER 'General case' 0 CA--C 1.537 0.473 0 C-N-CA 127.971 2.508 . . . . 4.11 110.753 175.358 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER 171.2 -35.87 0.0 OUTLIER 'General case' 0 N--CA 1.463 0.22 0 C-N-CA 126.064 1.746 . . . . 6.27 111.741 174.102 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 7.6 t -68.88 174.23 4.61 Favored 'General case' 0 CA--C 1.535 0.376 0 CA-C-O 121.314 0.578 . . . . 3.74 112.291 -167.432 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 26.9 tptt 70.05 98.78 0.06 Allowed 'General case' 0 CA--C 1.53 0.21 0 C-N-CA 126.999 2.119 . . . . 7.04 108.727 -167.791 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 2.9 mmpt? 49.26 -113.43 0.61 Allowed 'General case' 0 CA--C 1.531 0.245 0 CA-C-O 117.762 -1.113 . . . . 7.18 108.269 -166.772 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -142.83 92.62 2.42 Favored 'General case' 0 N--CA 1.453 -0.285 0 CA-C-N 119.684 1.129 . . . . 4.7 108.015 176.668 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . 0.259 10.2 tt 49.69 21.18 0.09 OUTLIER 'Isoleucine or valine' 0 CA--C 1.549 0.921 0 C-N-CA 126.562 1.945 . . . . 2.92 113.552 177.103 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 6.8 m-20 -65.39 -44.62 86.93 Favored 'General case' 0 N--CA 1.463 0.177 0 O-C-N 120.557 -1.339 . . . . 3.61 111.271 -170.389 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 3.2 mm -53.13 -50.96 43.35 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.232 0 C-N-CA 124.268 1.027 . . . . 0.47 109.416 -176.259 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 24.6 t80 -64.07 -36.76 85.07 Favored 'General case' 0 N--CA 1.451 -0.378 0 O-C-N 121.614 -0.679 . . . . 0.38 111.396 177.15 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 49' ' ' LYS . . . . . 0.514 ' HA ' ' HE2' ' A' ' 49' ' ' LYS . 0.3 OUTLIER -60.3 -47.2 87.04 Favored 'General case' 0 C--N 1.33 -0.246 0 C-N-CA 118.791 -1.164 . . . . 1.09 111.615 -177.292 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 3.5 tp10 -86.42 -59.64 2.22 Favored 'General case' 0 CA--C 1.532 0.268 0 CA-C-O 121.871 0.843 . . . . 2.89 109.598 -176.27 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 19.2 mm-40 -73.57 -28.84 62.06 Favored 'General case' 0 CA--C 1.535 0.402 0 O-C-N 121.654 -0.654 . . . . 2.19 110.621 -170.131 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -68.06 40.57 0.26 Allowed Glycine 0 CA--C 1.531 1.05 0 C-N-CA 126.509 2.004 . . . . 0.33 114.715 172.332 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 20.9 t -146.45 22.59 1.31 Allowed 'General case' 0 N--CA 1.45 -0.432 0 O-C-N 120.778 -1.425 . . . . 1.9 110.019 156.679 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -135.53 -23.3 1.44 Allowed 'General case' 0 C--N 1.342 0.282 0 N-CA-C 113.712 1.005 . . . . 2.22 113.712 -167.539 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 22.0 mt -71.48 -41.65 69.09 Favored 'General case' 0 C--N 1.331 -0.233 0 O-C-N 121.404 -0.81 . . . . 0.42 109.919 175.99 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 1.7 t 179.13 175.16 0.67 Allowed 'General case' 0 CA--C 1.533 0.305 0 C-N-CA 125.408 1.483 . . . . 0.52 107.939 -174.741 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 39.4 t -60.88 -36.02 78.13 Favored 'General case' 0 CA--C 1.532 0.288 0 O-C-N 121.688 -0.632 . . . . 2.17 109.781 168.888 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -65.59 -11.64 46.05 Favored 'General case' 0 N--CA 1.465 0.285 0 N-CA-C 112.468 0.544 . . . . 1.01 112.468 174.581 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -88.61 -7.17 72.2 Favored Glycine 0 C--O 1.221 -0.688 0 CA-C-O 119.124 -0.82 . . . . 0.39 111.117 176.31 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 64.1 ttt180 -113.52 -14.1 12.72 Favored 'General case' 0 N--CA 1.458 -0.07 0 CA-C-N 118.875 1.337 . . . . 3.48 112.036 -178.672 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 19.9 p -64.48 -159.03 0.01 OUTLIER 'General case' 0 CA--C 1.539 0.536 0 C-N-CA 123.408 0.683 . . . . 0.78 109.432 168.582 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 3.8 t-20 -53.05 145.85 12.35 Favored 'General case' 0 CA--C 1.53 0.196 0 O-C-N 120.403 -1.436 . . . . 1.75 110.271 -176.305 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -59.56 -31.87 69.83 Favored 'General case' 0 CA--C 1.535 0.368 0 CA-C-O 121.461 0.648 . . . . 3.36 110.663 -176.278 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -58.59 -36.19 73.6 Favored 'General case' 0 N--CA 1.453 -0.311 0 N-CA-C 112.968 0.729 . . . . 0.41 112.968 174.531 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 8.1 mt-10 -70.93 -48.57 52.79 Favored 'General case' 0 CA--C 1.511 -0.533 0 CA-C-O 118.301 -0.857 . . . . 2.22 110.261 174.599 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 30.6 t80 -46.49 -47.05 19.42 Favored 'General case' 0 CA--C 1.533 0.305 0 C-N-CA 124.385 1.074 . . . . 0.28 111.448 175.145 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 78.9 t80 -65.33 -44.38 87.96 Favored 'General case' 0 CA--C 1.537 0.447 0 O-C-N 121.172 -0.955 . . . . 0.45 111.12 177.29 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -66.16 -51.34 58.77 Favored 'General case' 0 CA--C 1.539 0.554 0 C-N-CA 123.959 0.904 . . . . 0.28 112.668 -174.331 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -60.72 -40.06 90.92 Favored 'General case' 0 C--N 1.332 -0.186 0 O-C-N 120.858 -1.151 . . . . 3.59 110.618 172.451 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -56.18 -40.68 74.31 Favored 'General case' 0 C--O 1.222 -0.362 0 CA-C-N 118.727 0.694 . . . . 0.51 110.176 174.72 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -55.75 -49.89 71.88 Favored 'General case' 0 N--CA 1.465 0.298 0 C-N-CA 124.513 1.125 . . . . 3.45 111.833 172.137 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -50.8 -56.65 11.11 Favored 'General case' 0 CA--C 1.531 0.236 0 N-CA-C 109.222 -0.659 . . . . 3.93 109.222 176.739 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 73' ' ' LEU . . . . . 0.591 ' CB ' HG21 ' A' ' 85' ' ' VAL . 0.1 OUTLIER -66.4 -25.91 66.99 Favored 'General case' 0 C--N 1.327 -0.402 0 C-N-CA 124.346 1.059 . . . . 0.49 111.236 -175.511 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 74' ' ' MET . . . . . 0.403 ' HA ' ' CE2' ' A' ' 93' ' ' PHE . 0.2 OUTLIER -63.49 -39.16 93.71 Favored 'General case' 0 C--O 1.231 0.125 0 CA-C-N 118.646 0.657 . . . . 2.34 109.912 -179.42 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 7.1 p80 -97.62 -9.72 26.4 Favored 'General case' 0 CA--C 1.531 0.246 0 CA-C-O 116.277 -1.821 . . . . 0.97 114.191 179.331 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 5.1 m -36.2 114.88 0.31 Allowed 'General case' 0 CA--C 1.512 -0.511 0 CA-C-N 120.698 1.59 . . . . 1.12 111.162 -173.303 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -51.62 -37.25 49.3 Favored 'General case' 0 N--CA 1.448 -0.568 0 CA-C-N 114.259 -1.337 . . . . 1.04 110.7 -173.67 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 53.9 t0 -73.41 107.19 5.57 Favored 'General case' 0 N--CA 1.452 -0.365 0 C-N-CA 116.95 -1.9 . . . . 2.4 109.563 164.955 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 20.9 p-80 -38.97 -38.22 0.43 Allowed 'General case' 0 N--CA 1.454 -0.234 0 C-N-CA 125.247 1.419 . . . . 4.59 112.5 169.431 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -53.89 -54.67 35.48 Favored 'General case' 0 N--CA 1.449 -0.485 0 CA-C-N 118.197 0.453 . . . . 0.58 109.789 -179.23 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -57.06 -35.88 69.86 Favored 'General case' 0 CA--C 1.514 -0.431 0 C-N-CA 122.957 0.503 . . . . 4.58 111.852 -175.238 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 22.0 mtp180 -61.97 -50.03 73.74 Favored 'General case' 0 N--CA 1.449 -0.52 0 C-N-CA 119.744 -0.783 . . . . 2.26 109.397 175.987 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 1.6 mm? -67.24 -18.54 65.27 Favored 'General case' 0 N--CA 1.456 -0.17 0 CA-C-O 118.093 -0.956 . . . . 0.53 113.41 176.743 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 2.5 mptm? -65.44 -50.47 65.27 Favored 'General case' 0 CA--C 1.517 -0.294 0 CA-C-N 120.65 1.568 . . . . 1.41 107.413 169.827 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 85' ' ' VAL . . . . . 0.591 HG21 ' CB ' ' A' ' 73' ' ' LEU . 94.4 t -57.39 -50.17 77.81 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.528 0 CA-C-O 118.85 -0.595 . . . . 0.47 110.458 176.387 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -62.38 -52.56 63.13 Favored 'General case' 0 N--CA 1.45 -0.432 0 CA-C-N 119.472 1.033 . . . . 2.21 111.223 -173.518 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 29.5 pttt -63.58 -40.25 96.47 Favored 'General case' 0 CA--C 1.53 0.176 0 O-C-N 121.78 -0.575 . . . . 2.49 109.96 -175.531 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 50.8 m-20 -72.14 -28.47 63.28 Favored 'General case' 0 C--O 1.224 -0.249 0 C-N-CA 122.763 0.425 . . . . 0.99 110.635 -178.855 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -141.43 74.7 23.64 Favored Pre-proline 0 C--O 1.237 0.419 0 C-N-CA 125.901 1.68 . . . . 0.42 108.914 -170.559 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 85.5 Cg_endo -78.29 68.55 7.9 Favored 'Trans proline' 0 N--CA 1.457 -0.655 0 C-N-CA 123.874 3.05 . . . . 1.86 110.146 -171.307 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 1.2 ptmt 166.47 -55.23 0.0 OUTLIER 'General case' 0 C--O 1.224 -0.272 0 C-N-CA 126.432 1.893 . . . . 2.18 111.204 -167.083 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 6.0 m -56.47 -44.03 80.18 Favored 'General case' 0 CA--C 1.518 -0.265 0 CA-C-N 120.071 1.305 . . . . 0.48 110.514 -178.404 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 93' ' ' PHE . . . . . 0.403 ' CE2' ' HA ' ' A' ' 74' ' ' MET . 13.9 t80 -57.16 -48.87 77.65 Favored 'General case' 0 CA--C 1.513 -0.475 0 C-N-CA 120.073 -0.651 . . . . 2.01 110.68 175.865 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 19.3 tt0 -59.87 -28.97 67.99 Favored 'General case' 0 N--CA 1.443 -0.779 0 CA-C-N 114.93 -1.032 . . . . 1.64 110.844 -179.104 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 2.6 t80 -63.26 -57.02 11.81 Favored 'General case' 0 N--CA 1.457 -0.113 0 C-N-CA 124.258 1.023 . . . . 1.12 109.133 -176.213 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 3.3 mp -60.24 -42.69 91.35 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.302 0 N-CA-C 108.498 -0.927 . . . . 0.84 108.498 177.069 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 12.8 t-20 -56.89 -36.34 70.0 Favored 'General case' 0 CA--C 1.537 0.466 0 CA-C-N 117.836 0.289 . . . . 1.9 111.589 -177.892 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -58.79 -49.75 76.5 Favored 'General case' 0 N--CA 1.462 0.144 0 C-N-CA 125.172 1.389 . . . . 2.13 109.399 175.756 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 13.3 mm-40 -77.72 84.86 4.04 Favored 'General case' 0 N--CA 1.451 -0.392 0 CA-C-N 115.986 -0.552 . . . . 2.64 109.92 179.954 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 2.2 pp -45.26 125.92 1.25 Allowed 'Isoleucine or valine' 0 CA--C 1.535 0.374 0 C-N-CA 124.352 1.061 . . . . 5.48 111.664 -178.22 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -77.84 79.32 4.32 Favored 'General case' 0 N--CA 1.457 -0.084 0 O-C-N 121.537 -0.727 . . . . 10.94 110.077 -174.6 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 102' ' ' PHE . . . . . . . . . . . . . 9.4 t80 -142.69 99.93 3.57 Favored 'General case' 0 N--CA 1.454 -0.247 0 O-C-N 121.632 -0.667 . . . . 6.63 109.222 178.077 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 6.7 tp -147.18 28.58 0.15 Allowed 'Isoleucine or valine' 0 CA--C 1.535 0.366 0 CA-C-O 121.663 0.744 . . . . 3.73 111.019 -177.946 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 104' ' ' ILE . . . . . . . . . . . . . 16.1 tt -154.92 146.85 13.29 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.241 0 N-CA-C 106.916 -1.513 . . . . 6.47 106.916 179.788 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 79.5 m-20 53.4 84.73 0.06 Allowed 'General case' 0 N--CA 1.463 0.207 0 C-N-CA 124.785 1.234 . . . . 7.2 110.972 -168.927 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 22.9 t . . . . . 0 C--O 1.25 1.122 0 CA-C-O 115.963 -1.97 . . . . 11.98 107.452 176.353 . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.471 0.989 0 N-CA-C 108.804 -1.718 . . . . 19.44 108.804 . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 12.4 m -155.41 172.84 17.56 Favored 'General case' 0 C--N 1.332 -0.163 0 N-CA-C 107.747 -1.205 . . . . 19.33 107.747 -176.211 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 3.9 ptpp? -155.36 157.08 36.55 Favored 'General case' 0 N--CA 1.457 -0.093 0 N-CA-C 108.861 -0.792 . . . . 25.32 108.861 -179.585 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 118.73 -168.03 13.18 Favored Glycine 0 C--N 1.332 0.326 0 N-CA-C 108.827 -1.709 . . . . 18.41 108.827 -175.092 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 34.4 m -78.72 -177.66 0.33 Allowed 'Isoleucine or valine' 0 N--CA 1.444 -0.756 0 N-CA-C 109.14 -0.689 . . . . 17.42 109.14 165.76 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 2.8 pm0 -77.7 121.03 23.45 Favored 'General case' 0 N--CA 1.449 -0.498 0 N-CA-C 113.146 0.795 . . . . 11.99 113.146 177.987 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -113.01 19.94 16.8 Favored 'General case' 0 C--N 1.343 0.293 0 C-N-CA 123.798 0.839 . . . . 10.05 111.263 -179.508 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 20.3 mtp180 -146.51 114.15 6.4 Favored 'General case' 0 N--CA 1.446 -0.656 0 N-CA-C 107.441 -1.318 . . . . 10.51 107.441 -172.799 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -47.18 -34.37 6.22 Favored 'General case' 0 C--O 1.222 -0.374 0 C-N-CA 124.956 1.302 . . . . 2.98 111.228 166.627 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -58.28 -51.81 68.22 Favored 'General case' 0 N--CA 1.449 -0.497 0 C-N-CA 123.523 0.729 . . . . 2.85 111.294 173.79 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 17.2 m -65.01 -53.29 48.4 Favored 'General case' 0 CA--C 1.53 0.208 0 CA-C-N 118.971 0.805 . . . . 1.73 111.653 -178.385 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 12' ' ' GLU . . . . . 0.431 ' HB2' ' CZ ' ' A' ' 72' ' ' ARG . 16.2 pt-20 -70.2 -27.47 64.52 Favored 'General case' 0 CA--C 1.533 0.291 0 CA-C-O 121.707 0.765 . . . . 3.86 110.483 -175.25 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -66.63 -47.6 67.58 Favored Glycine 0 N--CA 1.446 -0.698 0 N-CA-C 109.147 -1.581 . . . . 0.61 109.147 172.313 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -54.31 -52.32 61.87 Favored 'General case' 0 CA--C 1.52 -0.175 0 CA-C-N 117.794 0.797 . . . . 3.68 110.638 -173.712 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 0.7 OUTLIER -64.59 -38.88 83.77 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.303 0 N-CA-C 112.069 0.396 . . . . 0.45 112.069 179.354 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 12.4 t60 -59.29 -56.18 25.37 Favored 'General case' 0 CA--C 1.53 0.184 0 N-CA-C 107.741 -1.207 . . . . 0.54 107.741 -179.67 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 34.3 mt-10 -57.87 -37.55 74.13 Favored 'General case' 0 N--CA 1.451 -0.418 0 C-N-CA 124.406 1.083 . . . . 2.42 111.057 178.507 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -54.47 -52.15 62.77 Favored 'General case' 0 CA--C 1.521 -0.165 0 CA-C-N 119.457 1.026 . . . . 3.48 109.871 173.878 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -47.82 -46.37 25.23 Favored Glycine 0 CA--C 1.526 0.75 0 N-CA-C 110.696 -0.961 . . . . 0.58 110.696 173.849 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 8.1 t-80 -65.66 -45.97 80.9 Favored 'General case' 0 N--CA 1.454 -0.248 0 O-C-N 121.951 -0.735 . . . . 1.8 112.272 -177.883 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -61.78 -34.32 75.68 Favored 'General case' 0 N--CA 1.452 -0.353 0 O-C-N 120.925 -1.109 . . . . 1.1 109.123 179.298 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 94.2 t -76.77 -26.88 16.48 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.428 0 C-N-CA 120.233 -0.587 . . . . 1.63 110.284 179.509 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 34.7 t0 -57.87 -36.93 73.06 Favored 'General case' 0 N--CA 1.456 -0.171 0 CA-C-O 121.953 0.883 . . . . 2.35 110.328 172.141 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 17.6 t70 -69.36 -53.13 21.05 Favored 'General case' 0 N--CA 1.449 -0.491 0 CA-C-O 121.78 0.8 . . . . 2.65 108.948 -175.876 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 36.1 t80 -65.87 -50.91 62.83 Favored 'General case' 0 N--CA 1.452 -0.326 0 CA-C-N 115.463 -0.789 . . . . 2.31 109.494 -173.858 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -53.21 -37.92 62.44 Favored 'General case' 0 N--CA 1.451 -0.388 0 C-N-CA 123.885 0.874 . . . . 1.73 111.264 174.24 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -58.01 -54.4 37.81 Favored Glycine 0 C--N 1.334 0.461 0 N-CA-C 109.762 -1.335 . . . . 2.57 109.762 178.484 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 2.1 t80 -63.2 -46.15 88.4 Favored 'General case' 0 CA--C 1.533 0.303 0 CA-C-O 120.906 0.384 . . . . 4.83 110.961 -177.036 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -73.8 -27.78 61.3 Favored 'General case' 0 N--CA 1.449 -0.521 0 N-CA-C 114.435 1.272 . . . . 3.01 114.435 -171.921 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 38.7 mt -120.42 -70.82 0.77 Allowed 'General case' 0 N--CA 1.463 0.176 0 CA-C-N 119.783 1.174 . . . . 4.91 113.073 -161.074 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 23.3 t0 -62.25 122.33 15.37 Favored 'General case' 0 C--N 1.337 0.042 0 N-CA-C 109.458 -0.571 . . . . 7.15 109.458 -165.886 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 18.3 tptm -63.0 -19.81 64.71 Favored 'General case' 0 C--O 1.226 -0.152 0 N-CA-C 112.211 0.448 . . . . 9.71 112.211 -165.448 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 18.4 t-20 -60.87 -41.19 95.46 Favored 'General case' 0 CA--C 1.531 0.228 0 C-N-CA 123.009 0.524 . . . . 8.49 111.031 174.87 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 1.1 tm0? 73.62 -30.79 0.21 Allowed 'General case' 0 CA--C 1.531 0.234 0 C-N-CA 127.183 2.193 . . . . 9.69 112.875 -177.425 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 14.3 m -67.36 162.31 23.2 Favored 'General case' 0 CA--C 1.531 0.247 0 CA-C-N 119.191 0.905 . . . . 6.76 109.701 171.639 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 64.9 m-20 60.89 -145.65 0.46 Allowed 'General case' 0 CA--C 1.535 0.378 0 C-N-CA 124.726 1.21 . . . . 7.77 110.831 -179.361 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 4.2 mp -123.24 -165.16 1.28 Allowed 'General case' 0 CA--C 1.532 0.282 0 N-CA-C 106.986 -1.487 . . . . 3.1 106.986 -179.56 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 9.8 p -83.25 43.23 0.05 OUTLIER 'Isoleucine or valine' 0 CA--C 1.538 0.503 0 CA-C-N 120.667 1.576 . . . . 3.32 110.089 177.702 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 13.3 t -143.78 139.31 29.31 Favored 'General case' 0 N--CA 1.446 -0.63 0 N-CA-C 104.836 -2.283 . . . . 4.2 104.836 169.616 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 5.4 p30 131.39 -48.16 0.01 OUTLIER 'General case' 0 N--CA 1.47 0.545 0 C-N-CA 130.494 3.518 . . . . 6.38 108.024 -168.252 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 9.9 t -76.86 179.19 6.3 Favored 'General case' 0 N--CA 1.454 -0.256 0 C-N-CA 124.531 1.132 . . . . 3.7 110.997 -168.458 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 42' ' ' LYS . . . . . 0.43 ' HE3' ' OD2' ' A' ' 98' ' ' ASP . 21.4 tttm 71.05 -53.9 0.67 Allowed 'General case' 0 N--CA 1.467 0.412 0 C-N-CA 126.705 2.002 . . . . 6.89 113.016 -177.187 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 9.7 ttmm -139.52 106.39 5.41 Favored 'General case' 0 N--CA 1.454 -0.242 0 N-CA-C 105.272 -2.121 . . . . 7.2 105.272 176.106 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -51.44 96.57 0.01 OUTLIER 'General case' 0 N--CA 1.465 0.324 0 C-N-CA 125.637 1.575 . . . . 4.75 112.334 -161.404 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 5.9 tt 38.59 38.45 0.2 Allowed 'Isoleucine or valine' 0 CA--C 1.541 0.605 0 C-N-CA 126.023 1.729 . . . . 2.28 111.51 -174.701 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 2.5 m-20 -92.92 -43.3 9.02 Favored 'General case' 0 CA--C 1.521 -0.169 0 O-C-N 120.773 -1.204 . . . . 3.28 109.072 -177.162 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 11.3 mm -49.52 -56.6 2.81 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.229 0 C-N-CA 125.329 1.451 . . . . 0.69 108.922 -178.443 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 28.9 t80 -61.69 -37.5 84.37 Favored 'General case' 0 N--CA 1.453 -0.311 0 C-N-CA 124.614 1.166 . . . . 0.51 112.337 175.551 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 49' ' ' LYS . . . . . 0.464 ' HA ' ' HE2' ' A' ' 49' ' ' LYS . 0.2 OUTLIER -62.0 -45.17 94.77 Favored 'General case' 0 CA--C 1.519 -0.218 0 CA-C-N 119.652 1.115 . . . . 1.37 111.1 -175.502 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 2.9 tp10 -80.19 -67.51 0.76 Allowed 'General case' 0 N--CA 1.451 -0.425 0 CA-C-O 122.387 1.089 . . . . 2.62 108.962 179.074 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 51' ' ' GLU . . . . . 0.583 ' OE2' ' HE2' ' A' ' 91' ' ' LYS . 59.2 mm-40 -76.45 -19.69 57.8 Favored 'General case' 0 N--CA 1.453 -0.293 0 C-N-CA 123.389 0.675 . . . . 3.05 111.51 -164.773 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -68.83 36.31 0.28 Allowed Glycine 0 CA--C 1.532 1.145 0 C-N-CA 124.393 0.997 . . . . 0.6 113.12 167.684 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 59.9 p -148.84 23.63 0.97 Allowed 'General case' 0 N--CA 1.448 -0.532 0 O-C-N 120.444 -1.621 . . . . 1.8 110.855 161.488 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 58.7 t-20 -135.51 -43.52 0.69 Allowed 'General case' 0 CA--C 1.52 -0.209 0 CA-C-O 120.896 0.379 . . . . 2.33 111.444 -160.15 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 20.6 mt -66.14 -37.16 85.0 Favored 'General case' 0 C--N 1.331 -0.205 0 C-N-CA 120.445 -0.502 . . . . 0.48 110.674 -179.41 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 2.7 t 175.78 173.1 0.32 Allowed 'General case' 0 CA--C 1.533 0.301 0 C-N-CA 125.269 1.428 . . . . 0.61 108.193 -173.136 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 8.8 p -64.04 -36.3 83.54 Favored 'General case' 0 N--CA 1.455 -0.188 0 C-N-CA 123.889 0.876 . . . . 2.29 110.504 172.666 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -64.38 -14.8 58.52 Favored 'General case' 0 N--CA 1.464 0.266 0 N-CA-C 112.041 0.385 . . . . 1.02 112.041 172.247 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -75.57 -13.6 82.8 Favored Glycine 0 N--CA 1.443 -0.885 0 N-CA-C 110.848 -0.901 . . . . 0.43 110.848 174.339 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 3.6 tmt_? -113.75 -8.65 13.21 Favored 'General case' 0 CA--C 1.52 -0.174 0 CA-C-N 118.967 1.384 . . . . 2.8 113.028 -171.34 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 18.8 p -69.09 -115.21 0.0 OUTLIER 'General case' 0 C--N 1.327 -0.377 0 C-N-CA 124.368 1.067 . . . . 1.39 110.042 177.215 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 9.8 t-20 -86.94 154.1 21.07 Favored 'General case' 0 N--CA 1.454 -0.228 0 O-C-N 120.553 -1.342 . . . . 2.35 107.724 177.829 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 78.8 tt0 -58.68 -34.57 71.41 Favored 'General case' 0 CA--C 1.535 0.383 0 CA-C-N 118.87 0.759 . . . . 2.95 109.731 175.416 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -65.93 -29.04 69.39 Favored 'General case' 0 N--CA 1.455 -0.215 0 N-CA-C 113.128 0.788 . . . . 0.63 113.128 177.521 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 11.9 mt-10 -77.42 -45.68 25.05 Favored 'General case' 0 CA--C 1.513 -0.471 0 O-C-N 121.075 -1.016 . . . . 2.22 110.05 175.856 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 49.8 t80 -47.64 -48.71 28.55 Favored 'General case' 0 C--N 1.33 -0.271 0 C-N-CA 125.717 1.607 . . . . 0.56 111.27 172.19 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 56.5 t80 -63.26 -43.78 97.0 Favored 'General case' 0 CA--C 1.538 0.517 0 O-C-N 121.174 -0.954 . . . . 0.81 110.833 177.013 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -66.49 -52.33 47.22 Favored 'General case' 0 CA--C 1.539 0.534 0 O-C-N 121.114 -0.991 . . . . 0.47 112.851 -174.185 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -57.63 -39.8 77.75 Favored 'General case' 0 C--N 1.331 -0.215 0 O-C-N 120.701 -1.249 . . . . 4.0 111.017 170.382 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -56.71 -44.0 81.12 Favored 'General case' 0 N--CA 1.451 -0.416 0 CA-C-O 118.4 -0.81 . . . . 0.48 110.251 176.648 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 71.3 t80 -55.92 -49.98 71.95 Favored 'General case' 0 N--CA 1.466 0.371 0 CA-C-N 119.725 1.148 . . . . 3.07 111.672 173.517 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 72' ' ' ARG . . . . . 0.431 ' CZ ' ' HB2' ' A' ' 12' ' ' GLU . 64.1 ttt180 -47.98 -57.59 5.55 Favored 'General case' 0 CA--C 1.533 0.325 0 CA-C-N 118.568 0.622 . . . . 2.37 109.899 177.537 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 73' ' ' LEU . . . . . 0.601 ' CB ' HG21 ' A' ' 85' ' ' VAL . 0.1 OUTLIER -67.3 -27.6 67.31 Favored 'General case' 0 C--N 1.327 -0.385 0 C-N-CA 124.538 1.135 . . . . 0.52 111.263 -176.476 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 1.2 ttp -62.29 -38.32 88.91 Favored 'General case' 0 N--CA 1.454 -0.244 0 C-N-CA 122.814 0.445 . . . . 2.4 109.852 179.763 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 23.1 p80 -91.27 -36.61 13.8 Favored 'General case' 0 N--CA 1.452 -0.334 0 CA-C-O 115.886 -2.007 . . . . 1.01 111.572 -175.083 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 18.6 m -6.11 118.4 0.01 OUTLIER 'General case' 0 C--N 1.347 0.492 0 C-N-CA 128.493 2.717 . . . . 1.01 114.575 -174.655 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 4.9 p -46.21 -47.24 17.91 Favored 'General case' 0 N--CA 1.451 -0.376 0 C-N-CA 125.234 1.414 . . . . 0.97 109.638 175.136 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 12.9 t0 -70.36 114.18 8.23 Favored 'General case' 0 N--CA 1.451 -0.393 0 CA-C-O 122.13 0.967 . . . . 2.39 109.929 169.7 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 13.2 m170 -63.04 -29.41 70.8 Favored 'General case' 0 N--CA 1.451 -0.377 0 CA-C-N 115.779 -0.646 . . . . 6.1 111.189 176.964 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -63.21 -46.1 88.59 Favored 'General case' 0 N--CA 1.453 -0.29 0 CA-C-N 119.313 0.96 . . . . 1.25 110.07 179.369 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -48.66 -41.99 33.09 Favored 'General case' 0 C--O 1.231 0.13 0 C-N-CA 124.554 1.142 . . . . 4.23 110.771 175.105 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -64.35 -52.52 57.94 Favored 'General case' 0 C--N 1.33 -0.247 0 N-CA-C 109.417 -0.586 . . . . 3.16 109.417 179.39 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 83' ' ' LEU . . . . . 0.418 HD13 ' HA ' ' A' ' 83' ' ' LEU . 1.3 mm? -66.19 -16.88 64.36 Favored 'General case' 0 CA--C 1.522 -0.128 0 N-CA-C 112.861 0.689 . . . . 1.25 112.861 179.239 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 33.5 mttt -66.4 -51.24 59.04 Favored 'General case' 0 N--CA 1.45 -0.454 0 N-CA-C 106.953 -1.499 . . . . 2.14 106.953 168.865 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 85' ' ' VAL . . . . . 0.601 HG21 ' CB ' ' A' ' 73' ' ' LEU . 98.8 t -56.18 -46.3 81.17 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.449 0 CA-C-O 118.195 -0.907 . . . . 0.61 111.994 174.557 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 1.6 mt-30 -66.84 -49.89 64.27 Favored 'General case' 0 C--O 1.224 -0.252 0 CA-C-N 120.662 1.574 . . . . 2.21 112.183 -175.589 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 5.3 pttp -68.11 -38.39 82.22 Favored 'General case' 0 C--O 1.226 -0.161 0 O-C-N 121.178 -0.951 . . . . 3.96 109.978 -174.678 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 3.1 m120 -62.38 -45.42 93.24 Favored 'General case' 0 N--CA 1.453 -0.322 0 N-CA-C 108.866 -0.79 . . . . 1.34 108.866 175.883 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -128.53 86.19 58.35 Favored Pre-proline 0 N--CA 1.451 -0.385 0 C-N-CA 126.324 1.85 . . . . 0.52 109.755 -172.467 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 92.1 Cg_endo -80.46 46.18 2.18 Favored 'Trans proline' 0 CA--C 1.539 0.737 0 C-N-CA 123.361 2.707 . . . . 1.85 111.596 -176.899 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 91' ' ' LYS . . . . . 0.583 ' HE2' ' OE2' ' A' ' 51' ' ' GLU . 21.1 pttt -160.88 -53.2 0.05 OUTLIER 'General case' 0 N--CA 1.452 -0.339 0 C-N-CA 125.443 1.497 . . . . 2.61 110.743 177.27 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 3.4 m -50.43 -47.06 56.83 Favored 'General case' 0 N--CA 1.464 0.228 0 C-N-CA 123.649 0.78 . . . . 0.66 111.781 -178.135 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 12.2 t80 -57.47 -49.56 75.89 Favored 'General case' 0 CA--C 1.516 -0.343 0 CA-C-O 121.793 0.806 . . . . 2.39 110.883 178.845 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 1.4 mt-30 -59.69 -26.48 65.61 Favored 'General case' 0 N--CA 1.446 -0.634 0 CA-C-N 114.657 -1.156 . . . . 2.04 110.773 -179.027 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 3.6 t80 -66.93 -58.39 5.07 Favored 'General case' 0 N--CA 1.451 -0.383 0 C-N-CA 123.586 0.755 . . . . 1.05 110.227 -178.16 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 96' ' ' ILE . . . . . 0.402 HD12 ' H ' ' A' ' 96' ' ' ILE . 3.3 mp -55.63 -42.54 69.41 Favored 'Isoleucine or valine' 0 CA--C 1.528 0.098 0 N-CA-C 108.701 -0.852 . . . . 1.18 108.701 175.638 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 21.8 t-20 -55.8 -43.91 77.33 Favored 'General case' 0 CA--C 1.537 0.452 0 CA-C-O 120.886 0.374 . . . . 2.31 111.181 -179.869 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 98' ' ' ASP . . . . . 0.43 ' OD2' ' HE3' ' A' ' 42' ' ' LYS . 0.2 OUTLIER -55.76 -37.52 68.62 Favored 'General case' 0 CA--C 1.533 0.318 0 C-N-CA 124.44 1.096 . . . . 2.27 110.178 177.523 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -70.2 -55.61 8.9 Favored 'General case' 0 CA--C 1.532 0.266 0 C-N-CA 123.347 0.659 . . . . 5.03 111.026 -179.649 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 2.5 pt -76.28 74.24 0.48 Allowed 'Isoleucine or valine' 0 CA--C 1.532 0.287 0 CA-C-O 121.771 0.796 . . . . 5.63 111.283 -171.92 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 5.7 tmtm? -133.8 -43.32 0.82 Allowed 'General case' 0 N--CA 1.456 -0.136 0 O-C-N 121.745 -0.597 . . . . 9.83 110.74 -169.292 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 102' ' ' PHE . . . . . . . . . . . . . 52.2 t80 -112.45 -32.0 6.63 Favored 'General case' 0 CA--C 1.532 0.265 0 C-N-CA 123.112 0.565 . . . . 9.15 111.283 177.382 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -60.47 128.52 21.71 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.343 0 O-C-N 121.853 -0.529 . . . . 5.84 109.749 178.402 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 104' ' ' ILE . . . . . . . . . . . . . 5.0 pt -77.37 134.46 28.52 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.171 0 N-CA-C 109.547 -0.538 . . . . 7.08 109.547 176.768 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 18.2 p-10 -144.28 155.49 43.86 Favored 'General case' 0 N--CA 1.454 -0.261 0 N-CA-C 109.264 -0.643 . . . . 11.03 109.264 177.782 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 38.9 m . . . . . 0 C--O 1.247 0.953 0 C-N-CA 126.888 2.075 . . . . 10.73 107.214 173.524 . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.471 1.018 0 N-CA-C 111.212 -0.755 . . . . 12.05 111.212 . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 8.2 m -140.71 -32.03 0.59 Allowed 'General case' 0 N--CA 1.465 0.295 0 N-CA-C 113.294 0.85 . . . . 14.05 113.294 -175.355 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -139.06 160.99 38.47 Favored 'General case' 0 N--CA 1.451 -0.393 0 N-CA-C 107.547 -1.279 . . . . 17.01 107.547 -179.33 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 118.81 166.91 13.69 Favored Glycine 0 N--CA 1.45 -0.402 0 N-CA-C 107.991 -2.044 . . . . 13.77 107.991 -170.508 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 21.4 m -97.37 -160.63 0.1 OUTLIER 'Isoleucine or valine' 0 N--CA 1.441 -0.896 0 N-CA-C 107.57 -1.27 . . . . 14.24 107.57 163.348 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 5.4 pt-20 -109.13 104.49 13.68 Favored 'General case' 0 N--CA 1.448 -0.574 0 CA-C-O 122.684 1.231 . . . . 10.62 111.569 -173.555 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 1.1 mm? -98.23 36.21 1.63 Allowed 'General case' 0 N--CA 1.452 -0.328 0 O-C-N 121.395 -0.816 . . . . 9.6 109.763 -173.076 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 14.4 mmm180 69.17 -71.16 0.12 Allowed 'General case' 0 N--CA 1.467 0.378 0 C-N-CA 124.87 1.268 . . . . 6.4 109.366 -170.67 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 9.7 m-80 -50.14 -37.39 34.2 Favored 'General case' 0 CA--C 1.51 -0.589 0 C-N-CA 125.099 1.36 . . . . 3.41 112.733 175.758 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 24.8 t70 -64.85 -41.44 95.69 Favored 'General case' 0 C--O 1.218 -0.577 0 C-N-CA 118.324 -1.351 . . . . 3.97 110.53 179.401 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -67.43 -55.09 15.1 Favored 'General case' 0 CA--C 1.535 0.381 0 CA-C-N 119.052 0.842 . . . . 2.53 110.444 179.738 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 6.3 tp10 -71.68 -17.55 62.23 Favored 'General case' 0 CA--C 1.537 0.469 0 CA-C-O 121.993 0.902 . . . . 5.85 110.233 -175.42 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -80.75 -37.11 20.7 Favored Glycine 0 CA--C 1.526 0.76 0 C-N-CA 125.039 1.304 . . . . 0.94 110.951 168.935 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 9.2 t80 -55.7 -49.2 73.64 Favored 'General case' 0 C--O 1.219 -0.541 0 C-N-CA 124.403 1.081 . . . . 2.73 108.71 -172.664 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -59.19 -37.16 67.01 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.389 0 N-CA-C 113.087 0.773 . . . . 0.39 113.087 176.421 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 6.4 t60 -61.03 -54.01 50.09 Favored 'General case' 0 N--CA 1.465 0.277 0 N-CA-C 106.354 -1.721 . . . . 0.47 106.354 177.775 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 67.9 mt-10 -53.26 -40.64 64.8 Favored 'General case' 0 C--O 1.223 -0.333 0 C-N-CA 122.698 0.399 . . . . 2.55 110.512 176.988 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -60.84 -50.17 74.54 Favored 'General case' 0 CA--C 1.518 -0.251 0 C-N-CA 125.173 1.389 . . . . 2.06 109.379 -175.291 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -49.04 -46.33 33.11 Favored Glycine 0 CA--C 1.528 0.9 0 N-CA-C 110.447 -1.061 . . . . 0.43 110.447 173.161 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 6.5 t-80 -63.34 -42.15 98.93 Favored 'General case' 0 N--CA 1.451 -0.417 0 O-C-N 122.035 -0.685 . . . . 1.8 111.784 179.571 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -65.5 -30.42 71.18 Favored 'General case' 0 N--CA 1.452 -0.372 0 O-C-N 121.378 -0.826 . . . . 0.65 109.956 -179.938 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 82.5 t -70.01 -40.05 78.1 Favored 'Isoleucine or valine' 0 C--O 1.232 0.165 0 O-C-N 121.328 -0.857 . . . . 0.88 109.609 176.355 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 3.6 m-20 -59.76 -22.85 62.67 Favored 'General case' 0 C--N 1.334 -0.099 0 N-CA-C 112.047 0.388 . . . . 2.5 112.047 172.375 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 11.6 t70 -67.45 -50.02 61.04 Favored 'General case' 0 N--CA 1.452 -0.348 0 N-CA-C 108.565 -0.902 . . . . 1.81 108.565 179.695 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -58.73 -57.45 12.95 Favored 'General case' 0 N--CA 1.456 -0.172 0 C-N-CA 123.21 0.604 . . . . 3.71 110.547 177.343 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -58.15 -32.89 68.62 Favored 'General case' 0 N--CA 1.453 -0.292 0 O-C-N 121.824 -0.547 . . . . 0.94 111.333 -178.705 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -59.72 -59.87 9.75 Favored Glycine 0 CA--C 1.521 0.439 0 N-CA-C 110.833 -0.907 . . . . 1.09 110.833 173.101 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -53.85 -29.52 41.49 Favored 'General case' 0 CA--C 1.533 0.301 0 C-N-CA 124.882 1.273 . . . . 2.38 112.385 -173.449 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 2.9 mm? -94.32 -21.69 18.83 Favored 'General case' 0 N--CA 1.445 -0.683 0 N-CA-C 114.25 1.204 . . . . 1.66 114.25 -179.779 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 28.6 mt -127.07 49.07 2.12 Favored 'General case' 0 CA--C 1.534 0.362 0 CA-C-N 120.052 1.296 . . . . 2.37 111.042 -166.696 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 22.5 p-10 -120.54 87.58 2.78 Favored 'General case' 0 CA--C 1.532 0.279 0 C-N-CA 125.248 1.419 . . . . 6.01 111.483 -166.694 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 49.3 mttm -64.43 -57.34 9.54 Favored 'General case' 0 N--CA 1.465 0.302 0 O-C-N 119.987 -1.695 . . . . 7.8 111.216 175.456 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 4.2 t-20 -163.72 158.51 20.38 Favored 'General case' 0 N--CA 1.455 -0.219 0 N-CA-C 108.179 -1.045 . . . . 7.25 108.179 177.391 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 27.1 tt0 42.67 34.91 0.62 Allowed 'General case' 0 CA--C 1.537 0.475 0 C-N-CA 126.819 2.048 . . . . 9.65 113.733 172.693 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 6.7 t -160.77 80.37 0.64 Allowed 'General case' 0 N--CA 1.453 -0.277 0 N-CA-C 107.069 -1.456 . . . . 6.65 107.069 179.548 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 70.8 m-20 -72.34 -45.63 59.03 Favored 'General case' 0 N--CA 1.462 0.158 0 CA-C-O 121.699 0.761 . . . . 5.67 109.81 -173.738 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 2.5 mt -86.3 141.29 29.35 Favored 'General case' 0 N--CA 1.454 -0.254 0 N-CA-C 107.087 -1.449 . . . . 2.21 107.087 172.387 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 9.9 p -63.94 116.42 3.51 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.312 0 N-CA-C 105.435 -2.061 . . . . 3.35 105.435 173.28 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 18.7 p -129.02 85.48 2.33 Favored 'General case' 0 N--CA 1.452 -0.359 0 N-CA-C 106.332 -1.729 . . . . 3.63 106.332 -179.228 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 3.1 t30 64.38 -74.63 0.05 OUTLIER 'General case' 0 CA--C 1.53 0.194 0 C-N-CA 125.892 1.677 . . . . 7.79 110.958 -166.796 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 6.3 t 67.96 158.86 0.15 Allowed 'General case' 0 N--CA 1.453 -0.318 0 C-N-CA 126.487 1.915 . . . . 3.0 110.948 -175.32 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 49.2 tttm 70.8 -63.03 0.43 Allowed 'General case' 0 CA--C 1.532 0.279 0 C-N-CA 125.177 1.391 . . . . 7.58 111.843 -174.563 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -86.75 168.21 13.74 Favored 'General case' 0 N--CA 1.457 -0.088 0 CA-C-N 119.287 0.948 . . . . 6.87 109.421 174.307 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -85.1 58.74 5.2 Favored 'General case' 0 CA--C 1.533 0.292 0 C-N-CA 123.606 0.762 . . . . 6.75 109.279 -175.648 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 3.8 pt 39.01 39.21 0.22 Allowed 'Isoleucine or valine' 0 CA--C 1.541 0.624 0 C-N-CA 125.459 1.504 . . . . 3.93 112.369 -175.719 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 12.8 t70 -60.68 -44.04 96.99 Favored 'General case' 0 N--CA 1.465 0.308 0 C-N-CA 124.716 1.206 . . . . 2.37 111.032 -173.874 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 47' ' ' ILE . . . . . 0.474 HD13 ' HE3' ' A' ' 91' ' ' LYS . 5.7 mm -50.63 -52.59 15.81 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.308 0 C-N-CA 124.559 1.144 . . . . 0.62 108.677 177.461 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 20.0 t80 -67.52 -33.7 75.6 Favored 'General case' 0 N--CA 1.452 -0.332 0 C-N-CA 123.403 0.681 . . . . 0.78 112.043 177.201 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 49' ' ' LYS . . . . . 0.508 ' HE2' ' N ' ' A' ' 49' ' ' LYS . 0.6 OUTLIER -61.93 -49.16 77.25 Favored 'General case' 0 CA--C 1.519 -0.235 0 CA-C-N 119.899 1.227 . . . . 1.83 109.195 -174.44 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 7.3 mm-40 -80.08 -66.17 0.91 Allowed 'General case' 0 N--CA 1.448 -0.563 0 CA-C-O 122.14 0.971 . . . . 2.79 109.089 -178.461 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 17.8 mm-40 -73.79 -21.52 60.14 Favored 'General case' 0 C--O 1.235 0.298 0 C-N-CA 123.442 0.697 . . . . 2.57 110.659 -164.791 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -68.2 37.52 0.25 Allowed Glycine 0 CA--C 1.531 1.064 0 C-N-CA 125.429 1.49 . . . . 0.35 113.454 169.073 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 61.5 p -148.94 23.25 0.97 Allowed 'General case' 0 N--CA 1.446 -0.663 0 O-C-N 120.673 -1.486 . . . . 2.04 110.839 163.388 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 3.2 t-20 -136.19 -39.84 0.67 Allowed 'General case' 0 CA--C 1.517 -0.301 0 N-CA-C 113.147 0.795 . . . . 1.56 113.147 -164.799 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 55' ' ' LEU . . . . . 0.643 HD22 HG22 ' A' ' 85' ' ' VAL . 16.2 mt -66.96 -36.86 83.15 Favored 'General case' 0 C--N 1.332 -0.194 0 C-N-CA 120.214 -0.594 . . . . 0.36 110.473 -178.533 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 1.2 t 178.83 170.3 0.87 Allowed 'General case' 0 C--N 1.331 -0.206 0 C-N-CA 125.451 1.5 . . . . 0.49 107.637 -178.581 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 9.6 m -57.56 -35.35 70.22 Favored 'General case' 0 N--CA 1.453 -0.279 0 C-N-CA 123.175 0.59 . . . . 0.92 110.554 170.056 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -58.5 -33.84 70.27 Favored 'General case' 0 C--N 1.34 0.154 0 CA-C-N 117.837 0.289 . . . . 1.17 110.418 173.842 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -63.96 -16.36 59.48 Favored Glycine 0 C--O 1.22 -0.74 0 CA-C-O 119.106 -0.83 . . . . 0.54 111.792 178.481 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 50.7 ttt-85 -104.6 -8.55 18.88 Favored 'General case' 0 N--CA 1.457 -0.111 0 CA-C-N 119.184 1.492 . . . . 2.13 113.735 178.942 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 44.0 p -67.65 -139.12 0.0 OUTLIER 'General case' 0 CA--C 1.54 0.596 0 CA-C-O 121.205 0.526 . . . . 0.98 110.585 174.567 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 1.1 t-20 -65.22 149.48 49.86 Favored 'General case' 0 N--CA 1.453 -0.307 0 O-C-N 120.067 -1.646 . . . . 1.95 108.703 178.473 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 3.4 tm-20 -60.58 -32.69 71.78 Favored 'General case' 0 CA--C 1.532 0.282 0 O-C-N 121.915 -0.491 . . . . 3.15 110.259 179.454 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -61.62 -29.76 70.26 Favored 'General case' 0 N--CA 1.454 -0.246 0 N-CA-C 113.798 1.036 . . . . 0.62 113.798 175.166 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 2.1 mt-10 -81.44 -41.03 22.44 Favored 'General case' 0 CA--C 1.508 -0.653 0 O-C-N 121.169 -0.957 . . . . 2.52 110.597 176.776 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 37.3 t80 -50.42 -47.7 56.52 Favored 'General case' 0 N--CA 1.45 -0.437 0 C-N-CA 124.194 0.997 . . . . 0.31 111.155 170.283 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 42.1 t80 -64.59 -46.02 84.48 Favored 'General case' 0 CA--C 1.538 0.504 0 O-C-N 121.34 -0.85 . . . . 0.68 109.98 176.979 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -61.28 -54.61 41.88 Favored 'General case' 0 CA--C 1.539 0.53 0 O-C-N 121.082 -1.011 . . . . 0.26 113.061 -174.297 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -57.28 -39.86 76.56 Favored 'General case' 0 C--N 1.331 -0.211 0 O-C-N 121.008 -1.057 . . . . 3.9 110.86 171.511 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -56.69 -42.18 78.64 Favored 'General case' 0 N--CA 1.453 -0.316 0 CA-C-N 119.15 0.886 . . . . 0.36 110.806 175.995 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 76.7 t80 -58.53 -49.66 76.59 Favored 'General case' 0 N--CA 1.464 0.261 0 CA-C-N 119.912 1.233 . . . . 3.07 111.633 172.821 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 22.8 ttp180 -47.84 -57.75 5.24 Favored 'General case' 0 N--CA 1.465 0.284 0 CA-C-N 119.238 0.926 . . . . 2.63 110.203 177.449 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -63.6 -30.15 71.3 Favored 'General case' 0 C--N 1.326 -0.414 0 C-N-CA 124.838 1.255 . . . . 0.45 111.104 -177.153 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 1.2 ttp -59.2 -42.23 90.45 Favored 'General case' 0 C--O 1.233 0.227 0 C-N-CA 122.756 0.422 . . . . 2.5 110.488 -179.938 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 8.9 p80 -96.7 -6.12 37.17 Favored 'General case' 0 N--CA 1.455 -0.183 0 CA-C-O 116.365 -1.779 . . . . 0.89 113.68 -177.181 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 16.6 m -36.94 126.93 0.91 Allowed 'General case' 0 N--CA 1.453 -0.29 0 CA-C-O 123.267 1.508 . . . . 1.02 111.905 -171.697 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 7.8 p -52.83 -44.95 67.08 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 112.849 -1.978 . . . . 1.18 108.207 177.133 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 13.0 t0 -65.68 107.52 1.78 Allowed 'General case' 0 N--CA 1.45 -0.459 0 CA-C-O 121.863 0.84 . . . . 2.14 108.91 166.687 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -57.58 -33.01 67.74 Favored 'General case' 0 N--CA 1.454 -0.266 0 CA-C-N 116.068 -0.515 . . . . 5.41 110.432 177.452 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -61.95 -47.4 85.06 Favored 'General case' 0 N--CA 1.451 -0.38 0 CA-C-N 118.567 0.621 . . . . 0.67 110.745 179.952 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 5.7 mt-10 -49.1 -41.44 35.66 Favored 'General case' 0 CA--C 1.519 -0.245 0 C-N-CA 123.943 0.897 . . . . 2.6 110.908 178.444 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 2.2 mtp180 -62.45 -50.2 72.4 Favored 'General case' 0 C--N 1.327 -0.396 0 N-CA-C 109.056 -0.72 . . . . 2.86 109.056 178.484 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 1.3 mm? -64.99 -18.18 65.06 Favored 'General case' 0 N--CA 1.451 -0.398 0 CA-C-O 117.682 -1.152 . . . . 0.45 113.487 176.51 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 6.6 mttt -69.32 -48.8 60.38 Favored 'General case' 0 C--O 1.224 -0.27 0 CA-C-N 121.404 1.911 . . . . 1.27 107.511 168.774 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 85' ' ' VAL . . . . . 0.643 HG22 HD22 ' A' ' 55' ' ' LEU . 33.4 t -58.57 -42.61 85.19 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.596 0 CA-C-O 118.112 -0.947 . . . . 0.47 111.449 176.237 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 1.3 mt-30 -69.44 -52.77 23.67 Favored 'General case' 0 C--O 1.224 -0.255 0 CA-C-N 121.253 1.842 . . . . 1.95 111.741 -179.949 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 35.6 tttt -51.96 -50.8 60.52 Favored 'General case' 0 N--CA 1.451 -0.393 0 C-N-CA 123.436 0.694 . . . . 2.2 110.075 -177.661 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 4.0 m-20 -65.93 -46.08 79.51 Favored 'General case' 0 N--CA 1.449 -0.479 0 C-N-CA 123.389 0.676 . . . . 1.52 109.565 179.276 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -130.63 78.1 74.55 Favored Pre-proline 0 C--O 1.238 0.45 0 C-N-CA 125.672 1.589 . . . . 0.43 110.847 -168.634 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 73.9 Cg_endo -74.7 15.9 0.66 Allowed 'Trans proline' 0 CA--C 1.536 0.594 0 C-N-CA 123.062 2.508 . . . . 1.51 112.683 -175.233 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 91' ' ' LYS . . . . . 0.474 ' HE3' HD13 ' A' ' 47' ' ' ILE . 7.9 ptmt -128.69 -46.43 1.29 Allowed 'General case' 0 N--CA 1.451 -0.421 0 C-N-CA 125.773 1.629 . . . . 2.66 109.526 -177.751 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 3.3 m -54.61 -49.4 70.56 Favored 'General case' 0 N--CA 1.464 0.242 0 CA-C-N 119.533 1.061 . . . . 0.33 111.067 176.227 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 22.5 t80 -59.01 -50.48 73.92 Favored 'General case' 0 CA--C 1.51 -0.583 0 C-N-CA 119.927 -0.709 . . . . 1.84 110.428 -179.724 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 22.4 tt0 -57.72 -29.63 64.89 Favored 'General case' 0 N--CA 1.444 -0.732 0 CA-C-N 114.69 -1.141 . . . . 2.42 110.1 -177.158 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 13.1 t80 -66.07 -58.42 5.52 Favored 'General case' 0 N--CA 1.45 -0.45 0 C-N-CA 123.358 0.663 . . . . 1.45 109.34 -177.882 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 3.2 mp -55.02 -41.99 62.03 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.217 0 N-CA-C 109.297 -0.631 . . . . 0.84 109.297 175.718 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 14.0 t-20 -60.98 -35.73 77.58 Favored 'General case' 0 N--CA 1.455 -0.187 0 C-N-CA 123.382 0.673 . . . . 2.29 111.772 -175.957 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 27.0 t70 -70.83 -40.24 72.54 Favored 'General case' 0 CA--C 1.528 0.126 0 C-N-CA 123.585 0.754 . . . . 2.17 110.333 174.481 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -68.38 -58.33 4.52 Favored 'General case' 0 CA--C 1.534 0.353 0 C-N-CA 124.066 0.946 . . . . 4.02 110.431 -170.317 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 1.1 pt -74.44 129.23 36.72 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.238 0 O-C-N 121.471 -0.768 . . . . 5.7 109.225 179.107 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -147.52 -59.83 0.27 Allowed 'General case' 0 CA--C 1.518 -0.268 0 O-C-N 121.414 -0.804 . . . . 10.02 109.843 -175.265 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 102' ' ' PHE . . . . . . . . . . . . . 8.7 t80 -152.83 89.08 1.36 Allowed 'General case' 0 N--CA 1.453 -0.304 0 N-CA-C 108.051 -1.092 . . . . 7.09 108.051 172.19 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 11.1 tp -134.31 62.78 0.28 Allowed 'Isoleucine or valine' 0 C--O 1.227 -0.121 0 CA-C-O 122.685 1.231 . . . . 4.94 108.66 -177.664 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 104' ' ' ILE . . . . . . . . . . . . . 1.1 pt -136.74 156.14 34.65 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.546 0 N-CA-C 107.884 -1.154 . . . . 8.49 107.884 178.685 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 60.5 t30 -145.11 149.43 35.0 Favored 'General case' 0 N--CA 1.449 -0.501 0 N-CA-C 105.708 -1.96 . . . . 8.09 105.708 172.156 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 48.7 m . . . . . 0 C--O 1.248 1.012 0 CA-C-O 116.738 -1.601 . . . . 9.55 108.604 -177.074 . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 1' ' ' GLY . . . . . 0.429 ' HA3' ' OE1' ' A' ' 17' ' ' GLU . . . . . . . . 0 N--CA 1.471 1.016 0 CA-C-O 119.639 -0.534 . . . . 11.05 113.783 . . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 6.0 m -155.34 -85.24 0.06 Allowed 'General case' 0 N--CA 1.454 -0.272 0 CA-C-N 119.36 1.58 . . . . 12.19 107.77 174.252 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 9.6 ttmt -173.89 163.92 4.17 Favored 'General case' 0 N--CA 1.458 -0.052 0 N-CA-C 109.04 -0.726 . . . . 16.24 109.04 178.907 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 104.79 -153.98 17.39 Favored Glycine 0 C--N 1.333 0.411 0 N-CA-C 110.226 -1.149 . . . . 12.45 110.226 177.264 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 31.8 m -80.02 -156.59 0.04 OUTLIER 'Isoleucine or valine' 0 N--CA 1.445 -0.72 0 N-CA-C 108.069 -1.086 . . . . 13.31 108.069 167.859 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -96.28 124.87 40.43 Favored 'General case' 0 N--CA 1.446 -0.657 0 CA-C-O 121.889 0.852 . . . . 8.6 109.885 169.268 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 1.9 mm? -111.18 39.23 2.33 Favored 'General case' 0 N--CA 1.447 -0.585 0 C-N-CA 124.455 1.102 . . . . 8.69 108.091 179.945 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 11.3 mmm180 68.96 -76.37 0.06 Allowed 'General case' 0 N--CA 1.467 0.385 0 C-N-CA 123.555 0.742 . . . . 6.83 109.483 -174.217 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 7.0 m-20 -45.49 -43.66 11.8 Favored 'General case' 0 CA--C 1.513 -0.449 0 C-N-CA 124.9 1.28 . . . . 2.67 111.303 173.45 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 8.4 t70 -66.07 -38.76 89.11 Favored 'General case' 0 N--CA 1.449 -0.49 0 C-N-CA 118.168 -1.413 . . . . 3.59 111.315 -176.085 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -65.91 -59.63 3.66 Favored 'General case' 0 CA--C 1.53 0.2 0 C-N-CA 124.471 1.108 . . . . 1.55 110.532 177.481 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 12' ' ' GLU . . . . . 0.493 ' HA ' HD11 ' A' ' 15' ' ' ILE . 8.9 pt-20 -68.85 -25.8 64.83 Favored 'General case' 0 C--O 1.234 0.286 0 O-C-N 121.529 -0.732 . . . . 3.23 110.37 -172.27 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -72.34 -46.56 33.15 Favored Glycine 0 CA--C 1.526 0.765 0 C-N-CA 124.897 1.237 . . . . 0.76 110.881 170.75 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 16.0 t80 -58.21 -55.9 29.05 Favored 'General case' 0 C--O 1.223 -0.303 0 CA-C-N 118.576 1.188 . . . . 3.37 109.504 -176.956 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 15' ' ' ILE . . . . . 0.493 HD11 ' HA ' ' A' ' 12' ' ' GLU . 0.8 OUTLIER -60.74 -33.9 56.86 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.328 0 O-C-N 121.724 -0.61 . . . . 0.61 111.708 -179.894 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 13.6 t60 -61.7 -51.56 67.88 Favored 'General case' 0 CA--C 1.536 0.442 0 N-CA-C 107.796 -1.186 . . . . 0.73 107.796 177.607 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 17' ' ' GLU . . . . . 0.429 ' OE1' ' HA3' ' A' ' 1' ' ' GLY . 43.6 mt-10 -54.13 -40.69 67.61 Favored 'General case' 0 C--O 1.225 -0.22 0 O-C-N 121.013 -1.054 . . . . 2.29 110.668 175.173 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 1.3 t80 -58.23 -41.37 83.96 Favored 'General case' 0 N--CA 1.453 -0.314 0 C-N-CA 123.244 0.618 . . . . 2.37 109.931 178.752 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -49.87 -49.71 34.4 Favored Glycine 0 CA--C 1.529 0.927 0 N-CA-C 111.226 -0.75 . . . . 0.69 111.226 170.47 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 70.8 m-70 -57.15 -52.16 66.42 Favored 'General case' 0 C--O 1.227 -0.11 0 CA-C-N 117.93 0.865 . . . . 3.8 110.917 176.833 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -60.59 -27.42 67.71 Favored 'General case' 0 N--CA 1.454 -0.226 0 CA-C-N 117.802 0.273 . . . . 0.81 111.691 -177.904 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 54.2 t -71.83 -40.12 68.71 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.212 0 O-C-N 121.15 -0.969 . . . . 1.02 109.563 176.51 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 23' ' ' ASP . . . . . 0.467 ' OD1' HG12 ' A' ' 38' ' ' VAL . 3.2 t0 -66.51 -12.86 59.61 Favored 'General case' 0 N--CA 1.451 -0.419 0 N-CA-C 112.215 0.45 . . . . 2.49 112.215 179.837 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 17.1 t70 -59.02 -51.31 70.61 Favored 'General case' 0 N--CA 1.454 -0.26 0 N-CA-C 108.497 -0.927 . . . . 3.81 108.497 177.672 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -55.73 -43.58 76.74 Favored 'General case' 0 N--CA 1.453 -0.307 0 C-N-CA 123.473 0.709 . . . . 2.68 110.518 177.922 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -57.74 -40.82 80.54 Favored 'General case' 0 N--CA 1.447 -0.603 0 CA-C-O 118.714 -0.66 . . . . 1.47 110.434 179.768 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -70.79 -52.97 12.65 Favored Glycine 0 CA--C 1.526 0.754 0 N-CA-C 110.751 -0.94 . . . . 1.48 110.751 179.966 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -45.03 -47.77 11.64 Favored 'General case' 0 C--O 1.235 0.301 0 C-N-CA 125.083 1.353 . . . . 2.58 110.556 -177.374 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 3.3 mm? -79.19 -42.83 25.16 Favored 'General case' 0 N--CA 1.443 -0.82 0 C-N-CA 123.915 0.886 . . . . 2.81 112.238 177.938 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 6.4 mt -119.7 99.14 6.47 Favored 'General case' 0 CA--C 1.534 0.357 0 C-N-CA 123.772 0.829 . . . . 2.78 109.131 -165.967 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 5.8 t0 88.32 85.94 0.02 OUTLIER 'General case' 0 N--CA 1.47 0.564 0 C-N-CA 126.775 2.03 . . . . 4.96 107.151 -175.669 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.38 165.02 2.23 Favored 'General case' 0 N--CA 1.467 0.412 0 C-N-CA 123.093 0.557 . . . . 7.89 110.404 -171.887 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 54.6 t30 -34.71 89.76 0.0 OUTLIER 'General case' 0 N--CA 1.465 0.322 0 C-N-CA 126.804 2.042 . . . . 10.3 113.307 -174.091 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 48.3 tt0 -162.73 -44.49 0.04 OUTLIER 'General case' 0 C--N 1.334 -0.097 0 C-N-CA 124.262 1.025 . . . . 8.11 108.734 -169.858 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -120.09 148.24 43.85 Favored 'General case' 0 N--CA 1.449 -0.515 0 N-CA-C 106.092 -1.818 . . . . 5.43 106.092 160.964 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 38.8 t0 -93.88 132.76 37.98 Favored 'General case' 0 N--CA 1.454 -0.256 0 N-CA-C 107.605 -1.257 . . . . 7.1 107.605 -179.652 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 5.9 mp 64.68 177.15 0.19 Allowed 'General case' 0 CA--C 1.544 0.739 0 C-N-CA 124.891 1.276 . . . . 2.79 110.399 -167.594 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 38' ' ' VAL . . . . . 0.467 HG12 ' OD1' ' A' ' 23' ' ' ASP . 2.7 p -89.26 40.41 0.07 OUTLIER 'Isoleucine or valine' 0 N--CA 1.471 0.605 0 O-C-N 119.707 -1.87 . . . . 2.54 110.227 -176.713 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 8.8 t -63.48 162.14 13.19 Favored 'General case' 0 N--CA 1.452 -0.359 0 O-C-N 121.375 -0.828 . . . . 3.95 110.082 179.831 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 5.2 m120 62.26 -84.52 0.02 OUTLIER 'General case' 0 N--CA 1.447 -0.607 0 C-N-CA 126.273 1.829 . . . . 6.95 109.9 -176.801 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 9.8 t 64.96 120.37 0.02 OUTLIER 'General case' 0 CA--C 1.538 0.517 0 CA-C-O 123.595 1.664 . . . . 3.93 111.412 -176.27 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -67.26 135.36 53.27 Favored 'General case' 0 N--CA 1.455 -0.187 0 O-C-N 120.142 -1.599 . . . . 13.61 108.411 -174.057 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER 51.99 35.4 15.95 Favored 'General case' 0 CA--C 1.535 0.381 0 C-N-CA 124.655 1.182 . . . . 9.91 111.138 -175.278 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 1.9 m-85 -139.4 -31.98 0.67 Allowed 'General case' 0 N--CA 1.455 -0.197 0 C-N-CA 123.67 0.788 . . . . 10.99 110.817 177.435 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 9.9 tt -48.74 -26.32 1.5 Allowed 'Isoleucine or valine' 0 CA--C 1.535 0.388 0 C-N-CA 124.147 0.979 . . . . 2.62 112.818 178.639 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 94.7 m-20 -42.49 -45.85 4.6 Favored 'General case' 0 N--CA 1.465 0.291 0 C-N-CA 125.878 1.671 . . . . 3.81 111.11 173.873 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 8.8 mm -47.65 -60.58 0.59 Allowed 'Isoleucine or valine' 0 CA--C 1.536 0.406 0 C-N-CA 125.692 1.597 . . . . 0.75 108.955 175.963 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 23.7 t80 -65.35 -30.6 71.45 Favored 'General case' 0 N--CA 1.454 -0.257 0 O-C-N 121.031 -1.043 . . . . 0.64 112.304 178.185 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -65.22 -49.55 69.26 Favored 'General case' 0 N--CA 1.454 -0.251 0 O-C-N 120.256 -1.527 . . . . 1.21 109.76 -176.942 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 26.8 mm-40 -85.94 -57.14 3.15 Favored 'General case' 0 N--CA 1.449 -0.499 0 CA-C-O 121.452 0.644 . . . . 4.33 109.557 -171.98 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 37.3 mt-10 -80.95 -23.32 38.92 Favored 'General case' 0 C--O 1.235 0.329 0 O-C-N 121.775 -0.578 . . . . 3.54 110.502 -171.692 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 52' ' ' GLY . . . . . 0.42 ' HA2' ' CD1' ' A' ' 66' ' ' PHE . . . -71.17 43.52 0.67 Allowed Glycine 0 CA--C 1.531 1.039 0 C-N-CA 125.791 1.662 . . . . 0.39 113.776 168.934 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 34.6 t -160.25 35.79 0.17 Allowed 'General case' 0 N--CA 1.447 -0.62 0 C-N-CA 125.022 1.329 . . . . 1.79 108.023 162.9 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 31.9 t30 -146.34 -34.76 0.29 Allowed 'General case' 0 C--N 1.341 0.228 0 N-CA-C 113.589 0.959 . . . . 1.87 113.589 -169.699 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 18.8 mt -64.01 -41.28 97.52 Favored 'General case' 0 CA--C 1.53 0.187 0 O-C-N 121.4 -0.813 . . . . 0.55 110.124 174.912 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 1.6 t 177.7 174.67 0.5 Allowed 'General case' 0 CA--C 1.534 0.337 0 C-N-CA 125.907 1.683 . . . . 0.65 107.67 -177.116 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 74.5 m -59.57 -31.5 69.49 Favored 'General case' 0 CA--C 1.529 0.166 0 O-C-N 121.584 -0.697 . . . . 0.97 110.472 166.935 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -64.65 -19.87 65.97 Favored 'General case' 0 CA--C 1.535 0.403 0 CA-C-N 118.066 0.394 . . . . 1.89 111.755 176.112 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -84.29 -11.9 77.21 Favored Glycine 0 N--CA 1.446 -0.642 0 CA-C-O 119.177 -0.791 . . . . 0.41 111.394 176.494 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 3.9 tmt_? -107.18 -13.85 15.05 Favored 'General case' 0 N--CA 1.455 -0.194 0 CA-C-N 118.29 1.045 . . . . 2.67 112.132 -178.106 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 1.1 p -62.73 -165.76 0.01 OUTLIER 'General case' 0 CA--C 1.538 0.501 0 C-N-CA 123.752 0.821 . . . . 1.07 110.162 164.987 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 14.6 m-20 -49.52 148.53 2.77 Favored 'General case' 0 CA--C 1.528 0.122 0 O-C-N 121.268 -0.895 . . . . 2.14 110.879 -178.679 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 60.4 tt0 -62.83 -27.86 69.61 Favored 'General case' 0 CA--C 1.533 0.322 0 CA-C-O 121.298 0.57 . . . . 2.64 111.117 -177.547 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -54.46 -40.43 68.42 Favored 'General case' 0 N--CA 1.455 -0.201 0 O-C-N 121.553 -0.717 . . . . 0.69 112.152 169.429 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 1.3 mt-10 -78.25 -39.37 40.39 Favored 'General case' 0 CA--C 1.507 -0.68 0 CA-C-O 118.418 -0.801 . . . . 2.85 110.022 -178.059 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 66' ' ' PHE . . . . . 0.42 ' CD1' ' HA2' ' A' ' 52' ' ' GLY . 56.5 t80 -51.47 -50.87 58.98 Favored 'General case' 0 N--CA 1.452 -0.354 0 C-N-CA 123.863 0.865 . . . . 0.47 111.354 171.735 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 79.1 t80 -62.89 -44.23 96.65 Favored 'General case' 0 CA--C 1.541 0.619 0 O-C-N 121.473 -0.767 . . . . 0.55 110.132 177.426 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -64.57 -55.54 19.79 Favored 'General case' 0 CA--C 1.537 0.448 0 N-CA-C 113.795 1.035 . . . . 0.3 113.795 -174.438 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -54.8 -39.44 68.47 Favored 'General case' 0 C--N 1.33 -0.244 0 O-C-N 120.665 -1.272 . . . . 3.85 111.404 169.047 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -59.02 -35.58 73.52 Favored 'General case' 0 CA--C 1.534 0.345 0 CA-C-N 119.63 1.104 . . . . 0.4 110.789 174.465 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -61.52 -53.33 57.87 Favored 'General case' 0 C--O 1.233 0.194 0 CA-C-N 119.085 0.857 . . . . 3.71 111.481 171.202 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 2.3 ttt180 -45.39 -64.53 0.7 Allowed 'General case' 0 CA--C 1.528 0.129 0 C-N-CA 123.202 0.601 . . . . 2.43 109.966 177.548 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 73' ' ' LEU . . . . . 0.427 HD12 HG23 ' A' ' 85' ' ' VAL . 0.2 OUTLIER -51.08 -53.51 33.4 Favored 'General case' 0 C--N 1.326 -0.448 0 C-N-CA 126.363 1.865 . . . . 0.85 110.063 -179.296 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -61.92 -30.15 70.7 Favored 'General case' 0 CA--C 1.535 0.37 0 O-C-N 121.742 -0.599 . . . . 2.88 112.238 -172.43 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 1.7 p80 -90.9 -18.71 24.3 Favored 'General case' 0 N--CA 1.463 0.201 0 CA-C-O 118.049 -0.977 . . . . 1.2 112.215 176.115 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 5.1 m -55.36 112.69 1.16 Allowed 'General case' 0 N--CA 1.446 -0.63 0 CA-C-N 119.82 1.191 . . . . 1.87 107.963 -173.989 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -44.74 -37.43 3.74 Favored 'General case' 0 C--N 1.325 -0.497 0 C-N-CA 125.684 1.593 . . . . 2.43 110.908 -178.051 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 19.1 t0 -55.33 99.23 0.03 OUTLIER 'General case' 0 N--CA 1.449 -0.493 0 CA-C-O 122.721 1.248 . . . . 2.14 111.439 168.348 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 14.2 p-80 -44.42 -36.73 3.01 Favored 'General case' 0 N--CA 1.449 -0.482 0 CA-C-N 114.467 -1.242 . . . . 4.9 112.558 171.251 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -63.23 -53.71 48.84 Favored 'General case' 0 N--CA 1.449 -0.507 0 CA-C-N 119.365 0.984 . . . . 0.88 110.746 -178.202 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -50.21 -44.37 53.16 Favored 'General case' 0 N--CA 1.465 0.276 0 CA-C-N 119.235 0.925 . . . . 3.56 109.525 178.287 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 44.0 mtp180 -62.59 -56.64 16.01 Favored 'General case' 0 N--CA 1.452 -0.327 0 CA-C-N 115.99 -0.55 . . . . 3.03 110.576 -177.812 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 1.1 mm? -63.72 -17.81 63.38 Favored 'General case' 0 N--CA 1.448 -0.538 0 C-N-CA 123.516 0.727 . . . . 0.68 112.634 179.491 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 45.5 mttt -70.09 -45.64 66.55 Favored 'General case' 0 CA--C 1.511 -0.552 0 CA-C-N 119.835 1.198 . . . . 1.17 108.567 170.51 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 85' ' ' VAL . . . . . 0.427 HG23 HD12 ' A' ' 73' ' ' LEU . 57.2 t -54.28 -51.52 47.38 Favored 'Isoleucine or valine' 0 C--O 1.214 -0.791 0 C-N-CA 119.538 -0.865 . . . . 0.62 109.241 170.062 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 4.2 tm0? -67.06 -51.59 52.71 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 119.583 1.083 . . . . 2.88 111.927 -167.598 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 7.8 ttmm -55.38 -44.81 76.45 Favored 'General case' 0 C--N 1.331 -0.22 0 C-N-CA 124.651 1.18 . . . . 2.6 110.828 175.427 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 15.9 m-20 -77.63 -22.45 50.72 Favored 'General case' 0 CA--C 1.532 0.266 0 C-N-CA 122.732 0.413 . . . . 0.95 111.458 -177.068 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -155.9 69.7 5.14 Favored Pre-proline 0 C--O 1.238 0.459 0 C-N-CA 125.492 1.517 . . . . 0.53 109.365 -165.367 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 30.8 Cg_endo -61.22 -34.82 87.83 Favored 'Trans proline' 0 N--CA 1.449 -1.126 0 C-N-CA 121.873 1.716 . . . . 2.2 109.911 -175.388 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 11.1 tttt -79.45 -44.05 22.1 Favored 'General case' 0 N--CA 1.448 -0.545 0 C-N-CA 124.974 1.31 . . . . 4.62 110.414 -174.375 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 7.2 m -58.16 -47.4 83.49 Favored 'General case' 0 N--CA 1.464 0.269 0 CA-C-N 119.217 0.917 . . . . 0.57 108.983 176.384 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 12.9 t80 -59.59 -45.39 92.01 Favored 'General case' 0 CA--C 1.501 -0.931 0 O-C-N 122.018 -0.426 . . . . 2.0 111.543 -178.265 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 46.8 tt0 -48.99 -44.26 40.97 Favored 'General case' 0 N--CA 1.443 -0.795 0 O-C-N 124.332 1.02 . . . . 3.03 109.333 176.511 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 4.0 t80 -61.99 -54.31 43.46 Favored 'General case' 0 CA--C 1.529 0.148 0 N-CA-C 109.695 -0.483 . . . . 1.63 109.695 -177.378 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 34.8 mm -59.72 -29.41 42.77 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.199 0 C-N-CA 123.518 0.727 . . . . 1.53 111.512 -178.361 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -78.36 -33.89 48.71 Favored 'General case' 0 N--CA 1.453 -0.282 0 O-C-N 121.195 -0.941 . . . . 1.67 110.324 178.863 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -61.09 -56.13 24.49 Favored 'General case' 0 CA--C 1.53 0.199 0 C-N-CA 124.747 1.219 . . . . 2.13 108.799 177.404 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 42.9 mm-40 -78.14 96.92 5.29 Favored 'General case' 0 N--CA 1.452 -0.362 0 O-C-N 121.622 -0.674 . . . . 2.52 109.951 178.119 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 37.7 mt -46.38 130.92 3.06 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.37 0 C-N-CA 125.105 1.362 . . . . 4.65 110.45 179.244 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 1.4 mppt? -83.69 165.74 18.68 Favored 'General case' 0 N--CA 1.454 -0.244 0 N-CA-C 109.712 -0.477 . . . . 11.37 109.712 -177.909 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 102' ' ' PHE . . . . . . . . . . . . . 79.2 m-85 73.27 83.71 0.12 Allowed 'General case' 0 N--CA 1.464 0.226 0 C-N-CA 126.821 2.048 . . . . 12.05 110.903 179.865 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 5.0 tp -84.9 -35.78 10.49 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.405 0 CA-C-N 116.596 -0.274 . . . . 4.26 111.585 -175.149 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 104' ' ' ILE . . . . . . . . . . . . . 84.8 mt -78.77 -63.2 1.16 Allowed 'Isoleucine or valine' 0 CA--C 1.532 0.273 0 N-CA-C 108.128 -1.064 . . . . 7.63 108.128 176.313 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER 58.85 83.99 0.12 Allowed 'General case' 0 CA--C 1.533 0.324 0 C-N-CA 125.942 1.697 . . . . 8.17 113.305 177.39 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 51.1 m . . . . . 0 C--O 1.247 0.973 0 C-N-CA 128.358 2.663 . . . . 8.0 107.614 -178.422 . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.471 1.026 0 N-CA-C 108.948 -1.661 . . . . 12.57 108.948 . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 67.7 m -118.99 -176.09 3.04 Favored 'General case' 0 C--N 1.332 -0.194 0 N-CA-C 107.956 -1.127 . . . . 12.96 107.956 174.856 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 30.2 ttmt -130.93 -42.54 1.11 Allowed 'General case' 0 C--O 1.226 -0.157 0 C-N-CA 122.494 0.318 . . . . 16.25 110.86 -171.612 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -87.96 -174.23 47.87 Favored Glycine 0 C--N 1.334 0.424 0 N-CA-C 109.601 -1.4 . . . . 11.9 109.601 164.501 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 31.7 m -77.15 -159.59 0.04 OUTLIER 'Isoleucine or valine' 0 N--CA 1.446 -0.672 0 N-CA-C 109.142 -0.688 . . . . 12.23 109.142 169.102 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 28.6 mt-10 -103.16 111.24 23.51 Favored 'General case' 0 N--CA 1.447 -0.591 0 CA-C-O 121.474 0.654 . . . . 9.62 111.154 -176.653 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 1.2 mm? -96.33 34.76 1.56 Allowed 'General case' 0 N--CA 1.455 -0.209 0 C-N-CA 122.881 0.473 . . . . 7.57 109.741 -173.804 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 14.7 mtp85 68.84 -71.76 0.11 Allowed 'General case' 0 C--O 1.219 -0.509 0 C-N-CA 123.878 0.871 . . . . 7.43 109.253 -166.837 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 1.1 m120 -44.38 -38.61 4.09 Favored 'General case' 0 C--O 1.226 -0.158 0 N-CA-C 113.635 0.976 . . . . 2.88 113.635 177.205 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 10.3 t70 -73.23 -40.83 64.36 Favored 'General case' 0 C--O 1.225 -0.207 0 CA-C-N 118.296 0.498 . . . . 2.73 111.667 -179.752 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 4.9 t -64.7 -60.57 2.96 Favored 'General case' 0 N--CA 1.458 -0.036 0 N-CA-C 108.998 -0.741 . . . . 2.48 108.998 176.724 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 12' ' ' GLU . . . . . 0.575 ' HA ' HD11 ' A' ' 15' ' ' ILE . 1.1 mp0 -59.99 -36.75 77.85 Favored 'General case' 0 N--CA 1.451 -0.392 0 C-N-CA 124.327 1.051 . . . . 3.8 109.73 -175.215 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -60.91 -54.04 40.17 Favored Glycine 0 CA--C 1.527 0.824 0 N-CA-C 111.062 -0.815 . . . . 0.93 111.062 173.917 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 72.8 t80 -57.33 -54.89 41.66 Favored 'General case' 0 N--CA 1.455 -0.22 0 C-N-CA 123.924 0.889 . . . . 2.42 110.31 -176.344 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 15' ' ' ILE . . . . . 0.575 HD11 ' HA ' ' A' ' 12' ' ' GLU . 0.8 OUTLIER -66.29 -28.95 45.1 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.259 0 O-C-N 121.177 -0.952 . . . . 0.82 112.745 179.105 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 1.6 t-160 -58.82 -53.76 54.75 Favored 'General case' 0 C--N 1.342 0.248 0 N-CA-C 105.938 -1.875 . . . . 0.67 105.938 174.607 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 7.4 mt-10 -53.74 -43.01 68.77 Favored 'General case' 0 C--O 1.223 -0.308 0 CA-C-O 118.824 -0.607 . . . . 2.56 111.175 177.208 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 7.2 t80 -56.83 -44.94 82.58 Favored 'General case' 0 C--N 1.333 -0.137 0 CA-C-N 119.156 0.889 . . . . 2.11 111.228 178.498 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -51.49 -49.64 44.89 Favored Glycine 0 CA--C 1.524 0.645 0 N-CA-C 110.198 -1.161 . . . . 0.58 110.198 170.837 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 20' ' ' HIS . . . . . 0.506 ' CE1' ' HB1' ' A' ' 64' ' ' ALA . 2.0 t60 -59.28 -44.46 92.47 Favored 'General case' 0 N--CA 1.45 -0.473 0 O-C-N 121.59 -0.947 . . . . 1.75 111.641 -178.72 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -61.29 -32.56 72.4 Favored 'General case' 0 N--CA 1.452 -0.343 0 CA-C-N 118.398 0.544 . . . . 0.6 109.849 178.212 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 3.5 t -67.16 -38.66 81.53 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.213 0 O-C-N 121.191 -0.943 . . . . 1.01 111.501 175.122 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 6.8 t0 -60.46 -27.75 67.77 Favored 'General case' 0 C--N 1.333 -0.149 0 CA-C-O 120.9 0.381 . . . . 1.99 110.702 175.02 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 13.8 t70 -65.26 -54.37 30.31 Favored 'General case' 0 N--CA 1.454 -0.253 0 N-CA-C 108.191 -1.04 . . . . 2.3 108.191 -177.137 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 25' ' ' TYR . . . . . 0.717 ' HB2' HD12 ' A' ' 103' ' ' ILE . 10.9 t80 -59.56 -48.83 80.14 Favored 'General case' 0 CA--C 1.517 -0.32 0 CA-C-N 116.098 -0.501 . . . . 2.72 110.503 179.77 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -57.53 -39.67 77.11 Favored 'General case' 0 N--CA 1.448 -0.527 0 CA-C-O 118.646 -0.692 . . . . 1.2 111.014 -179.322 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -64.92 -59.18 8.36 Favored Glycine 0 C--O 1.223 -0.541 0 N-CA-C 109.725 -1.35 . . . . 1.69 109.725 177.767 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -47.97 -44.01 30.06 Favored 'General case' 0 CA--C 1.531 0.233 0 C-N-CA 124.942 1.297 . . . . 2.01 110.989 -174.26 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -82.96 -32.77 26.92 Favored 'General case' 0 N--CA 1.449 -0.499 0 N-CA-C 113.303 0.853 . . . . 1.54 113.303 179.537 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 13.7 mt -129.23 70.67 1.41 Allowed 'General case' 0 N--CA 1.456 -0.157 0 CA-C-N 119.115 0.87 . . . . 2.77 109.689 -166.623 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -131.65 153.3 50.11 Favored 'General case' 0 CA--C 1.518 -0.285 0 N-CA-C 108.917 -0.772 . . . . 4.66 108.917 176.305 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 4.3 ttmt -87.55 -69.55 0.68 Allowed 'General case' 0 C--O 1.226 -0.155 0 N-CA-C 108.011 -1.107 . . . . 10.62 108.011 176.909 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 56.0 t30 -160.32 149.67 17.5 Favored 'General case' 0 N--CA 1.449 -0.523 0 N-CA-C 108.373 -0.973 . . . . 7.12 108.373 169.826 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 35.8 tt0 43.53 42.8 4.22 Favored 'General case' 0 CA--C 1.537 0.476 0 C-N-CA 125.543 1.537 . . . . 8.22 113.185 167.277 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 66.1 m -144.42 46.6 1.4 Allowed 'General case' 0 C--O 1.223 -0.334 0 O-C-N 121.778 -0.576 . . . . 7.03 110.625 -176.897 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -44.12 121.19 2.39 Favored 'General case' 0 CA--C 1.531 0.23 0 C-N-CA 125.385 1.474 . . . . 4.95 113.08 -172.617 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 11.1 mp 101.52 139.33 0.01 OUTLIER 'General case' 0 N--CA 1.467 0.375 1 C-N-CA 131.715 4.006 . . . . 2.25 108.659 173.381 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 9.1 p -64.92 -31.82 55.55 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.223 0 C-N-CA 119.733 -0.787 . . . . 2.39 110.202 -175.053 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 10.3 t -53.52 -62.2 1.81 Allowed 'General case' 0 CA--C 1.537 0.471 0 C-N-CA 122.876 0.47 . . . . 4.35 111.345 -179.427 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 43.9 t30 -89.38 57.51 4.03 Favored 'General case' 0 N--CA 1.462 0.152 0 O-C-N 121.156 -0.965 . . . . 6.14 109.221 -175.121 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 23.2 t -166.84 -47.66 0.02 OUTLIER 'General case' 0 N--CA 1.454 -0.271 0 O-C-N 121.883 -0.51 . . . . 4.12 110.717 -174.465 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 7.8 tptt -55.4 121.04 8.08 Favored 'General case' 0 CA--C 1.532 0.256 0 O-C-N 121.385 -0.822 . . . . 6.92 109.26 179.877 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 24.4 mttm 56.76 -89.72 0.02 OUTLIER 'General case' 0 N--CA 1.463 0.208 0 C-N-CA 123.507 0.723 . . . . 6.34 110.139 -170.75 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 26.7 p90 -172.17 156.94 4.09 Favored 'General case' 0 N--CA 1.45 -0.461 0 C-N-CA 125.425 1.49 . . . . 7.91 107.388 -178.656 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 45' ' ' ILE . . . . . 0.571 HG22 ' OE1' ' A' ' 63' ' ' GLU . 0.1 OUTLIER -42.97 106.19 0.03 OUTLIER 'Isoleucine or valine' 0 CA--C 1.545 0.783 0 C-N-CA 123.842 0.857 . . . . 3.37 112.048 169.411 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 5.8 t70 -148.61 -60.04 0.23 Allowed 'General case' 0 N--CA 1.47 0.561 0 C-N-CA 124.554 1.141 . . . . 2.32 109.483 -179.891 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 47' ' ' ILE . . . . . 0.46 ' HA ' ' HE2' ' A' ' 91' ' ' LYS . 3.4 mm -50.99 -52.0 19.13 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.238 0 C-N-CA 124.989 1.316 . . . . 0.48 107.989 -179.967 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 28.5 t80 -61.82 -36.18 80.41 Favored 'General case' 0 N--CA 1.45 -0.469 0 C-N-CA 124.852 1.261 . . . . 0.4 113.665 173.845 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 49' ' ' LYS . . . . . 0.468 ' HA ' ' HE2' ' A' ' 49' ' ' LYS . 1.0 OUTLIER -59.54 -49.15 78.91 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 120.025 1.284 . . . . 1.0 110.926 -175.23 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 9.5 mm-40 -81.94 -64.02 1.27 Allowed 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 121.902 0.858 . . . . 2.34 109.302 178.708 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 25.6 mm-40 -75.04 -24.05 58.24 Favored 'General case' 0 C--O 1.235 0.341 0 O-C-N 121.703 -0.623 . . . . 2.82 111.208 -164.933 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -72.79 45.2 1.05 Allowed Glycine 0 N--CA 1.442 -0.956 0 C-N-CA 124.622 1.106 . . . . 0.35 112.551 168.716 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 22.2 t -153.2 32.9 0.47 Allowed 'General case' 0 N--CA 1.449 -0.492 0 O-C-N 121.147 -1.208 . . . . 2.32 109.058 151.89 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 2.2 t-20 -133.71 -45.56 0.81 Allowed 'General case' 0 CA--C 1.521 -0.171 0 CA-C-O 120.638 0.256 . . . . 1.58 111.276 -168.433 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 55' ' ' LEU . . . . . 0.535 HD22 HG22 ' A' ' 85' ' ' VAL . 21.2 mt -59.86 -37.22 78.69 Favored 'General case' 0 CA--C 1.529 0.147 0 O-C-N 122.128 -0.357 . . . . 0.67 111.273 -177.275 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER 178.27 173.15 0.66 Allowed 'General case' 0 CA--C 1.533 0.294 0 C-N-CA 126.031 1.733 . . . . 0.69 107.171 -177.889 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 15.5 m -61.94 -35.08 77.38 Favored 'General case' 0 N--CA 1.455 -0.188 0 O-C-N 121.6 -0.687 . . . . 0.93 110.719 169.178 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 1.1 m-85 -69.31 -8.05 42.68 Favored 'General case' 0 N--CA 1.467 0.401 0 O-C-N 121.804 -0.56 . . . . 1.23 112.096 172.32 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -80.65 -18.39 70.77 Favored Glycine 0 N--CA 1.445 -0.72 0 N-CA-C 110.693 -0.963 . . . . 0.45 110.693 170.544 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -104.09 -16.34 15.3 Favored 'General case' 0 CA--C 1.518 -0.254 0 CA-C-N 118.719 1.259 . . . . 2.45 113.128 -176.132 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 41.6 p -64.43 -161.17 0.01 OUTLIER 'General case' 0 CA--C 1.539 0.535 0 N-CA-C 108.972 -0.751 . . . . 0.89 108.972 169.925 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 39.6 m-80 -51.47 145.53 8.57 Favored 'General case' 0 CA--C 1.53 0.21 0 O-C-N 120.369 -1.457 . . . . 1.95 111.011 -176.867 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 63' ' ' GLU . . . . . 0.571 ' OE1' HG22 ' A' ' 45' ' ' ILE . 47.4 tt0 -60.21 -19.37 53.98 Favored 'General case' 0 CA--C 1.541 0.623 0 C-N-CA 124.223 1.009 . . . . 2.95 111.938 -177.703 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 64' ' ' ALA . . . . . 0.506 ' HB1' ' CE1' ' A' ' 20' ' ' HIS . . . -61.24 -47.92 83.84 Favored 'General case' 0 N--CA 1.453 -0.315 0 C-N-CA 125.973 1.709 . . . . 0.47 112.022 168.688 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 5.2 mt-10 -70.39 -42.23 71.99 Favored 'General case' 0 CA--C 1.51 -0.587 0 O-C-N 121.548 -0.72 . . . . 1.7 111.036 177.935 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 63.6 t80 -45.89 -53.26 10.12 Favored 'General case' 0 N--CA 1.45 -0.45 0 C-N-CA 123.397 0.679 . . . . 0.36 110.896 172.385 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 82.0 t80 -64.35 -41.14 96.9 Favored 'General case' 0 CA--C 1.534 0.332 0 O-C-N 122.131 -0.356 . . . . 0.97 111.62 176.523 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -61.38 -50.56 72.4 Favored 'General case' 0 CA--C 1.537 0.462 0 O-C-N 121.022 -1.049 . . . . 0.26 111.262 -174.935 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 5.4 mm-40 -53.69 -43.71 69.17 Favored 'General case' 0 CA--C 1.521 -0.157 0 C-N-CA 124.653 1.181 . . . . 4.17 110.466 168.524 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -55.87 -39.93 72.22 Favored 'General case' 0 N--CA 1.453 -0.3 0 CA-C-N 118.487 0.585 . . . . 0.53 110.214 179.437 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 2.7 t80 -65.04 -51.59 60.64 Favored 'General case' 0 CA--C 1.53 0.2 0 CA-C-N 119.239 0.927 . . . . 2.28 110.921 175.247 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 12.5 ttt180 -43.72 -56.87 3.52 Favored 'General case' 0 N--CA 1.469 0.499 0 C-N-CA 123.849 0.86 . . . . 2.49 110.558 177.134 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 73' ' ' LEU . . . . . 0.461 HD12 HG23 ' A' ' 85' ' ' VAL . 0.2 OUTLIER -59.67 -52.91 63.5 Favored 'General case' 0 N--CA 1.452 -0.371 0 C-N-CA 125.664 1.585 . . . . 1.16 109.819 179.679 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 0.6 OUTLIER -58.26 -37.57 75.22 Favored 'General case' 0 CA--C 1.531 0.22 0 CA-C-N 118.94 0.791 . . . . 2.67 111.899 -171.667 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 75' ' ' HIS . . . . . 0.45 ' CE1' HD12 ' A' ' 15' ' ' ILE . 2.6 p80 -85.49 -14.9 44.59 Favored 'General case' 0 N--CA 1.461 0.091 0 CA-C-O 118.356 -0.83 . . . . 1.6 111.735 -179.849 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 1.1 t -56.5 117.05 3.48 Favored 'General case' 0 N--CA 1.443 -0.809 0 N-CA-C 106.616 -1.624 . . . . 2.34 106.616 -174.65 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -53.39 -32.83 51.31 Favored 'General case' 0 C--N 1.319 -0.757 0 CA-C-N 115.351 -0.84 . . . . 2.66 110.997 -178.838 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 24.4 t0 -55.51 106.26 0.23 Allowed 'General case' 0 N--CA 1.447 -0.584 0 CA-C-O 122.73 1.252 . . . . 2.03 110.247 165.312 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 32.7 m80 -63.12 -29.31 70.7 Favored 'General case' 0 N--CA 1.449 -0.514 0 CA-C-N 115.151 -0.931 . . . . 5.5 110.189 178.985 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -59.81 -56.69 18.66 Favored 'General case' 0 N--CA 1.448 -0.557 0 CA-C-N 119.093 0.86 . . . . 0.78 109.714 177.323 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -43.47 -47.62 7.13 Favored 'General case' 0 C--O 1.232 0.15 0 C-N-CA 124.98 1.312 . . . . 2.78 110.778 179.13 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 35.8 mtp180 -63.83 -54.14 39.64 Favored 'General case' 0 N--CA 1.451 -0.407 0 CA-C-N 114.857 -1.065 . . . . 2.3 110.036 -177.721 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 83' ' ' LEU . . . . . 0.423 HD13 ' HA ' ' A' ' 83' ' ' LEU . 0.9 OUTLIER -63.35 -17.67 62.84 Favored 'General case' 0 N--CA 1.45 -0.46 0 CA-C-O 117.97 -1.014 . . . . 0.86 112.603 176.439 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 2.0 mptm? -66.39 -46.64 75.93 Favored 'General case' 0 CA--C 1.516 -0.329 0 CA-C-N 121.29 1.859 . . . . 1.33 107.731 169.066 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 85' ' ' VAL . . . . . 0.535 HG22 HD22 ' A' ' 55' ' ' LEU . 56.4 t -56.36 -50.93 69.62 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.657 0 CA-C-O 117.607 -1.187 . . . . 0.81 109.822 174.7 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 1.9 mt-30 -59.12 -57.23 13.96 Favored 'General case' 0 N--CA 1.466 0.374 0 CA-C-N 121.475 1.943 . . . . 2.25 112.304 -178.684 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 11.4 tttm -57.25 -38.27 73.6 Favored 'General case' 0 C--N 1.329 -0.292 0 C-N-CA 123.41 0.684 . . . . 2.47 111.602 -175.116 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 17.0 m-80 -84.51 -20.88 30.92 Favored 'General case' 0 C--O 1.222 -0.372 0 CA-C-O 118.476 -0.774 . . . . 1.98 110.705 179.387 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -144.68 81.48 10.93 Favored Pre-proline 0 C--O 1.237 0.403 0 C-N-CA 125.417 1.487 . . . . 0.54 109.907 -174.152 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 84.5 Cg_endo -78.53 35.35 0.54 Allowed 'Trans proline' 0 CA--C 1.54 0.805 0 C-N-CA 123.509 2.806 . . . . 1.82 112.476 -175.205 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 91' ' ' LYS . . . . . 0.46 ' HE2' ' HA ' ' A' ' 47' ' ' ILE . 14.4 ptmt -149.87 -52.41 0.15 Allowed 'General case' 0 N--CA 1.454 -0.232 0 C-N-CA 125.72 1.608 . . . . 2.79 109.628 -179.655 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 3.3 m -50.36 -47.21 56.17 Favored 'General case' 0 N--CA 1.462 0.149 0 O-C-N 121.419 -0.801 . . . . 0.51 111.379 178.2 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 16.6 t80 -58.64 -49.28 78.12 Favored 'General case' 0 CA--C 1.508 -0.659 0 C-N-CA 120.277 -0.569 . . . . 1.92 112.095 -177.901 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 39.8 tt0 -53.02 -36.57 60.66 Favored 'General case' 0 N--CA 1.446 -0.647 0 CA-C-N 115.115 -0.948 . . . . 1.46 109.507 -179.88 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -60.61 -59.87 4.7 Favored 'General case' 0 N--CA 1.45 -0.43 0 C-N-CA 123.296 0.639 . . . . 1.16 109.424 -178.455 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 23.4 mm -47.98 -46.59 12.61 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.249 0 C-N-CA 124.01 0.924 . . . . 1.5 110.428 175.728 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 1.4 t30 -61.21 -35.29 76.81 Favored 'General case' 0 CA--C 1.53 0.186 0 C-N-CA 123.413 0.685 . . . . 1.6 111.175 -176.969 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 35.7 t0 -61.81 -62.22 1.95 Allowed 'General case' 0 CA--C 1.52 -0.2 0 C-N-CA 124.152 0.981 . . . . 2.14 108.855 174.919 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 20.8 pt20 -90.93 73.75 6.47 Favored 'General case' 0 N--CA 1.446 -0.659 0 C-N-CA 120.227 -0.589 . . . . 4.93 111.08 -171.055 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 25.9 pt -48.23 -44.43 12.63 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.352 0 C-N-CA 123.072 0.549 . . . . 4.25 111.437 -176.305 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 4.5 mmtm 59.41 154.64 0.02 OUTLIER 'General case' 0 C--O 1.224 -0.272 0 C-N-CA 126.952 2.101 . . . . 9.88 113.06 -176.375 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 102' ' ' PHE . . . . . . . . . . . . . 30.1 p90 -162.76 48.58 0.16 Allowed 'General case' 0 N--CA 1.453 -0.317 0 CA-C-N 115.0 -1.0 . . . . 7.72 108.589 -170.797 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 103' ' ' ILE . . . . . 0.717 HD12 ' HB2' ' A' ' 25' ' ' TYR . 12.6 tt -51.63 -43.05 31.8 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.389 0 O-C-N 121.62 -0.675 . . . . 4.89 110.33 179.435 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 104' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -149.18 132.59 7.6 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.764 0 N-CA-C 105.326 -2.101 . . . . 5.76 105.326 171.97 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 4.0 t-20 69.47 175.71 0.28 Allowed 'General case' 0 CA--C 1.533 0.312 0 C-N-CA 124.722 1.209 . . . . 7.35 112.121 178.843 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 30.7 m . . . . . 0 C--O 1.251 1.156 0 C-N-CA 126.164 1.786 . . . . 11.75 108.177 175.294 . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.471 1.025 0 N-CA-C 110.2 -1.16 . . . . 19.6 110.2 . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -160.65 167.65 26.55 Favored 'General case' 0 CA--C 1.529 0.141 0 CA-C-N 118.703 1.252 . . . . 19.13 108.806 177.499 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 4.2 ptpt -168.13 159.81 11.3 Favored 'General case' 0 N--CA 1.464 0.243 0 C-N-CA 125.192 1.397 . . . . 24.51 107.741 175.397 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 138.0 -131.48 5.46 Favored Glycine 0 C--N 1.333 0.363 0 N-CA-C 109.736 -1.346 . . . . 17.15 109.736 175.985 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 27.7 m -72.46 -161.59 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.447 -0.612 0 C-N-CA 123.057 0.543 . . . . 15.98 109.577 172.423 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 11.2 pt-20 -80.31 121.96 26.31 Favored 'General case' 0 N--CA 1.449 -0.498 0 O-C-N 121.13 -0.981 . . . . 10.21 111.529 177.134 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 3.2 mt -122.35 34.52 5.13 Favored 'General case' 0 N--CA 1.452 -0.364 0 N-CA-C 107.875 -1.157 . . . . 11.05 107.875 -175.852 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 81.9 mtt180 65.07 44.29 3.43 Favored 'General case' 0 C--O 1.225 -0.199 0 C-N-CA 124.982 1.313 . . . . 9.38 111.679 -173.123 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 2.5 m-20 -47.82 -41.79 24.66 Favored 'General case' 0 CA--C 1.515 -0.388 0 C-N-CA 124.618 1.167 . . . . 3.77 113.752 178.526 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 29.5 t70 -57.32 -50.78 71.86 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 118.226 0.466 . . . . 2.45 110.201 178.684 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 74.4 m -63.1 -51.79 65.18 Favored 'General case' 0 N--CA 1.452 -0.352 0 C-N-CA 122.927 0.491 . . . . 1.74 111.288 178.828 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 12' ' ' GLU . . . . . 0.47 ' HA ' HD11 ' A' ' 15' ' ' ILE . 11.0 mt-10 -59.37 -37.18 77.28 Favored 'General case' 0 N--CA 1.455 -0.197 0 C-N-CA 123.071 0.548 . . . . 3.85 110.507 -176.029 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -59.33 -58.99 11.49 Favored Glycine 0 CA--C 1.527 0.834 0 N-CA-C 110.256 -1.137 . . . . 0.67 110.256 171.623 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 25.5 t80 -55.38 -51.44 66.8 Favored 'General case' 0 N--CA 1.454 -0.239 0 C-N-CA 124.032 0.933 . . . . 2.3 111.487 -173.216 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 15' ' ' ILE . . . . . 0.47 HD11 ' HA ' ' A' ' 12' ' ' GLU . 0.7 OUTLIER -66.02 -32.34 57.68 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.217 0 O-C-N 121.232 -0.918 . . . . 0.44 111.934 179.001 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 3.4 t60 -58.4 -52.28 66.29 Favored 'General case' 0 C--N 1.342 0.279 0 N-CA-C 106.993 -1.484 . . . . 0.49 106.993 176.064 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 44.7 mt-10 -57.47 -41.49 80.74 Favored 'General case' 0 N--CA 1.454 -0.258 0 CA-C-O 118.69 -0.671 . . . . 2.01 111.108 179.298 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -51.66 -47.29 63.84 Favored 'General case' 0 N--CA 1.464 0.269 0 CA-C-N 119.126 0.875 . . . . 3.04 111.72 175.396 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -48.0 -49.91 22.61 Favored Glycine 0 CA--C 1.528 0.895 0 N-CA-C 110.482 -1.047 . . . . 0.44 110.482 174.328 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 20' ' ' HIS . . . . . 0.429 ' CE1' ' HB1' ' A' ' 64' ' ' ALA . 2.4 t-80 -62.11 -40.64 96.59 Favored 'General case' 0 N--CA 1.451 -0.408 0 O-C-N 122.033 -0.687 . . . . 1.9 111.817 178.701 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -60.5 -32.5 71.5 Favored 'General case' 0 N--CA 1.454 -0.244 0 O-C-N 121.002 -1.061 . . . . 0.6 109.971 179.452 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 58.0 t -70.67 -34.43 56.84 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.222 0 O-C-N 121.293 -0.879 . . . . 0.81 111.142 178.041 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 80.0 m-20 -59.86 -29.45 68.3 Favored 'General case' 0 N--CA 1.468 0.441 0 CA-C-N 118.744 0.702 . . . . 2.42 111.33 172.205 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 17.9 t70 -68.45 -48.05 65.56 Favored 'General case' 0 N--CA 1.452 -0.34 0 N-CA-C 108.643 -0.873 . . . . 1.99 108.643 -174.756 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 18.4 t80 -55.53 -46.75 77.02 Favored 'General case' 0 N--CA 1.453 -0.313 0 CA-C-N 115.658 -0.701 . . . . 2.64 110.298 173.325 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -58.93 -28.95 66.72 Favored 'General case' 0 C--O 1.22 -0.476 0 CA-C-O 118.585 -0.722 . . . . 1.17 112.439 176.879 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -71.77 -25.41 75.04 Favored Glycine 0 CA--C 1.525 0.687 0 CA-C-N 119.429 1.013 . . . . 1.7 112.497 179.217 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 1.0 OUTLIER -91.95 -43.82 9.24 Favored 'General case' 0 CA--C 1.53 0.209 0 O-C-N 121.92 -0.753 . . . . 2.86 111.175 -179.828 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -78.66 -38.37 39.66 Favored 'General case' 0 CA--C 1.512 -0.505 0 C-N-CA 124.227 1.011 . . . . 1.6 112.169 -176.666 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 7.9 mt -113.7 175.84 5.29 Favored 'General case' 0 N--CA 1.441 -0.892 0 N-CA-C 104.872 -2.27 . . . . 2.6 104.872 179.326 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 65.4 m-20 63.39 124.91 0.01 OUTLIER 'General case' 0 CA--C 1.536 0.422 0 CA-C-O 123.436 1.588 . . . . 4.96 112.113 -179.239 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 65.0 mttt -92.7 50.15 1.55 Allowed 'General case' 0 N--CA 1.464 0.249 0 O-C-N 119.047 -2.283 . . . . 7.79 110.541 -164.453 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 22.1 t-20 -161.86 103.07 1.16 Allowed 'General case' 0 N--CA 1.451 -0.415 0 C-N-CA 125.409 1.484 . . . . 6.76 107.937 -179.349 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 10.7 mp0 -50.81 -41.93 57.85 Favored 'General case' 0 N--CA 1.466 0.326 0 CA-C-N 119.065 0.848 . . . . 12.79 112.752 -173.127 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 18.8 m -83.43 63.2 7.18 Favored 'General case' 0 N--CA 1.454 -0.265 0 O-C-N 121.717 -0.614 . . . . 9.49 110.224 -179.617 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 36' ' ' ASP . . . . . 0.431 ' C ' HD12 ' A' ' 37' ' ' LEU . 8.6 t0 -154.82 174.29 15.27 Favored 'General case' 0 CA--C 1.532 0.26 0 N-CA-C 108.445 -0.946 . . . . 6.13 108.445 173.934 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 37' ' ' LEU . . . . . 0.431 HD12 ' C ' ' A' ' 36' ' ' ASP . 3.7 mp -141.46 142.1 33.66 Favored 'General case' 0 C--O 1.234 0.266 0 N-CA-C 107.487 -1.301 . . . . 2.55 107.487 178.103 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 1.0 OUTLIER -62.91 114.63 1.7 Allowed 'Isoleucine or valine' 0 C--O 1.226 -0.17 0 N-CA-C 108.172 -1.047 . . . . 3.49 108.172 -176.537 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 9.7 p -139.46 3.22 2.1 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 121.36 0.6 . . . . 3.66 110.425 -178.894 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 9.5 m-80 -163.31 93.69 0.78 Allowed 'General case' 0 N--CA 1.453 -0.312 0 O-C-N 120.689 -1.257 . . . . 4.87 107.839 173.423 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 22.1 t -151.15 -175.26 5.09 Favored 'General case' 0 N--CA 1.452 -0.354 0 N-CA-C 108.57 -0.9 . . . . 3.82 108.57 173.427 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 42' ' ' LYS . . . . . 0.448 ' HE3' ' OD1' ' A' ' 98' ' ' ASP . 10.8 tmtt? 51.27 -79.49 0.01 OUTLIER 'General case' 0 N--CA 1.462 0.16 0 C-N-CA 127.68 2.392 . . . . 7.48 112.468 -176.479 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -72.82 -28.15 62.38 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-O 117.614 -1.184 . . . . 6.43 111.865 177.289 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 13.2 m-85 58.89 102.58 0.02 OUTLIER 'General case' 0 C--N 1.34 0.193 0 C-N-CA 127.023 2.129 . . . . 7.01 112.356 -173.071 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . 0.332 1.7 tt 43.92 -140.17 0.02 OUTLIER 'Isoleucine or valine' 0 CA--C 1.538 0.516 0 CA-C-O 116.511 -1.709 . . . . 4.11 109.812 -177.693 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 20.0 t70 64.28 -68.47 0.1 Allowed 'General case' 0 N--CA 1.479 0.98 0 C-N-CA 127.034 2.134 . . . . 3.03 112.517 -176.949 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 10.5 mm -38.05 -65.66 0.07 OUTLIER 'Isoleucine or valine' 0 N--CA 1.449 -0.521 0 C-N-CA 129.84 3.256 . . . . 0.98 109.912 173.453 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 24.2 t80 -64.74 -26.67 68.46 Favored 'General case' 0 N--CA 1.453 -0.3 0 O-C-N 120.98 -1.075 . . . . 0.46 112.363 179.775 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 49' ' ' LYS . . . . . 0.568 ' HA ' ' HE2' ' A' ' 49' ' ' LYS . 10.2 mmpt? -69.4 -47.79 63.1 Favored 'General case' 0 N--CA 1.452 -0.362 0 O-C-N 120.092 -1.63 . . . . 1.04 111.07 -176.195 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -89.31 -63.36 1.3 Allowed 'General case' 0 C--N 1.33 -0.274 0 N-CA-C 108.077 -1.082 . . . . 3.36 108.077 -177.721 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 7.8 mm-40 -67.16 -33.05 74.59 Favored 'General case' 0 CA--C 1.532 0.278 0 N-CA-C 109.193 -0.669 . . . . 2.2 109.193 -169.221 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -68.13 39.97 0.26 Allowed Glycine 0 CA--C 1.531 1.036 0 C-N-CA 125.836 1.684 . . . . 0.32 114.308 167.646 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 26.4 m -146.75 24.36 1.21 Allowed 'General case' 0 CA--C 1.533 0.29 0 O-C-N 120.771 -1.429 . . . . 2.11 110.66 154.026 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -131.14 -36.67 1.3 Allowed 'General case' 0 C--N 1.341 0.218 0 N-CA-C 113.283 0.845 . . . . 2.77 113.283 -170.81 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 55' ' ' LEU . . . . . 0.561 HD22 HG22 ' A' ' 85' ' ' VAL . 32.7 mt -66.23 -35.47 80.52 Favored 'General case' 0 N--CA 1.465 0.281 0 CA-C-N 119.383 0.992 . . . . 0.55 110.876 -176.873 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 1.3 t 177.98 172.87 0.62 Allowed 'General case' 0 CA--C 1.531 0.246 0 C-N-CA 125.403 1.481 . . . . 0.59 107.837 -178.438 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 6.4 m -57.91 -34.98 70.41 Favored 'General case' 0 N--CA 1.452 -0.34 0 C-N-CA 123.364 0.666 . . . . 0.94 110.544 166.851 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -65.89 -16.54 63.94 Favored 'General case' 0 CA--C 1.534 0.349 0 N-CA-C 112.253 0.464 . . . . 1.0 112.253 175.312 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -85.29 -11.48 75.44 Favored Glycine 0 N--CA 1.444 -0.776 0 N-CA-C 110.786 -0.926 . . . . 0.37 110.786 175.334 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 4.5 tmt_? -105.81 -19.88 13.62 Favored 'General case' 0 C--O 1.228 -0.062 0 CA-C-N 119.025 1.412 . . . . 3.34 112.112 179.556 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 1.6 p -59.46 -164.12 0.01 OUTLIER 'General case' 0 CA--C 1.536 0.442 0 C-N-CA 124.998 1.319 . . . . 0.8 110.723 170.88 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 50.9 t30 -54.46 149.58 10.2 Favored 'General case' 0 CA--C 1.529 0.172 0 O-C-N 120.635 -1.29 . . . . 2.16 110.158 -176.429 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 14.8 tm-20 -56.85 -39.46 74.32 Favored 'General case' 0 C--O 1.222 -0.348 0 CA-C-O 120.995 0.426 . . . . 3.57 110.24 -173.492 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 64' ' ' ALA . . . . . 0.429 ' HB1' ' CE1' ' A' ' 20' ' ' HIS . . . -56.83 -29.18 62.56 Favored 'General case' 0 C--N 1.328 -0.333 0 N-CA-C 113.421 0.897 . . . . 0.51 113.421 178.857 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 6.2 mt-10 -76.95 -42.87 37.39 Favored 'General case' 0 N--CA 1.452 -0.365 0 O-C-N 121.085 -1.009 . . . . 2.15 110.499 175.839 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 27.8 t80 -52.51 -49.63 64.4 Favored 'General case' 0 CA--C 1.532 0.261 0 C-N-CA 125.03 1.332 . . . . 0.28 111.299 172.585 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 47.8 t80 -64.65 -47.01 80.06 Favored 'General case' 0 CA--C 1.534 0.361 0 O-C-N 120.898 -1.126 . . . . 0.52 110.239 177.031 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -57.68 -56.14 25.73 Favored 'General case' 0 CA--C 1.536 0.412 0 O-C-N 121.243 -0.911 . . . . 0.3 111.927 -175.198 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -59.99 -34.0 72.74 Favored 'General case' 0 CA--C 1.53 0.208 0 C-N-CA 123.713 0.805 . . . . 3.7 111.7 174.384 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -56.27 -46.19 79.81 Favored 'General case' 0 C--O 1.221 -0.443 0 CA-C-N 119.155 0.889 . . . . 0.44 109.856 172.211 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 2.2 t80 -55.73 -49.02 74.18 Favored 'General case' 0 N--CA 1.463 0.202 0 CA-C-N 119.355 0.979 . . . . 2.85 111.371 179.539 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 32.6 ttt180 -47.93 -59.67 3.17 Favored 'General case' 0 N--CA 1.466 0.363 0 N-CA-C 109.419 -0.585 . . . . 2.23 109.419 174.04 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 73' ' ' LEU . . . . . 0.48 ' CB ' HG21 ' A' ' 85' ' ' VAL . 0.1 OUTLIER -63.1 -30.62 71.73 Favored 'General case' 0 C--N 1.33 -0.252 0 C-N-CA 124.594 1.158 . . . . 0.42 111.579 -175.043 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -62.92 -41.42 99.46 Favored 'General case' 0 C--N 1.328 -0.366 0 C-N-CA 124.416 1.086 . . . . 3.02 110.14 -175.282 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 75' ' ' HIS . . . . . 0.414 ' CE1' HD12 ' A' ' 15' ' ' ILE . 7.9 p80 -95.81 -4.11 44.42 Favored 'General case' 0 N--CA 1.452 -0.342 0 CA-C-O 116.312 -1.804 . . . . 0.88 112.928 -179.19 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 3.2 m -37.73 125.74 1.15 Allowed 'General case' 0 CA--C 1.516 -0.336 0 CA-C-N 120.296 1.407 . . . . 1.02 111.645 -166.781 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -51.94 -40.57 61.02 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 113.418 -1.719 . . . . 1.04 109.38 178.987 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 78' ' ' ASP . . . . . 0.515 ' OD2' ' HB3' ' A' ' 80' ' ' ALA . 14.6 t0 -72.19 110.44 6.64 Favored 'General case' 0 N--CA 1.446 -0.651 0 C-N-CA 119.357 -0.937 . . . . 1.82 109.448 163.793 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 1.8 p80 -47.44 -39.61 16.07 Favored 'General case' 0 N--CA 1.454 -0.246 0 CA-C-N 115.82 -0.627 . . . . 4.59 112.091 170.869 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 80' ' ' ALA . . . . . 0.515 ' HB3' ' OD2' ' A' ' 78' ' ' ASP . . . -61.6 -48.3 81.56 Favored 'General case' 0 N--CA 1.452 -0.374 0 CA-C-N 118.127 0.422 . . . . 0.6 110.036 -174.873 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 32.1 mt-10 -48.17 -39.39 20.67 Favored 'General case' 0 N--CA 1.452 -0.368 0 C-N-CA 124.22 1.008 . . . . 2.75 111.644 176.588 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 4.8 mtp180 -65.64 -47.26 76.19 Favored 'General case' 0 C--N 1.326 -0.415 0 C-N-CA 119.604 -0.838 . . . . 2.67 108.878 179.545 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 1.5 mm? -61.79 -26.57 68.17 Favored 'General case' 0 N--CA 1.453 -0.285 0 CA-C-O 117.674 -1.155 . . . . 0.55 112.321 174.779 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -62.77 -42.05 99.51 Favored 'General case' 0 C--O 1.224 -0.257 0 CA-C-N 121.231 1.832 . . . . 1.37 108.329 172.773 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 85' ' ' VAL . . . . . 0.561 HG22 HD22 ' A' ' 55' ' ' LEU . 56.0 t -63.41 -61.79 1.5 Allowed 'Isoleucine or valine' 0 C--O 1.22 -0.48 0 CA-C-O 117.425 -1.274 . . . . 0.39 111.148 173.273 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 3.9 mt-30 -49.33 -49.71 42.87 Favored 'General case' 0 N--CA 1.466 0.328 0 CA-C-N 121.024 1.738 . . . . 2.24 111.103 -175.258 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 37.1 tttt -56.85 -53.27 59.79 Favored 'General case' 0 N--CA 1.447 -0.606 0 C-N-CA 123.764 0.826 . . . . 1.95 111.192 178.243 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 56.1 m-20 -88.43 9.75 22.46 Favored 'General case' 0 C--N 1.332 -0.166 0 C-N-CA 122.696 0.398 . . . . 1.4 111.245 -172.986 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 89' ' ' ALA . . . . . 0.493 ' HB2' HD21 ' A' ' 55' ' ' LEU . . . -164.82 68.91 1.39 Allowed Pre-proline 0 N--CA 1.446 -0.642 0 C-N-CA 124.52 1.128 . . . . 0.5 109.013 -177.385 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 93.0 Cg_endo -80.86 57.51 6.57 Favored 'Trans proline' 0 CA--C 1.535 0.535 0 C-N-CA 124.737 3.625 . . . . 2.09 111.939 -170.556 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 5.0 ptmt 174.72 -47.48 0.01 OUTLIER 'General case' 0 CA--C 1.533 0.315 0 C-N-CA 128.299 2.639 . . . . 2.32 109.847 -170.268 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 13.8 m -55.56 -45.81 77.25 Favored 'General case' 0 N--CA 1.465 0.321 0 O-C-N 121.093 -1.004 . . . . 0.37 111.067 176.627 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 29.4 t80 -55.16 -47.24 75.41 Favored 'General case' 0 CA--C 1.513 -0.462 0 CA-C-O 121.584 0.707 . . . . 2.1 110.595 176.684 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 4.3 mt-30 -57.49 -29.2 64.07 Favored 'General case' 0 N--CA 1.443 -0.783 0 CA-C-N 114.427 -1.26 . . . . 2.42 111.443 178.787 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 8.3 t80 -62.91 -55.29 27.37 Favored 'General case' 0 CA--C 1.528 0.119 0 CA-C-N 118.939 0.791 . . . . 1.31 110.093 -179.468 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 3.6 mp -61.2 -41.47 89.64 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.186 0 N-CA-C 108.34 -0.985 . . . . 0.87 108.34 177.121 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 7.0 t30 -58.93 -37.78 77.48 Favored 'General case' 0 CA--C 1.532 0.255 0 N-CA-C 111.884 0.327 . . . . 2.08 111.884 -178.125 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 98' ' ' ASP . . . . . 0.448 ' OD1' ' HE3' ' A' ' 42' ' ' LYS . 0.2 OUTLIER -61.5 -52.76 63.18 Favored 'General case' 0 C--N 1.333 -0.143 0 C-N-CA 125.729 1.611 . . . . 2.73 109.04 175.045 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 21.0 mm100 -77.89 77.64 4.4 Favored 'General case' 0 N--CA 1.454 -0.256 0 C-N-CA 122.91 0.484 . . . . 2.83 110.756 -177.553 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 2.0 pt -73.7 76.25 0.36 Allowed 'Isoleucine or valine' 0 CA--C 1.537 0.466 0 CA-C-O 123.324 1.535 . . . . 5.7 110.11 172.339 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -138.03 157.61 46.0 Favored 'General case' 0 N--CA 1.448 -0.537 0 N-CA-C 107.251 -1.388 . . . . 8.52 107.251 179.833 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 102' ' ' PHE . . . . . . . . . . . . . 28.5 p90 -153.17 171.47 18.43 Favored 'General case' 0 N--CA 1.442 -0.83 0 N-CA-C 105.994 -1.854 . . . . 6.57 105.994 -175.879 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -135.05 139.97 46.16 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.5 0 N-CA-C 104.85 -2.278 . . . . 5.16 104.85 176.001 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 104' ' ' ILE . . . . . . . . . . . . . 3.0 pt -127.49 150.93 33.74 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.294 0 N-CA-C 108.035 -1.098 . . . . 5.79 108.035 -178.425 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 35.7 t30 71.73 101.87 0.07 Allowed 'General case' 0 CA--C 1.53 0.209 0 C-N-CA 125.454 1.501 . . . . 9.78 109.956 -179.753 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 10.8 p . . . . . 0 C--O 1.247 0.957 0 CA-C-O 116.811 -1.566 . . . . 12.66 109.284 -175.005 . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.469 0.858 0 N-CA-C 109.927 -1.269 . . . . 13.82 109.927 . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 14.7 m -62.54 -82.6 0.02 OUTLIER 'General case' 0 C--O 1.226 -0.133 0 CA-C-N 118.475 1.138 . . . . 16.91 112.679 -177.784 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 29.4 ttpt -156.6 137.34 13.3 Favored 'General case' 0 N--CA 1.45 -0.427 0 N-CA-C 107.522 -1.288 . . . . 21.18 107.522 179.768 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 171.05 -176.75 44.31 Favored Glycine 0 CA--C 1.519 0.322 0 N-CA-C 109.073 -1.611 . . . . 15.12 109.073 -174.726 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 18.5 m -78.09 -160.97 0.05 OUTLIER 'Isoleucine or valine' 0 N--CA 1.45 -0.453 0 C-N-CA 122.769 0.428 . . . . 15.2 110.282 -178.405 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -78.25 110.84 13.62 Favored 'General case' 0 N--CA 1.445 -0.685 0 CA-C-O 123.049 1.404 . . . . 11.37 112.021 170.24 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 7' ' ' LEU . . . . . 0.543 HD22 ' H ' ' A' ' 7' ' ' LEU . 0.0 OUTLIER -140.78 42.77 1.84 Allowed 'General case' 0 N--CA 1.447 -0.584 0 C-N-CA 125.887 1.675 . . . . 9.47 107.698 172.542 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 30.8 mtp85 69.24 36.59 2.31 Favored 'General case' 0 C--O 1.224 -0.282 0 C-N-CA 125.161 1.384 . . . . 7.25 113.088 179.016 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 37.3 m-20 -46.45 -43.55 16.67 Favored 'General case' 0 N--CA 1.468 0.436 0 N-CA-C 113.903 1.075 . . . . 3.09 113.903 -177.712 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 31.2 t70 -67.13 -44.33 80.14 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 118.011 0.369 . . . . 2.29 111.398 -178.775 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 4.2 m -64.28 -55.54 20.72 Favored 'General case' 0 CA--C 1.531 0.221 0 O-C-N 121.45 -0.781 . . . . 1.41 111.059 178.133 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 12' ' ' GLU . . . . . 0.434 ' HA ' HD11 ' A' ' 15' ' ' ILE . 5.4 pt-20 -61.56 -37.83 85.27 Favored 'General case' 0 CA--C 1.527 0.088 0 N-CA-C 108.902 -0.777 . . . . 4.25 108.902 -176.61 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -54.73 -58.84 11.66 Favored Glycine 0 C--N 1.337 0.589 0 N-CA-C 109.281 -1.527 . . . . 0.93 109.281 173.105 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 8.5 t80 -54.96 -52.88 61.65 Favored 'General case' 0 N--CA 1.452 -0.345 0 C-N-CA 123.837 0.855 . . . . 2.57 111.122 -171.934 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 15' ' ' ILE . . . . . 0.467 HD12 ' CE1' ' A' ' 75' ' ' HIS . 0.5 OUTLIER -67.47 -33.69 63.92 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.314 0 O-C-N 121.538 -0.726 . . . . 0.49 112.205 -179.597 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 8.2 t60 -62.21 -55.89 24.06 Favored 'General case' 0 CA--C 1.53 0.183 0 N-CA-C 107.351 -1.351 . . . . 0.55 107.351 179.558 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 41.6 mt-10 -55.03 -39.33 69.03 Favored 'General case' 0 N--CA 1.449 -0.493 0 C-N-CA 126.051 1.74 . . . . 2.32 110.823 178.222 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 36.4 t80 -56.69 -52.41 65.03 Favored 'General case' 0 C--N 1.333 -0.144 0 CA-C-N 119.222 0.919 . . . . 2.89 109.813 175.828 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -48.15 -45.61 27.17 Favored Glycine 0 CA--C 1.526 0.756 0 N-CA-C 111.498 -0.641 . . . . 0.57 111.498 172.375 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 19.3 t-80 -61.67 -49.96 74.42 Favored 'General case' 0 N--CA 1.448 -0.56 0 O-C-N 121.631 -0.923 . . . . 1.91 111.456 -179.68 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -59.83 -31.7 69.97 Favored 'General case' 0 N--CA 1.449 -0.479 0 C-N-CA 123.825 0.85 . . . . 0.59 109.643 -176.592 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 93.3 t -62.88 -51.9 66.19 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.24 0 C-N-CA 120.309 -0.556 . . . . 0.73 109.844 177.409 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -65.79 -17.89 64.95 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.361 -0.381 . . . . 3.15 111.376 179.072 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 4.5 t70 -75.42 -51.0 14.1 Favored 'General case' 0 N--CA 1.451 -0.404 0 N-CA-C 107.928 -1.138 . . . . 3.49 107.928 -174.169 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -53.41 -48.86 68.34 Favored 'General case' 0 N--CA 1.453 -0.293 0 CA-C-N 114.44 -1.254 . . . . 4.05 109.369 173.32 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -54.14 -40.86 67.81 Favored 'General case' 0 N--CA 1.453 -0.276 0 C-N-CA 122.836 0.454 . . . . 1.14 111.74 178.273 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -58.03 -56.42 25.27 Favored Glycine 0 CA--C 1.522 0.483 0 N-CA-C 110.313 -1.115 . . . . 1.09 110.313 179.268 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 1.8 t80 -58.03 -40.88 81.98 Favored 'General case' 0 CA--C 1.532 0.266 0 O-C-N 122.069 -0.665 . . . . 2.84 111.386 -174.888 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 1.9 mm? -74.23 -24.93 59.39 Favored 'General case' 0 N--CA 1.447 -0.586 0 N-CA-C 113.956 1.095 . . . . 1.63 113.956 -176.919 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 26.5 mt -118.64 -155.38 0.6 Allowed 'General case' 0 CA--C 1.535 0.376 0 N-CA-C 108.379 -0.971 . . . . 3.07 108.379 -168.506 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 13.6 t0 -72.16 151.22 43.11 Favored 'General case' 0 C--O 1.231 0.117 0 N-CA-C 107.193 -1.41 . . . . 4.92 107.193 161.426 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 32' ' ' LYS . . . . . 0.536 ' HA ' ' HE2' ' A' ' 32' ' ' LYS . 11.7 mmpt? 93.75 83.2 0.01 OUTLIER 'General case' 0 CA--C 1.521 -0.136 0 C-N-CA 128.331 2.652 . . . . 11.32 108.586 174.328 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 48.4 t30 -137.68 151.3 48.11 Favored 'General case' 0 N--CA 1.452 -0.369 0 N-CA-C 107.453 -1.314 . . . . 9.64 107.453 179.856 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER 40.34 37.48 0.44 Allowed 'General case' 0 CA--C 1.537 0.476 0 C-N-CA 127.258 2.223 . . . . 9.58 113.746 -177.289 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 4.2 m -163.45 -56.23 0.04 OUTLIER 'General case' 0 C--O 1.226 -0.162 0 N-CA-C 108.301 -1.0 . . . . 6.12 108.301 178.366 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 4.2 m-20 -138.56 176.6 8.56 Favored 'General case' 0 N--CA 1.456 -0.174 0 C-N-CA 125.49 1.516 . . . . 7.69 107.149 -175.814 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 2.0 mm? -113.61 178.17 4.37 Favored 'General case' 0 CA--C 1.531 0.224 0 C-N-CA 124.862 1.265 . . . . 2.39 108.299 173.684 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 9.5 p -57.02 -29.19 30.76 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.541 0 CA-C-O 118.958 -0.544 . . . . 2.26 111.968 -174.805 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 8.9 t -70.34 63.43 0.25 Allowed 'General case' 0 CA--C 1.538 0.516 0 C-N-CA 124.555 1.142 . . . . 3.87 112.206 172.291 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 23.1 t-20 -158.31 -72.69 0.09 Allowed 'General case' 0 CA--C 1.533 0.317 0 O-C-N 121.079 -1.013 . . . . 6.45 108.616 176.552 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 41' ' ' SER . . . . . 0.53 ' O ' ' HE2' ' A' ' 42' ' ' LYS . 48.0 m -75.09 77.46 2.26 Favored 'General case' 0 N--CA 1.462 0.171 0 O-C-N 121.603 -0.686 . . . . 5.19 110.115 175.25 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 42' ' ' LYS . . . . . 0.53 ' HE2' ' O ' ' A' ' 41' ' ' SER . 8.7 mmpt? -132.29 -70.0 0.57 Allowed 'General case' 0 CA--C 1.515 -0.381 0 N-CA-C 109.03 -0.73 . . . . 7.44 109.03 -177.97 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 36.7 mttp -140.18 98.95 3.55 Favored 'General case' 0 N--CA 1.447 -0.585 0 N-CA-C 102.99 -2.967 . . . . 6.91 102.99 169.022 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 1.9 t80 -2.61 70.14 0.0 OUTLIER 'General case' 0 CA--C 1.537 0.48 0 C-N-CA 130.259 3.424 . . . . 6.47 113.614 -177.32 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 22.4 pt 28.62 73.24 0.02 OUTLIER 'Isoleucine or valine' 0 CA--C 1.541 0.603 0 C-N-CA 125.42 1.488 . . . . 2.44 113.514 -167.258 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 6.8 m-20 -97.13 -64.65 1.02 Allowed 'General case' 0 N--CA 1.464 0.267 0 N-CA-C 108.374 -0.973 . . . . 3.25 108.374 177.585 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 11.9 mm -48.18 -52.97 6.64 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.243 0 C-N-CA 125.298 1.439 . . . . 0.45 109.292 -177.743 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 33.1 t80 -64.42 -33.98 77.14 Favored 'General case' 0 N--CA 1.449 -0.487 0 N-CA-C 112.821 0.674 . . . . 0.45 112.821 179.407 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 49' ' ' LYS . . . . . 0.554 ' HA ' ' HE2' ' A' ' 49' ' ' LYS . 9.4 mmpt? -67.85 -46.28 72.19 Favored 'General case' 0 C--N 1.331 -0.228 0 O-C-N 119.938 -1.726 . . . . 1.29 110.669 -177.994 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 11.8 mm-40 -82.27 -65.97 0.95 Allowed 'General case' 0 N--CA 1.452 -0.359 0 N-CA-C 108.429 -0.952 . . . . 3.93 108.429 -175.887 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 3.7 mm-40 -68.44 -35.37 77.51 Favored 'General case' 0 N--CA 1.451 -0.405 0 C-N-CA 123.935 0.894 . . . . 2.95 109.432 -169.567 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -67.29 38.23 0.21 Allowed Glycine 0 CA--C 1.532 1.136 0 C-N-CA 126.286 1.898 . . . . 0.44 114.035 170.231 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 60.6 p -146.62 22.43 1.29 Allowed 'General case' 0 N--CA 1.449 -0.503 0 O-C-N 120.342 -1.681 . . . . 2.17 112.07 159.747 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 36.2 t-20 -127.29 -46.17 1.5 Allowed 'General case' 0 CA--C 1.518 -0.267 0 CA-C-O 118.936 -0.554 . . . . 2.89 111.62 -176.558 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 29.2 mt -57.13 -35.97 70.11 Favored 'General case' 0 N--CA 1.467 0.395 0 CA-C-N 118.802 0.728 . . . . 0.45 110.896 -169.187 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER 179.53 175.72 0.7 Allowed 'General case' 0 C--O 1.233 0.221 0 C-N-CA 125.508 1.523 . . . . 0.51 107.203 175.233 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 7.9 m -55.86 -32.66 63.84 Favored 'General case' 0 N--CA 1.452 -0.326 0 O-C-N 121.597 -0.689 . . . . 0.93 110.582 165.15 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -63.28 -26.77 68.93 Favored 'General case' 0 C--N 1.342 0.271 0 CA-C-O 121.142 0.496 . . . . 1.22 111.828 175.304 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -75.32 -8.83 84.09 Favored Glycine 0 N--CA 1.442 -0.958 0 CA-C-O 118.24 -1.311 . . . . 0.51 111.465 176.704 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 10.9 ttt-85 -113.06 -17.21 12.48 Favored 'General case' 0 CA--C 1.522 -0.097 0 CA-C-N 119.564 1.682 . . . . 2.7 112.579 -177.493 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -61.27 -168.14 0.01 OUTLIER 'General case' 0 CA--C 1.534 0.358 0 C-N-CA 123.537 0.735 . . . . 1.12 110.115 163.503 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -47.51 148.78 1.3 Allowed 'General case' 0 N--CA 1.464 0.244 0 O-C-N 121.561 -0.712 . . . . 2.05 111.665 -174.311 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 5.0 mt-10 -55.56 -30.26 60.46 Favored 'General case' 0 CA--C 1.534 0.361 0 CA-C-O 121.285 0.564 . . . . 4.68 110.759 -179.862 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -66.18 -35.08 79.53 Favored 'General case' 0 N--CA 1.453 -0.281 0 C-N-CA 124.044 0.938 . . . . 0.63 113.056 176.484 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 6.4 mt-10 -76.27 -41.37 49.14 Favored 'General case' 0 CA--C 1.516 -0.331 0 O-C-N 121.48 -0.763 . . . . 1.89 110.626 176.943 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 50.4 t80 -50.41 -51.85 42.71 Favored 'General case' 0 N--CA 1.451 -0.395 0 C-N-CA 124.441 1.097 . . . . 0.5 110.68 170.024 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 58.0 t80 -65.79 -46.63 77.98 Favored 'General case' 0 CA--C 1.537 0.457 0 O-C-N 121.34 -0.85 . . . . 0.6 110.824 -179.472 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -61.27 -48.97 78.96 Favored 'General case' 0 CA--C 1.535 0.392 0 O-C-N 121.195 -0.94 . . . . 0.35 112.045 -175.345 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -61.96 -37.54 85.14 Favored 'General case' 0 N--CA 1.454 -0.245 0 O-C-N 121.346 -0.846 . . . . 3.58 110.58 173.487 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -55.26 -42.79 73.97 Favored 'General case' 0 C--O 1.22 -0.472 0 CA-C-N 119.009 0.822 . . . . 0.4 109.979 175.329 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -55.8 -51.11 68.57 Favored 'General case' 0 N--CA 1.466 0.339 0 CA-C-N 119.263 0.938 . . . . 3.56 112.147 172.464 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 23.3 ttt180 -50.88 -57.14 9.23 Favored 'General case' 0 CA--C 1.535 0.374 0 N-CA-C 109.409 -0.589 . . . . 2.26 109.409 179.007 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 73' ' ' LEU . . . . . 0.462 ' HB3' HG21 ' A' ' 85' ' ' VAL . 0.1 OUTLIER -66.37 -28.42 68.64 Favored 'General case' 0 C--N 1.326 -0.423 0 C-N-CA 125.128 1.371 . . . . 0.46 111.686 -177.197 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 2.1 ttp -64.66 -36.45 84.32 Favored 'General case' 0 N--CA 1.452 -0.372 0 O-C-N 121.98 -0.45 . . . . 2.98 109.971 -178.832 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 75' ' ' HIS . . . . . 0.467 ' CE1' HD12 ' A' ' 15' ' ' ILE . 26.2 p80 -88.04 -39.85 14.31 Favored 'General case' 0 N--CA 1.452 -0.369 0 CA-C-O 115.827 -2.035 . . . . 1.13 110.591 -178.977 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 21.9 m -5.51 113.37 0.01 OUTLIER 'General case' 0 C--N 1.346 0.443 0 C-N-CA 128.254 2.621 . . . . 1.03 114.361 -171.403 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 3.0 p -47.07 -44.61 21.09 Favored 'General case' 0 N--CA 1.451 -0.401 0 C-N-CA 124.975 1.31 . . . . 1.16 110.27 179.692 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 9.9 t0 -65.86 106.58 1.58 Allowed 'General case' 0 N--CA 1.449 -0.482 0 CA-C-O 121.827 0.822 . . . . 1.91 109.141 166.105 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 54.8 m170 -57.11 -33.04 66.93 Favored 'General case' 0 N--CA 1.454 -0.27 0 CA-C-O 118.974 -0.536 . . . . 5.31 111.04 177.667 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -59.65 -46.74 88.1 Favored 'General case' 0 N--CA 1.45 -0.451 0 CA-C-N 118.713 0.688 . . . . 0.78 110.397 -179.743 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 5.7 mt-10 -48.71 -41.64 32.47 Favored 'General case' 0 C--O 1.232 0.148 0 C-N-CA 123.901 0.88 . . . . 2.68 111.008 176.952 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -64.37 -47.52 78.97 Favored 'General case' 0 C--N 1.329 -0.31 0 N-CA-C 108.518 -0.919 . . . . 3.06 108.518 179.123 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 1.3 mm? -64.99 -18.9 65.69 Favored 'General case' 0 N--CA 1.453 -0.285 0 CA-C-O 117.119 -1.419 . . . . 0.49 113.087 175.573 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -63.69 -49.83 71.61 Favored 'General case' 0 CA--C 1.519 -0.24 0 CA-C-N 122.077 2.217 . . . . 1.6 107.034 167.516 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 85' ' ' VAL . . . . . 0.462 HG21 ' HB3' ' A' ' 73' ' ' LEU . 58.9 t -55.07 -41.33 58.75 Favored 'Isoleucine or valine' 0 C--O 1.214 -0.776 0 CA-C-O 118.486 -0.768 . . . . 0.44 110.846 175.747 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 2.2 tm0? -77.94 -47.61 18.2 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 120.434 1.47 . . . . 3.04 111.844 -171.027 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 20.8 ttmt -54.58 -49.29 70.75 Favored 'General case' 0 C--O 1.226 -0.137 0 O-C-N 121.6 -0.688 . . . . 2.31 109.905 175.721 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 55.1 m-80 -72.73 -41.3 65.32 Favored 'General case' 0 C--O 1.225 -0.213 0 CA-C-O 119.703 -0.189 . . . . 2.25 111.159 -177.728 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -129.56 75.62 79.64 Favored Pre-proline 0 C--O 1.238 0.478 0 C-N-CA 125.832 1.653 . . . . 0.36 110.236 -173.509 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 27.2 Cg_endo -59.58 -33.28 96.92 Favored 'Trans proline' 0 N--CA 1.446 -1.284 0 C-N-CA 121.341 1.361 . . . . 2.02 110.288 -177.244 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 9.1 tttp -80.44 -51.6 8.63 Favored 'General case' 0 N--CA 1.45 -0.47 0 C-N-CA 125.177 1.391 . . . . 5.15 111.13 -173.524 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 5.7 m -54.19 -42.77 70.09 Favored 'General case' 0 N--CA 1.469 0.523 0 CA-C-N 119.378 0.99 . . . . 0.51 110.801 -179.53 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 21.0 t80 -57.52 -47.14 82.78 Favored 'General case' 0 CA--C 1.509 -0.626 0 CA-C-O 121.19 0.519 . . . . 2.16 111.644 179.32 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 21.0 tt0 -56.03 -36.18 67.71 Favored 'General case' 0 N--CA 1.443 -0.798 0 CA-C-N 115.02 -0.991 . . . . 1.75 109.929 178.993 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 9.1 t80 -66.45 -53.59 33.74 Favored 'General case' 0 N--CA 1.455 -0.187 0 C-N-CA 124.158 0.983 . . . . 1.01 110.275 -176.175 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 44.3 mm -59.4 -42.19 86.79 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.209 0 O-C-N 121.828 -0.545 . . . . 1.46 109.78 179.083 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 9.2 m-20 -58.36 -36.19 73.09 Favored 'General case' 0 CA--C 1.528 0.127 0 O-C-N 122.128 -0.357 . . . . 2.35 111.306 177.96 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 1.6 t0 -57.91 -54.75 43.34 Favored 'General case' 0 CA--C 1.53 0.188 0 CA-C-O 121.963 0.887 . . . . 2.01 109.327 177.466 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 25.6 mm100 -86.37 93.52 9.13 Favored 'General case' 0 N--CA 1.452 -0.325 0 O-C-N 121.601 -0.687 . . . . 2.58 110.393 -175.96 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 4.7 pt -53.51 151.37 1.3 Allowed 'Isoleucine or valine' 0 CA--C 1.534 0.353 0 CA-C-O 122.467 1.127 . . . . 4.91 112.938 -178.191 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 20.5 pttp -87.99 103.63 15.88 Favored 'General case' 0 N--CA 1.453 -0.279 0 O-C-N 121.661 -0.649 . . . . 11.18 110.286 -179.822 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 102' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -152.47 117.1 5.04 Favored 'General case' 0 N--CA 1.454 -0.23 0 N-CA-C 106.947 -1.501 . . . . 6.93 106.947 168.153 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 2.9 tp -152.31 150.51 12.86 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.516 0 N-CA-C 107.386 -1.339 . . . . 3.86 107.386 176.356 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 104' ' ' ILE . . . . . . . . . . . . . 2.4 pp -70.91 164.39 3.25 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.203 0 N-CA-C 109.87 -0.419 . . . . 7.84 109.87 178.848 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -131.79 164.7 25.45 Favored 'General case' 0 C--N 1.332 -0.153 0 N-CA-C 108.305 -0.998 . . . . 9.15 108.305 179.972 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 11.1 t . . . . . 0 C--O 1.251 1.183 0 CA-C-O 115.05 -2.405 . . . . 13.63 110.87 -171.461 . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.471 0.971 0 CA-C-O 119.867 -0.407 . . . . 15.6 112.308 . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 63.7 m -148.85 -66.76 0.23 Allowed 'General case' 0 CA--C 1.522 -0.12 0 CA-C-N 118.983 1.391 . . . . 17.64 108.007 172.452 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -170.51 -90.42 0.01 OUTLIER 'General case' 0 N--CA 1.452 -0.358 0 N-CA-C 106.675 -1.602 . . . . 17.19 106.675 171.84 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 81.28 -176.43 54.45 Favored Glycine 0 CA--C 1.521 0.42 0 N-CA-C 109.318 -1.513 . . . . 16.36 109.318 -167.444 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 5' ' ' VAL . . . . . 0.504 HG23 HD11 ' A' ' 7' ' ' LEU . 0.2 OUTLIER -75.38 -172.84 0.13 Allowed 'Isoleucine or valine' 0 CA--C 1.533 0.314 0 C-N-CA 123.385 0.674 . . . . 17.58 111.026 178.304 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -94.48 111.64 23.39 Favored 'General case' 0 N--CA 1.445 -0.678 0 CA-C-O 123.342 1.544 . . . . 12.97 111.968 179.962 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 7' ' ' LEU . . . . . 0.504 HD11 HG23 ' A' ' 5' ' ' VAL . 0.0 OUTLIER -147.87 62.13 1.13 Allowed 'General case' 0 N--CA 1.441 -0.902 0 C-N-CA 126.081 1.752 . . . . 11.16 106.395 171.07 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER 57.78 46.68 16.69 Favored 'General case' 0 C--O 1.226 -0.145 0 CA-C-N 114.963 -1.017 . . . . 6.73 111.183 179.559 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -51.09 -34.34 29.98 Favored 'General case' 0 C--O 1.217 -0.613 0 C-N-CA 123.235 0.614 . . . . 5.2 111.9 179.441 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 2.1 t70 -59.78 -55.88 28.72 Favored 'General case' 0 N--CA 1.447 -0.577 0 C-N-CA 124.062 0.945 . . . . 2.54 111.869 174.307 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 9.2 t -72.09 -48.16 46.02 Favored 'General case' 0 C--N 1.33 -0.245 0 O-C-N 121.849 -0.532 . . . . 1.7 109.843 -170.434 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -69.05 -31.18 69.77 Favored 'General case' 0 C--O 1.221 -0.426 0 N-CA-C 107.306 -1.368 . . . . 5.72 107.306 178.176 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -60.78 -50.55 66.32 Favored Glycine 0 C--O 1.22 -0.725 0 N-CA-C 110.473 -1.051 . . . . 1.15 110.473 178.961 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -51.86 -57.86 8.15 Favored 'General case' 0 C--N 1.333 -0.118 0 CA-C-N 118.565 1.183 . . . . 3.07 110.884 -177.683 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 15' ' ' ILE . . . . . 0.424 HD12 ' CE1' ' A' ' 75' ' ' HIS . 0.4 OUTLIER -67.09 -33.46 63.35 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.434 0 O-C-N 121.99 -0.443 . . . . 0.51 111.314 -176.733 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 3.7 t-160 -62.63 -52.95 61.35 Favored 'General case' 0 N--CA 1.45 -0.472 0 N-CA-C 107.584 -1.265 . . . . 0.96 107.584 -178.765 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 20.2 mt-10 -60.51 -34.51 74.19 Favored 'General case' 0 N--CA 1.45 -0.456 0 C-N-CA 124.244 1.018 . . . . 2.83 110.566 179.132 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -52.3 -54.03 36.61 Favored 'General case' 0 CA--C 1.517 -0.29 0 CA-C-N 119.288 0.949 . . . . 2.41 110.512 171.429 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -47.63 -50.29 19.63 Favored Glycine 0 C--N 1.336 0.535 0 N-CA-C 110.277 -1.129 . . . . 0.73 110.277 172.459 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 20' ' ' HIS . . . . . 0.544 ' CE1' ' HB1' ' A' ' 64' ' ' ALA . 1.8 t-160 -62.26 -35.96 80.57 Favored 'General case' 0 N--CA 1.452 -0.341 0 O-C-N 121.918 -0.754 . . . . 2.02 112.676 -177.555 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -65.68 -32.2 73.64 Favored 'General case' 0 N--CA 1.45 -0.475 0 CA-C-N 119.068 0.849 . . . . 1.34 109.194 178.291 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 17.6 t -66.08 -38.64 82.46 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.239 0 C-N-CA 118.14 -1.424 . . . . 1.49 111.417 173.975 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 11.7 t70 -57.15 -32.62 66.58 Favored 'General case' 0 N--CA 1.464 0.267 0 CA-C-O 121.863 0.84 . . . . 2.54 110.647 173.689 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 36.8 t0 -70.78 -50.21 38.3 Favored 'General case' 0 N--CA 1.448 -0.556 0 N-CA-C 107.93 -1.137 . . . . 2.13 107.93 -172.634 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 25' ' ' TYR . . . . . 0.488 ' CD2' HD11 ' A' ' 103' ' ' ILE . 71.1 t80 -56.89 -50.81 71.39 Favored 'General case' 0 CA--C 1.52 -0.207 0 O-C-N 122.184 -0.322 . . . . 4.19 110.576 178.23 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -55.26 -39.38 69.73 Favored 'General case' 0 N--CA 1.449 -0.479 0 C-N-CA 120.645 -0.422 . . . . 1.29 110.874 -178.045 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -68.85 -50.63 34.23 Favored Glycine 0 C--N 1.334 0.468 0 N-CA-C 110.93 -0.868 . . . . 1.14 110.93 179.597 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -47.34 -46.51 25.61 Favored 'General case' 0 N--CA 1.454 -0.232 0 C-N-CA 124.933 1.293 . . . . 2.74 110.738 -178.607 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -75.58 -38.84 58.86 Favored 'General case' 0 N--CA 1.447 -0.588 0 C-N-CA 124.653 1.181 . . . . 1.74 112.567 178.648 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 13.8 mt -110.0 57.62 0.61 Allowed 'General case' 0 N--CA 1.448 -0.542 0 N-CA-C 106.783 -1.562 . . . . 2.66 106.783 -172.43 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -61.22 152.68 28.22 Favored 'General case' 0 C--O 1.235 0.327 0 CA-C-O 121.856 0.836 . . . . 6.82 110.893 -165.328 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -141.47 76.46 1.55 Allowed 'General case' 0 N--CA 1.446 -0.638 0 C-N-CA 119.896 -0.722 . . . . 7.37 109.356 172.289 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 40.8 t30 36.35 77.14 0.04 OUTLIER 'General case' 0 N--CA 1.464 0.234 0 C-N-CA 125.928 1.691 . . . . 7.61 112.646 171.191 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 3.7 tm0? 95.12 -19.21 0.07 Allowed 'General case' 0 N--CA 1.467 0.384 0 C-N-CA 127.511 2.324 . . . . 8.67 111.183 179.2 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 40.4 m -71.24 98.4 1.72 Allowed 'General case' 0 N--CA 1.456 -0.166 0 O-C-N 121.523 -0.735 . . . . 5.0 109.887 173.974 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 27.3 m-20 -66.46 -38.47 87.42 Favored 'General case' 0 N--CA 1.464 0.238 0 C-N-CA 123.902 0.881 . . . . 7.37 111.116 174.87 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 3.0 mp -111.53 159.52 18.04 Favored 'General case' 0 C--N 1.339 0.114 0 C-N-CA 124.056 0.942 . . . . 2.61 108.643 -174.549 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 8.0 p -77.33 17.74 0.15 Allowed 'Isoleucine or valine' 0 N--CA 1.468 0.47 0 CA-C-N 118.651 0.66 . . . . 2.61 112.254 -179.44 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 9.5 t -66.53 162.57 20.51 Favored 'General case' 0 N--CA 1.444 -0.75 0 O-C-N 121.171 -0.955 . . . . 4.86 109.996 174.281 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 41.8 t-20 63.2 -79.46 0.03 OUTLIER 'General case' 0 CA--C 1.533 0.324 0 C-N-CA 125.837 1.655 . . . . 7.79 111.628 175.245 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 69.2 m -72.27 81.94 1.02 Allowed 'General case' 0 N--CA 1.452 -0.343 0 C-N-CA 123.504 0.722 . . . . 7.35 111.187 177.054 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 7.8 tmtt? -134.66 -66.44 0.6 Allowed 'General case' 0 C--O 1.226 -0.169 0 N-CA-C 108.671 -0.862 . . . . 6.1 108.671 166.935 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 43' ' ' LYS . . . . . 0.449 ' O ' ' HE2' ' A' ' 43' ' ' LYS . 0.2 OUTLIER -152.74 61.84 0.8 Allowed 'General case' 0 C--O 1.223 -0.293 0 N-CA-C 108.608 -0.886 . . . . 6.56 108.608 179.841 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 34.3 m-85 41.42 41.86 1.69 Allowed 'General case' 0 N--CA 1.468 0.464 0 C-N-CA 124.08 0.952 . . . . 5.89 111.951 -172.407 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER 37.12 42.89 0.23 Allowed 'Isoleucine or valine' 0 CA--C 1.546 0.793 0 C-N-CA 125.067 1.347 . . . . 4.23 112.709 -177.99 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 5.0 t70 -57.56 -46.65 83.69 Favored 'General case' 0 N--CA 1.464 0.271 0 C-N-CA 127.653 2.381 . . . . 2.31 111.445 -176.248 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 6.1 mm -58.6 -54.42 33.57 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.402 0 CA-C-N 115.046 -0.979 . . . . 0.93 108.547 179.14 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 28.8 t80 -60.9 -28.95 69.28 Favored 'General case' 0 C--O 1.226 -0.182 0 C-N-CA 124.967 1.307 . . . . 0.51 111.86 176.758 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 49' ' ' LYS . . . . . 0.421 ' CA ' ' HE2' ' A' ' 49' ' ' LYS . 0.1 OUTLIER -66.48 -46.86 74.88 Favored 'General case' 0 N--CA 1.453 -0.324 0 O-C-N 120.854 -1.154 . . . . 1.16 110.191 -172.643 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 6.4 tp10 -84.0 -57.72 3.08 Favored 'General case' 0 N--CA 1.451 -0.412 0 CA-C-O 121.903 0.859 . . . . 2.31 108.984 -179.712 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 20.6 mm-40 -82.62 -20.83 35.62 Favored 'General case' 0 C--O 1.234 0.279 0 O-C-N 121.631 -0.668 . . . . 2.65 111.385 -165.132 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -73.13 41.97 0.93 Allowed Glycine 0 CA--C 1.529 0.953 0 C-N-CA 124.729 1.157 . . . . 0.42 113.365 172.116 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 27.9 m -152.69 33.93 0.49 Allowed 'General case' 0 N--CA 1.453 -0.318 0 C-N-CA 126.57 1.948 . . . . 1.83 107.789 160.508 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 9.7 t-20 -144.73 -38.72 0.27 Allowed 'General case' 0 C--N 1.341 0.213 0 N-CA-C 113.242 0.83 . . . . 2.36 113.242 -161.928 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 16.2 mt -72.01 -38.59 69.58 Favored 'General case' 0 C--N 1.33 -0.257 0 O-C-N 122.236 -0.29 . . . . 0.68 110.947 179.167 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 4.4 t 171.03 172.72 0.07 Allowed 'General case' 0 N--CA 1.467 0.377 0 C-N-CA 125.579 1.551 . . . . 0.91 108.709 -171.412 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 7.6 m -61.56 -36.49 80.78 Favored 'General case' 0 N--CA 1.455 -0.224 0 C-N-CA 124.228 1.011 . . . . 1.34 111.037 172.587 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -65.86 -17.8 64.9 Favored 'General case' 0 CA--C 1.535 0.377 0 CA-C-N 118.107 0.412 . . . . 1.13 111.456 173.818 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -78.8 -12.81 83.79 Favored Glycine 0 N--CA 1.443 -0.85 0 CA-C-O 118.938 -0.923 . . . . 0.44 111.31 174.512 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 4.2 tmt_? -110.08 -15.6 13.99 Favored 'General case' 0 CA--C 1.523 -0.092 0 CA-C-N 119.149 1.475 . . . . 2.66 112.661 -176.946 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 1.3 p -61.8 -168.38 0.01 OUTLIER 'General case' 0 CA--C 1.537 0.447 0 C-N-CA 123.397 0.679 . . . . 1.11 109.798 162.332 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 9.7 m-20 -48.17 145.75 3.03 Favored 'General case' 0 N--CA 1.463 0.222 0 O-C-N 121.359 -0.838 . . . . 2.19 110.882 -177.95 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -50.51 -31.99 16.99 Favored 'General case' 0 CA--C 1.534 0.349 0 C-N-CA 123.99 0.916 . . . . 5.56 111.884 175.177 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 64' ' ' ALA . . . . . 0.544 ' HB1' ' CE1' ' A' ' 20' ' ' HIS . . . -61.11 -42.06 97.83 Favored 'General case' 0 N--CA 1.451 -0.418 0 C-N-CA 124.263 1.025 . . . . 0.52 110.438 178.311 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 7.9 mt-10 -69.82 -45.26 68.24 Favored 'General case' 0 N--CA 1.448 -0.528 0 CA-C-O 117.921 -1.038 . . . . 1.89 110.477 177.073 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 35.7 t80 -51.45 -45.01 62.53 Favored 'General case' 0 CA--C 1.533 0.315 0 C-N-CA 126.041 1.737 . . . . 0.36 112.005 175.303 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 90.4 t80 -69.23 -45.81 68.87 Favored 'General case' 0 C--N 1.328 -0.349 0 O-C-N 120.859 -1.151 . . . . 0.46 109.847 178.267 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -65.02 -39.4 93.36 Favored 'General case' 0 CA--C 1.542 0.65 0 O-C-N 121.495 -0.753 . . . . 0.36 112.058 -174.806 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -72.15 -33.78 68.01 Favored 'General case' 0 C--N 1.333 -0.135 0 O-C-N 121.092 -1.005 . . . . 3.8 110.266 175.233 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -54.01 -42.42 69.06 Favored 'General case' 0 C--O 1.223 -0.313 0 CA-C-N 119.114 0.87 . . . . 0.38 110.419 171.706 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 47.4 t80 -56.65 -49.94 73.55 Favored 'General case' 0 N--CA 1.466 0.357 0 CA-C-N 119.954 1.252 . . . . 4.15 111.315 171.667 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -49.45 -58.77 4.55 Favored 'General case' 0 C--N 1.34 0.157 0 CA-C-N 118.649 0.659 . . . . 3.73 109.791 -179.98 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 73' ' ' LEU . . . . . 0.574 ' CB ' HG21 ' A' ' 85' ' ' VAL . 0.1 OUTLIER -63.78 -27.89 69.5 Favored 'General case' 0 N--CA 1.45 -0.454 0 C-N-CA 124.888 1.275 . . . . 0.54 110.997 -175.429 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 1.5 tmt? -68.64 -36.03 78.06 Favored 'General case' 0 N--CA 1.448 -0.558 0 C-N-CA 122.695 0.398 . . . . 2.62 111.725 -178.988 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 75' ' ' HIS . . . . . 0.424 ' CE1' HD12 ' A' ' 15' ' ' ILE . 10.8 p80 -93.94 -10.6 33.23 Favored 'General case' 0 C--O 1.231 0.08 0 CA-C-O 117.384 -1.293 . . . . 1.2 113.169 -179.535 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 60.1 m -39.01 126.9 1.63 Allowed 'General case' 0 N--CA 1.449 -0.505 0 CA-C-O 123.028 1.394 . . . . 1.01 112.554 -169.488 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 4.1 p -53.53 -44.48 69.22 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 113.254 -1.793 . . . . 1.33 108.588 176.404 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 12.3 t0 -65.8 107.23 1.74 Allowed 'General case' 0 N--CA 1.447 -0.612 0 N-CA-C 108.717 -0.846 . . . . 2.37 108.717 167.151 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -55.9 -33.19 64.42 Favored 'General case' 0 N--CA 1.454 -0.267 0 CA-C-N 116.028 -0.533 . . . . 5.19 110.626 176.304 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -61.06 -49.51 77.06 Favored 'General case' 0 N--CA 1.447 -0.615 0 CA-C-O 118.205 -0.902 . . . . 0.84 110.323 -179.831 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 1.2 mt-10 -46.58 -42.56 16.2 Favored 'General case' 0 C--N 1.34 0.185 0 CA-C-N 119.263 0.938 . . . . 2.74 110.061 179.371 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 2.2 mtp180 -64.87 -54.0 37.89 Favored 'General case' 0 CA--C 1.517 -0.314 0 CA-C-N 115.714 -0.675 . . . . 2.99 109.556 -179.268 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 1.4 mm? -65.68 -17.33 64.52 Favored 'General case' 0 N--CA 1.452 -0.344 0 CA-C-O 117.774 -1.108 . . . . 0.5 112.774 179.89 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 2.5 mptm? -67.54 -48.12 67.9 Favored 'General case' 0 CA--C 1.517 -0.297 0 CA-C-N 121.175 1.807 . . . . 1.56 107.407 168.49 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 85' ' ' VAL . . . . . 0.574 HG21 ' CB ' ' A' ' 73' ' ' LEU . 93.0 t -57.37 -45.62 85.38 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.692 0 C-N-CA 120.452 -0.499 . . . . 0.51 110.689 175.942 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -71.18 -48.76 49.78 Favored 'General case' 0 N--CA 1.45 -0.447 0 CA-C-N 119.667 1.122 . . . . 1.77 110.857 -172.487 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 51.2 tttt -55.41 -51.81 65.63 Favored 'General case' 0 N--CA 1.451 -0.384 0 C-N-CA 124.34 1.056 . . . . 2.6 110.506 177.92 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 12.2 m-20 -64.64 -40.42 95.42 Favored 'General case' 0 N--CA 1.454 -0.262 0 C-N-CA 123.174 0.59 . . . . 1.54 109.967 -179.813 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -137.83 74.21 45.23 Favored Pre-proline 0 C--O 1.238 0.498 0 C-N-CA 125.961 1.705 . . . . 0.47 111.173 -165.136 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 40.5 Cg_endo -64.24 -16.79 56.95 Favored 'Trans proline' 0 N--CA 1.453 -0.908 0 C-N-CA 122.315 2.01 . . . . 1.98 111.934 -175.547 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 22.5 pttt -95.48 -40.28 9.55 Favored 'General case' 0 CA--C 1.531 0.231 0 C-N-CA 123.203 0.601 . . . . 3.42 112.352 -179.125 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 3.3 m -62.46 -45.3 93.69 Favored 'General case' 0 CA--C 1.521 -0.135 0 O-C-N 120.739 -1.225 . . . . 0.36 110.628 -179.522 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 10.3 t80 -61.22 -45.37 94.86 Favored 'General case' 0 CA--C 1.508 -0.659 0 C-N-CA 119.965 -0.694 . . . . 1.85 110.946 -179.906 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 36.7 tt0 -53.88 -37.56 63.84 Favored 'General case' 0 N--CA 1.44 -0.938 0 CA-C-N 114.995 -1.002 . . . . 1.89 110.097 177.212 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 4.9 t80 -60.69 -56.99 14.67 Favored 'General case' 0 N--CA 1.453 -0.276 0 N-CA-C 109.135 -0.691 . . . . 1.25 109.135 -177.74 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 33.9 mm -53.4 -44.07 53.88 Favored 'Isoleucine or valine' 0 C--O 1.227 -0.118 0 O-C-N 121.992 -0.443 . . . . 1.52 110.201 178.05 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 14.7 t30 -62.36 -30.81 71.45 Favored 'General case' 0 CA--C 1.531 0.225 0 C-N-CA 122.886 0.474 . . . . 1.48 111.999 -178.075 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 26.9 t70 -69.8 -43.31 72.36 Favored 'General case' 0 C--O 1.231 0.095 0 C-N-CA 123.124 0.57 . . . . 2.64 110.273 174.989 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 92.7 mm-40 -70.16 -56.03 7.88 Favored 'General case' 0 N--CA 1.45 -0.427 0 CA-C-N 115.862 -0.608 . . . . 2.96 110.886 -172.235 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 1.5 pp -70.35 108.67 2.45 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.268 0 CA-C-O 121.489 0.662 . . . . 6.07 109.232 -174.379 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 38.9 ttmt -145.83 -70.54 0.26 Allowed 'General case' 0 C--O 1.224 -0.238 0 N-CA-C 108.623 -0.881 . . . . 9.56 108.623 -177.663 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 102' ' ' PHE . . . . . . . . . . . . . 3.8 m-85 -142.5 107.68 4.98 Favored 'General case' 0 N--CA 1.451 -0.423 0 N-CA-C 106.053 -1.832 . . . . 6.99 106.053 173.16 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 103' ' ' ILE . . . . . 0.488 HD11 ' CD2' ' A' ' 25' ' ' TYR . 7.0 tp -149.61 149.07 15.02 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.717 0 N-CA-C 108.494 -0.928 . . . . 4.8 108.494 173.566 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 104' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -152.32 138.15 11.6 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.343 0 N-CA-C 105.516 -2.031 . . . . 5.48 105.516 175.828 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 64.9 t30 -151.06 160.5 43.87 Favored 'General case' 0 C--O 1.234 0.237 0 N-CA-C 107.959 -1.126 . . . . 11.22 107.959 172.607 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 71.5 m . . . . . 0 C--O 1.247 0.939 0 CA-C-O 116.617 -1.659 . . . . 11.86 108.606 176.199 . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.531 1.093 0 CA-C-O 115.658 -2.745 . . . . 12.4 115.549 . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 37.0 m 23.54 91.86 0.01 OUTLIER 'General case' 0 N--CA 1.47 0.527 0 C-N-CA 128.332 2.653 . . . . 12.92 115.55 -176.815 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 14.3 ptpt -151.07 53.26 0.86 Allowed 'General case' 0 C--O 1.226 -0.162 0 C-N-CA 122.548 0.339 . . . . 17.04 111.104 -177.45 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 170.06 -169.0 41.88 Favored Glycine 0 C--N 1.333 0.405 0 N-CA-C 110.627 -0.989 . . . . 11.98 110.627 177.872 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 33.3 m -82.84 -159.83 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.447 -0.581 0 N-CA-C 108.916 -0.772 . . . . 12.59 108.916 171.292 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 9.8 pt-20 -76.36 119.39 20.17 Favored 'General case' 0 N--CA 1.451 -0.392 0 CA-C-O 122.017 0.913 . . . . 9.68 110.869 171.048 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -157.26 42.52 0.33 Allowed 'General case' 0 N--CA 1.449 -0.518 0 C-N-CA 124.252 1.021 . . . . 8.33 110.288 178.628 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 14.0 mmm-85 78.95 -63.43 0.28 Allowed 'General case' 0 N--CA 1.472 0.63 0 C-N-CA 125.49 1.516 . . . . 7.9 109.934 176.675 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 2.8 m120 -50.33 -29.65 10.35 Favored 'General case' 0 CA--C 1.514 -0.421 0 C-N-CA 124.925 1.29 . . . . 3.11 113.129 175.52 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 1.2 t70 -63.97 -53.45 49.89 Favored 'General case' 0 C--N 1.322 -0.61 0 C-N-CA 122.767 0.427 . . . . 2.59 110.653 172.893 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 8.2 m -60.52 -52.91 63.19 Favored 'General case' 0 N--CA 1.453 -0.311 0 CA-C-N 118.615 0.643 . . . . 2.17 110.799 -176.853 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 12' ' ' GLU . . . . . 0.48 ' HA ' HD11 ' A' ' 15' ' ' ILE . 6.7 pt-20 -71.64 -25.15 62.02 Favored 'General case' 0 CA--C 1.531 0.224 0 O-C-N 121.766 -0.584 . . . . 3.41 110.967 179.313 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -60.31 -46.3 94.54 Favored Glycine 0 CA--C 1.523 0.556 0 N-CA-C 110.416 -1.074 . . . . 0.68 110.416 172.105 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -59.87 -56.71 18.35 Favored 'General case' 0 C--N 1.331 -0.233 0 C-N-CA 125.189 1.396 . . . . 3.04 109.319 -172.603 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 15' ' ' ILE . . . . . 0.48 HD11 ' HA ' ' A' ' 12' ' ' GLU . 0.7 OUTLIER -64.56 -32.28 57.15 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.302 0 O-C-N 121.334 -0.854 . . . . 0.37 111.768 177.807 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 5.0 t60 -59.96 -47.68 84.82 Favored 'General case' 0 CA--C 1.532 0.268 0 N-CA-C 107.828 -1.175 . . . . 0.57 107.828 176.353 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 20.3 mt-10 -60.8 -38.55 85.72 Favored 'General case' 0 N--CA 1.454 -0.248 0 C-N-CA 124.321 1.048 . . . . 2.59 110.157 179.527 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 1.3 t80 -53.07 -45.99 68.36 Favored 'General case' 0 C--N 1.332 -0.169 0 C-N-CA 123.155 0.582 . . . . 2.26 110.028 172.856 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -48.57 -50.3 25.16 Favored Glycine 0 CA--C 1.529 0.94 0 N-CA-C 111.473 -0.651 . . . . 0.5 111.473 171.923 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 40.6 m-70 -58.84 -50.49 73.78 Favored 'General case' 0 C--O 1.224 -0.247 0 O-C-N 121.148 -1.207 . . . . 3.23 112.205 176.931 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -59.78 -27.92 66.97 Favored 'General case' 0 N--CA 1.453 -0.286 0 CA-C-N 118.227 0.467 . . . . 0.74 110.854 -176.938 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 53.9 t -69.11 -45.18 80.26 Favored 'Isoleucine or valine' 0 C--O 1.232 0.153 0 O-C-N 121.208 -0.933 . . . . 0.78 109.935 174.042 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 1.9 t0 -60.87 -19.7 60.61 Favored 'General case' 0 C--N 1.327 -0.38 0 C-N-CA 124.453 1.101 . . . . 1.86 111.78 178.0 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 9.8 t70 -72.33 -51.79 19.08 Favored 'General case' 0 N--CA 1.455 -0.177 0 C-N-CA 124.806 1.242 . . . . 1.89 109.556 -173.488 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -57.1 -48.37 78.77 Favored 'General case' 0 N--CA 1.457 -0.095 0 CA-C-N 115.544 -0.753 . . . . 3.07 109.418 -178.791 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -64.19 -24.67 67.76 Favored 'General case' 0 N--CA 1.453 -0.299 0 N-CA-C 112.441 0.534 . . . . 1.32 112.441 176.63 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -66.48 -30.75 77.05 Favored Glycine 0 CA--C 1.524 0.655 0 CA-C-N 118.964 0.802 . . . . 1.67 111.49 174.461 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -89.94 -44.82 9.63 Favored 'General case' 0 CA--C 1.529 0.165 0 CA-C-N 118.014 0.907 . . . . 2.74 110.973 -177.817 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 3.2 mm? -77.85 -37.68 47.81 Favored 'General case' 0 N--CA 1.452 -0.337 0 C-N-CA 124.201 1.0 . . . . 1.57 112.432 -175.559 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 13.0 mt -108.4 -143.2 0.38 Allowed 'General case' 0 N--CA 1.447 -0.585 0 N-CA-C 106.317 -1.734 . . . . 2.31 106.317 -174.465 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER 6.15 94.34 0.0 OUTLIER 'General case' 0 N--CA 1.469 0.52 0 C-N-CA 128.502 2.721 . . . . 6.12 115.339 178.061 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -62.91 157.36 21.83 Favored 'General case' 0 C--O 1.225 -0.221 0 O-C-N 121.651 -0.656 . . . . 6.65 110.415 -169.601 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -46.35 88.26 0.0 OUTLIER 'General case' 0 CA--C 1.533 0.31 0 C-N-CA 126.081 1.752 . . . . 7.08 112.673 -170.244 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 6.3 tp-100 -153.53 -53.26 0.1 Allowed 'General case' 0 N--CA 1.454 -0.268 0 C-N-CA 124.89 1.276 . . . . 9.39 107.673 -172.339 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 22.8 t -123.1 145.47 48.54 Favored 'General case' 0 N--CA 1.449 -0.523 0 N-CA-C 106.208 -1.775 . . . . 6.15 106.208 165.348 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 2.8 t70 -84.53 141.97 30.35 Favored 'General case' 0 N--CA 1.449 -0.523 0 N-CA-C 107.019 -1.475 . . . . 5.87 107.019 173.639 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 4.5 mp 63.81 150.99 0.04 OUTLIER 'General case' 0 CA--C 1.544 0.724 0 C-N-CA 126.506 1.922 . . . . 2.36 111.938 -171.17 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 11.6 p -79.73 77.83 0.9 Allowed 'Isoleucine or valine' 0 CA--C 1.539 0.533 0 O-C-N 120.311 -1.493 . . . . 2.69 110.648 -175.757 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 57.5 p -48.58 -48.37 39.02 Favored 'General case' 0 C--N 1.331 -0.237 0 O-C-N 120.242 -1.536 . . . . 3.96 114.4 -166.436 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 18.9 m-80 -159.49 -53.77 0.06 Allowed 'General case' 0 C--N 1.329 -0.32 0 N-CA-C 105.9 -1.889 . . . . 7.24 105.9 170.519 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER 57.33 -161.13 0.22 Allowed 'General case' 0 N--CA 1.452 -0.375 0 CA-C-N 115.462 -0.79 . . . . 2.92 109.895 -170.584 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 8.9 mttm 46.51 -90.22 0.01 OUTLIER 'General case' 0 N--CA 1.47 0.548 0 C-N-CA 124.706 1.202 . . . . 5.84 111.727 -175.855 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -75.19 78.45 2.32 Favored 'General case' 0 N--CA 1.45 -0.441 0 N-CA-C 107.274 -1.38 . . . . 6.71 107.274 173.076 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 1.7 m-85 -52.51 109.34 0.39 Allowed 'General case' 0 N--CA 1.456 -0.17 0 C-N-CA 123.657 0.783 . . . . 5.24 108.995 178.623 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . 0.284 1.5 mp 54.27 67.95 0.14 Allowed 'Isoleucine or valine' 0 CA--C 1.551 1.007 0 CA-C-O 122.886 1.326 . . . . 3.56 110.833 174.151 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 4.5 t0 -137.69 -64.19 0.56 Allowed 'General case' 0 N--CA 1.473 0.714 0 O-C-N 120.637 -1.289 . . . . 2.74 109.048 174.166 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 5.8 mm -53.75 -56.07 10.71 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.331 0 N-CA-C 108.108 -1.071 . . . . 0.49 108.108 -174.801 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 48' ' ' PHE . . . . . 0.538 ' CD2' ' HG2' ' A' ' 63' ' ' GLU . 29.2 t80 -57.73 -34.36 69.42 Favored 'General case' 0 N--CA 1.452 -0.364 0 N-CA-C 113.068 0.766 . . . . 0.41 113.068 174.21 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 49' ' ' LYS . . . . . 0.534 ' HA ' ' HE2' ' A' ' 49' ' ' LYS . 9.3 mmpt? -62.88 -48.33 79.46 Favored 'General case' 0 N--CA 1.454 -0.234 0 O-C-N 120.531 -1.355 . . . . 1.17 111.575 -172.465 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -88.32 -62.95 1.37 Allowed 'General case' 0 C--N 1.329 -0.316 0 N-CA-C 107.226 -1.398 . . . . 4.04 107.226 -177.806 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 13.9 mm-40 -66.21 -34.56 78.3 Favored 'General case' 0 C--O 1.235 0.31 0 CA-C-O 121.369 0.604 . . . . 2.48 109.869 -167.954 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -69.37 34.47 0.33 Allowed Glycine 0 CA--C 1.531 1.071 0 C-N-CA 125.447 1.498 . . . . 0.49 113.328 169.463 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 60.8 p -146.57 27.93 1.09 Allowed 'General case' 0 N--CA 1.451 -0.383 0 O-C-N 120.195 -1.768 . . . . 1.64 110.585 157.152 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 52.5 t-20 -134.48 -47.06 0.75 Allowed 'General case' 0 N--CA 1.453 -0.284 0 CA-C-O 120.725 0.298 . . . . 1.63 111.149 -165.83 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 14.5 mt -63.42 -35.06 79.18 Favored 'General case' 0 C--N 1.333 -0.142 0 O-C-N 121.865 -0.522 . . . . 0.46 111.125 -176.666 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 1.5 t 175.19 167.88 0.31 Allowed 'General case' 0 CA--C 1.531 0.237 0 C-N-CA 125.488 1.515 . . . . 0.55 108.148 -178.272 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 9.7 m -59.53 -33.63 71.63 Favored 'General case' 0 N--CA 1.453 -0.281 0 C-N-CA 123.44 0.696 . . . . 0.92 110.827 168.835 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -66.83 -14.23 62.46 Favored 'General case' 0 CA--C 1.535 0.377 0 C-N-CA 122.775 0.43 . . . . 2.46 111.672 175.842 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -90.26 -11.59 62.63 Favored Glycine 0 N--CA 1.445 -0.733 0 C-N-CA 124.415 1.007 . . . . 0.61 111.105 175.239 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -104.41 -13.93 15.91 Favored 'General case' 0 CA--C 1.521 -0.166 0 CA-C-N 118.711 1.255 . . . . 2.95 112.314 179.177 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 1.3 p -59.83 -173.1 0.02 OUTLIER 'General case' 0 CA--C 1.541 0.607 0 C-N-CA 123.205 0.602 . . . . 1.16 110.006 161.834 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 98.1 m-20 -49.59 153.05 1.24 Allowed 'General case' 0 N--CA 1.467 0.409 0 O-C-N 121.347 -0.846 . . . . 1.58 111.793 -172.8 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 63' ' ' GLU . . . . . 0.538 ' HG2' ' CD2' ' A' ' 48' ' ' PHE . 42.0 mt-10 -54.32 -34.24 60.59 Favored 'General case' 0 CA--C 1.533 0.321 0 O-C-N 122.299 -0.251 . . . . 3.13 111.34 -179.684 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -56.12 -39.36 72.11 Favored 'General case' 0 C--N 1.334 -0.078 0 O-C-N 121.552 -0.718 . . . . 0.62 112.558 176.058 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 1.8 mm-40 -80.19 -34.92 37.08 Favored 'General case' 0 CA--C 1.508 -0.65 0 CA-C-O 118.664 -0.684 . . . . 2.98 110.592 -178.203 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 62.7 t80 -55.15 -48.9 73.07 Favored 'General case' 0 N--CA 1.449 -0.51 0 C-N-CA 123.928 0.891 . . . . 0.51 111.13 170.929 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 82.5 t80 -63.13 -44.7 94.84 Favored 'General case' 0 CA--C 1.535 0.371 0 O-C-N 121.028 -1.045 . . . . 0.68 110.398 175.648 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -60.94 -52.53 64.65 Favored 'General case' 0 CA--C 1.539 0.543 0 O-C-N 121.077 -1.015 . . . . 0.37 112.58 -175.213 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 1.9 pp20? -63.41 -33.29 75.22 Favored 'General case' 0 C--N 1.331 -0.196 0 C-N-CA 124.426 1.09 . . . . 3.73 111.213 174.915 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -53.09 -58.74 5.99 Favored 'General case' 0 C--O 1.222 -0.37 0 CA-C-O 118.075 -0.964 . . . . 0.51 108.741 170.331 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 44.5 t80 -48.5 -48.01 38.33 Favored 'General case' 0 N--CA 1.468 0.445 0 CA-C-N 119.654 1.115 . . . . 2.3 112.01 179.454 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 72' ' ' ARG . . . . . 0.479 ' CG ' HG13 ' A' ' 15' ' ' ILE . 2.4 tmm_? -48.34 -51.46 26.11 Favored 'General case' 0 CA--C 1.539 0.522 0 C-N-CA 122.544 0.338 . . . . 3.24 110.238 176.331 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 73' ' ' LEU . . . . . 0.642 HD12 HG23 ' A' ' 85' ' ' VAL . 0.1 OUTLIER -75.7 -27.35 58.2 Favored 'General case' 0 C--O 1.225 -0.186 0 C-N-CA 124.5 1.12 . . . . 0.49 111.924 -176.711 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 34.0 mmt -58.52 -40.82 83.98 Favored 'General case' 0 CA--C 1.516 -0.349 0 CA-C-N 118.931 0.787 . . . . 5.8 109.627 -179.941 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 22.9 p80 -90.2 -39.6 12.71 Favored 'General case' 0 N--CA 1.449 -0.483 0 CA-C-O 115.815 -2.04 . . . . 1.07 110.758 -176.975 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 3.6 m -3.18 112.46 0.01 OUTLIER 'General case' 0 C--N 1.349 0.569 0 C-N-CA 128.156 2.582 . . . . 1.0 114.445 -172.636 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 2.6 p -46.64 -43.91 17.96 Favored 'General case' 0 N--CA 1.451 -0.396 0 C-N-CA 125.366 1.466 . . . . 0.94 110.836 178.713 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 61.9 t0 -72.35 108.1 5.29 Favored 'General case' 0 N--CA 1.453 -0.313 0 C-N-CA 119.055 -1.058 . . . . 1.91 108.629 167.708 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 92.8 m-70 -50.39 -34.08 22.99 Favored 'General case' 0 N--CA 1.453 -0.292 0 C-N-CA 123.478 0.711 . . . . 5.25 110.93 175.14 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -53.57 -48.94 68.71 Favored 'General case' 0 N--CA 1.45 -0.435 0 CA-C-O 119.205 -0.426 . . . . 0.64 111.039 176.659 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -56.17 -38.52 71.03 Favored 'General case' 0 CA--C 1.52 -0.188 0 CA-C-N 118.363 0.529 . . . . 3.74 110.641 -178.847 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -64.86 -50.32 67.08 Favored 'General case' 0 N--CA 1.452 -0.335 0 N-CA-C 109.068 -0.716 . . . . 3.15 109.068 179.111 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 1.2 mm? -65.11 -21.75 66.85 Favored 'General case' 0 N--CA 1.451 -0.378 0 CA-C-O 118.166 -0.921 . . . . 0.43 112.548 178.241 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 30.6 mttt -66.98 -46.62 74.05 Favored 'General case' 0 C--O 1.222 -0.387 0 N-CA-C 107.083 -1.451 . . . . 1.69 107.083 171.889 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 85' ' ' VAL . . . . . 0.642 HG23 HD12 ' A' ' 73' ' ' LEU . 86.8 t -59.87 -43.32 91.76 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.688 0 C-N-CA 119.541 -0.864 . . . . 0.49 112.183 173.965 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 86' ' ' GLN . . . . . 0.445 ' HG2' ' CG ' ' A' ' 93' ' ' PHE . 1.4 mm-40 -67.76 -53.13 29.75 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 120.554 1.525 . . . . 2.62 110.735 -174.994 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 18.6 tttm -52.82 -50.47 63.62 Favored 'General case' 0 N--CA 1.453 -0.279 0 C-N-CA 125.148 1.379 . . . . 2.07 110.431 177.606 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 5.8 m-20 -67.27 -36.03 80.74 Favored 'General case' 0 N--CA 1.452 -0.327 0 CA-C-O 118.894 -0.574 . . . . 1.1 110.501 -179.034 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -141.06 80.8 16.65 Favored Pre-proline 0 C--O 1.238 0.491 0 C-N-CA 126.266 1.826 . . . . 0.35 110.968 -168.686 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 92.6 Cg_endo -80.26 37.97 0.71 Allowed 'Trans proline' 0 CA--C 1.541 0.837 0 C-N-CA 123.525 2.817 . . . . 1.53 111.974 -176.498 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 2.0 ptmt -155.51 -47.88 0.08 Allowed 'General case' 0 CA--C 1.531 0.225 0 C-N-CA 125.431 1.492 . . . . 2.76 110.079 -175.34 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 3.6 m -53.94 -45.21 71.19 Favored 'General case' 0 N--CA 1.463 0.187 0 O-C-N 121.041 -1.037 . . . . 0.39 110.323 171.957 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 93' ' ' PHE . . . . . 0.445 ' CG ' ' HG2' ' A' ' 86' ' ' GLN . 7.8 t80 -56.82 -47.92 79.16 Favored 'General case' 0 CA--C 1.505 -0.755 0 C-N-CA 120.281 -0.568 . . . . 2.33 111.396 178.582 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 56.3 tt0 -51.27 -35.67 38.47 Favored 'General case' 0 N--CA 1.447 -0.624 0 CA-C-N 115.533 -0.758 . . . . 2.22 110.655 179.934 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 9.0 t80 -55.68 -59.6 4.63 Favored 'General case' 0 CA--C 1.532 0.252 0 CA-C-N 118.534 0.606 . . . . 1.64 110.83 -176.907 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 3.8 mp -69.43 -32.86 54.77 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.202 0 O-C-N 121.624 -0.673 . . . . 1.22 109.297 -178.846 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 47.2 t30 -60.37 -31.78 70.66 Favored 'General case' 0 N--CA 1.453 -0.284 0 O-C-N 121.807 -0.558 . . . . 2.15 110.606 -179.243 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -68.22 -59.81 2.94 Favored 'General case' 0 N--CA 1.456 -0.126 0 C-N-CA 124.688 1.195 . . . . 2.18 108.67 171.15 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 38.6 mm-40 -85.8 77.28 9.78 Favored 'General case' 0 N--CA 1.45 -0.456 0 CA-C-O 121.426 0.631 . . . . 3.42 110.574 -176.307 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 6.7 tp -42.45 -50.98 0.97 Allowed 'Isoleucine or valine' 0 CA--C 1.534 0.361 0 C-N-CA 126.178 1.791 . . . . 4.31 112.321 -178.181 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 34.5 pttt -172.98 162.77 4.71 Favored 'General case' 0 N--CA 1.46 0.055 0 C-N-CA 125.25 1.42 . . . . 8.79 107.909 175.271 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 102' ' ' PHE . . . . . . . . . . . . . 4.1 t80 -144.05 -49.19 0.29 Allowed 'General case' 0 C--O 1.225 -0.233 0 N-CA-C 109.949 -0.389 . . . . 11.53 109.949 -179.451 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -52.79 -35.99 22.49 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.466 0 C-N-CA 123.937 0.895 . . . . 4.57 111.427 175.051 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 104' ' ' ILE . . . . . . . . . . . . . 43.0 mm -74.05 81.46 0.47 Allowed 'Isoleucine or valine' 0 CA--C 1.532 0.25 0 N-CA-C 108.165 -1.05 . . . . 6.3 108.165 176.255 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 4.9 t30 -87.0 143.92 27.13 Favored 'General case' 0 N--CA 1.449 -0.478 0 N-CA-C 107.288 -1.375 . . . . 10.01 107.288 168.671 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 27.2 m . . . . . 0 C--O 1.251 1.17 0 CA-C-O 116.592 -1.671 . . . . 12.45 108.316 175.656 . . . . . . . . 0 0 . 1 . 021 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.468 0.796 0 N-CA-C 108.439 -1.864 . . . . 10.66 108.439 . . . . . . . . . 0 0 . 1 . 021 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 24.7 m -151.24 108.11 3.54 Favored 'General case' 0 N--CA 1.454 -0.25 0 CA-C-N 118.043 0.921 . . . . 12.17 108.97 171.539 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 2.3 ptpp? -159.28 126.13 4.63 Favored 'General case' 0 C--O 1.224 -0.283 0 CA-C-N 119.248 0.931 . . . . 14.32 110.182 167.866 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 68.45 -154.32 53.17 Favored Glycine 0 C--N 1.334 0.458 0 N-CA-C 111.695 -0.562 . . . . 11.74 111.695 176.03 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 33.7 m -81.38 -169.14 0.1 Allowed 'Isoleucine or valine' 0 N--CA 1.446 -0.641 0 N-CA-C 108.786 -0.82 . . . . 12.36 108.786 169.955 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 14.5 pt-20 -79.1 120.37 23.55 Favored 'General case' 0 N--CA 1.445 -0.68 0 O-C-N 121.028 -1.045 . . . . 9.11 111.923 176.757 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -108.18 32.17 4.99 Favored 'General case' 0 N--CA 1.453 -0.275 0 N-CA-C 109.208 -0.664 . . . . 7.99 109.208 178.546 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER 73.9 -58.32 0.59 Allowed 'General case' 0 N--CA 1.465 0.288 0 C-N-CA 125.123 1.369 . . . . 9.81 110.938 -166.558 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 3.9 m120 -59.65 -33.48 71.59 Favored 'General case' 0 CA--C 1.514 -0.439 0 C-N-CA 124.195 0.998 . . . . 2.7 111.96 -177.74 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 5.1 t70 -72.18 -39.57 68.56 Favored 'General case' 0 N--CA 1.449 -0.51 0 C-N-CA 119.528 -0.869 . . . . 3.07 110.36 -176.576 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 60.6 m -68.14 -55.31 12.85 Favored 'General case' 0 C--O 1.231 0.128 0 C-N-CA 123.448 0.699 . . . . 1.53 111.216 177.097 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 12' ' ' GLU . . . . . 0.457 ' HA ' HD11 ' A' ' 15' ' ' ILE . 0.0 OUTLIER -67.34 -30.8 70.71 Favored 'General case' 0 CA--C 1.539 0.557 0 CA-C-O 121.741 0.782 . . . . 4.46 109.262 -176.033 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -70.61 -40.47 66.55 Favored Glycine 0 CA--C 1.528 0.852 0 O-C-N 121.606 -0.684 . . . . 0.71 111.53 173.54 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 28.2 t80 -58.21 -56.2 25.14 Favored 'General case' 0 C--O 1.226 -0.172 0 CA-C-N 118.725 1.263 . . . . 3.36 108.813 -178.942 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 15' ' ' ILE . . . . . 0.457 HD11 ' HA ' ' A' ' 12' ' ' GLU . 0.5 OUTLIER -64.19 -32.51 57.72 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.229 0 CA-C-O 118.832 -0.604 . . . . 0.42 112.456 178.705 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 3.7 t-80 -55.47 -57.91 9.95 Favored 'General case' 0 C--N 1.342 0.261 0 N-CA-C 106.78 -1.563 . . . . 0.46 106.78 176.23 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 6.5 mt-10 -58.84 -36.35 74.41 Favored 'General case' 0 C--O 1.223 -0.307 0 C-N-CA 124.078 0.951 . . . . 3.06 110.624 -178.619 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 1.8 t80 -56.81 -51.33 69.38 Favored 'General case' 0 CA--C 1.521 -0.158 0 C-N-CA 124.075 0.95 . . . . 1.98 110.386 176.907 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -51.79 -45.15 55.49 Favored Glycine 0 CA--C 1.526 0.746 0 N-CA-C 110.309 -1.116 . . . . 0.56 110.309 175.681 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 17.1 t-80 -62.35 -42.91 99.78 Favored 'General case' 0 N--CA 1.451 -0.384 0 O-C-N 122.075 -0.662 . . . . 1.79 111.401 179.445 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -65.42 -30.0 70.75 Favored 'General case' 0 N--CA 1.452 -0.339 0 O-C-N 121.242 -0.911 . . . . 0.79 110.02 179.175 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 71.2 t -71.92 -34.73 51.99 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.175 0 O-C-N 121.067 -1.021 . . . . 1.21 110.278 177.121 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 18.0 t70 -58.26 -26.26 62.73 Favored 'General case' 0 C--O 1.233 0.203 0 CA-C-O 120.952 0.406 . . . . 1.84 111.581 172.787 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 12.8 t70 -65.26 -54.11 34.18 Favored 'General case' 0 CA--C 1.518 -0.266 0 N-CA-C 108.818 -0.808 . . . . 2.0 108.818 -177.369 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -50.43 -49.89 53.6 Favored 'General case' 0 CA--C 1.521 -0.172 0 C-N-CA 125.082 1.353 . . . . 3.75 110.13 178.855 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -55.92 -43.13 77.07 Favored 'General case' 0 N--CA 1.447 -0.581 0 CA-C-O 119.123 -0.465 . . . . 1.09 110.74 179.531 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -62.57 -51.21 57.74 Favored Glycine 0 C--N 1.333 0.396 0 CA-C-N 118.745 0.702 . . . . 1.28 111.656 179.45 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -52.75 -39.91 62.62 Favored 'General case' 0 N--CA 1.453 -0.299 0 C-N-CA 124.917 1.287 . . . . 2.47 110.563 -175.331 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 3.0 mm? -88.8 -24.57 22.57 Favored 'General case' 0 N--CA 1.446 -0.669 0 C-N-CA 124.683 1.193 . . . . 1.42 113.511 179.255 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 16.3 mt -131.14 81.59 2.0 Allowed 'General case' 0 N--CA 1.451 -0.38 0 N-CA-C 108.441 -0.948 . . . . 1.81 108.441 -169.041 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -43.54 -44.85 6.31 Favored 'General case' 0 N--CA 1.467 0.408 0 C-N-CA 126.017 1.727 . . . . 6.76 113.081 -166.884 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 12.5 mmtm 28.09 54.99 0.08 Allowed 'General case' 0 N--CA 1.468 0.463 0 C-N-CA 129.02 2.928 . . . . 8.55 113.615 177.187 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 6.1 t-20 38.53 52.59 1.79 Allowed 'General case' 0 CA--C 1.528 0.107 0 C-N-CA 126.218 1.807 . . . . 7.98 111.819 178.936 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 21.4 tp60 -139.65 -46.66 0.45 Allowed 'General case' 0 N--CA 1.446 -0.66 0 CA-C-N 114.124 -1.398 . . . . 10.69 108.006 -179.423 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 3.0 t 77.34 -41.4 0.37 Allowed 'General case' 0 N--CA 1.462 0.143 0 C-N-CA 126.052 1.741 . . . . 7.5 112.348 179.283 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 33.0 t70 -128.61 118.8 23.57 Favored 'General case' 0 N--CA 1.449 -0.518 0 N-CA-C 105.977 -1.86 . . . . 6.53 105.977 -177.059 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER 63.72 167.42 0.15 Allowed 'General case' 0 CA--C 1.539 0.528 0 C-N-CA 125.53 1.532 . . . . 2.9 111.831 -168.922 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 4.5 p -104.21 -44.25 8.85 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.47 0 O-C-N 121.163 -0.961 . . . . 2.74 110.296 176.927 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER 55.31 -175.2 0.04 OUTLIER 'General case' 0 CA--C 1.541 0.633 0 C-N-CA 125.379 1.472 . . . . 3.61 110.887 -175.076 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 9.6 t30 -73.62 95.79 2.37 Favored 'General case' 0 N--CA 1.453 -0.319 0 O-C-N 119.601 -1.937 . . . . 6.69 109.32 169.031 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 68.3 m -131.76 42.71 3.14 Favored 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 108.311 -0.996 . . . . 4.81 108.311 170.479 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 24.3 mmtp -73.49 -44.49 57.74 Favored 'General case' 0 N--CA 1.467 0.401 0 O-C-N 121.69 -0.632 . . . . 6.19 110.517 175.223 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 52.8 mttm -134.07 -72.0 0.49 Allowed 'General case' 0 CA--C 1.518 -0.252 0 N-CA-C 108.483 -0.932 . . . . 7.28 108.483 -178.602 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -150.69 171.17 17.57 Favored 'General case' 0 N--CA 1.453 -0.299 0 N-CA-C 107.046 -1.465 . . . . 5.74 107.046 171.338 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 7.0 pt -59.33 111.99 0.59 Allowed 'Isoleucine or valine' 0 CA--C 1.538 0.506 0 N-CA-C 108.946 -0.761 . . . . 2.45 108.946 170.199 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 26.6 p-10 -145.63 -59.35 0.33 Allowed 'General case' 0 CA--C 1.533 0.322 0 O-C-N 121.587 -0.696 . . . . 3.94 110.584 -169.824 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 4.6 mm -55.7 -49.97 70.68 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.416 0 C-N-CA 127.316 2.246 . . . . 0.55 107.504 176.138 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 26.5 t80 -60.58 -36.63 79.0 Favored 'General case' 0 N--CA 1.449 -0.498 0 C-N-CA 123.874 0.87 . . . . 0.54 112.866 174.155 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 49' ' ' LYS . . . . . 0.526 ' HA ' ' HE2' ' A' ' 49' ' ' LYS . 10.2 mmpt? -62.61 -46.8 86.62 Favored 'General case' 0 CA--C 1.519 -0.248 0 C-N-CA 118.576 -1.25 . . . . 1.03 110.542 -173.41 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 4.6 tp10 -85.05 -64.76 1.1 Allowed 'General case' 0 N--CA 1.449 -0.479 0 CA-C-O 121.916 0.865 . . . . 2.18 108.669 -177.825 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 14.2 mm-40 -72.52 -29.58 63.72 Favored 'General case' 0 CA--C 1.533 0.324 0 O-C-N 121.609 -0.682 . . . . 2.54 110.331 -167.835 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -70.57 37.8 0.47 Allowed Glycine 0 CA--C 1.528 0.902 0 C-N-CA 125.844 1.688 . . . . 0.37 113.869 169.487 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 63.8 p -142.41 23.89 1.96 Allowed 'General case' 0 N--CA 1.447 -0.624 0 O-C-N 121.085 -1.244 . . . . 1.85 110.152 157.497 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -134.26 -39.45 0.83 Allowed 'General case' 0 C--N 1.341 0.209 0 N-CA-C 112.842 0.682 . . . . 1.76 112.842 -164.541 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 55' ' ' LEU . . . . . 0.514 HD22 HG22 ' A' ' 85' ' ' VAL . 25.7 mt -65.91 -36.6 83.83 Favored 'General case' 0 N--CA 1.463 0.175 0 C-N-CA 120.118 -0.633 . . . . 0.42 110.495 -177.988 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER 178.23 169.65 0.77 Allowed 'General case' 0 CA--C 1.533 0.32 0 C-N-CA 125.622 1.569 . . . . 0.49 107.908 -178.762 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 16.4 m -59.19 -37.88 78.5 Favored 'General case' 0 CA--C 1.529 0.15 0 C-N-CA 124.026 0.93 . . . . 0.91 110.994 171.628 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -60.13 -32.92 71.46 Favored 'General case' 0 C--O 1.223 -0.34 0 C-N-CA 123.784 0.834 . . . . 1.54 109.175 172.53 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -64.06 -6.16 18.05 Favored Glycine 0 CA--C 1.524 0.594 0 O-C-N 121.196 -0.94 . . . . 0.39 112.442 176.46 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -121.57 0.88 10.0 Favored 'General case' 0 N--CA 1.454 -0.27 0 CA-C-N 119.01 1.405 . . . . 4.36 112.491 -177.49 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 58.9 p -73.92 -127.58 0.01 OUTLIER 'General case' 0 CA--C 1.534 0.359 0 N-CA-C 108.881 -0.785 . . . . 0.93 108.881 174.834 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 1.7 m120 -74.63 150.91 39.43 Favored 'General case' 0 CA--C 1.531 0.23 0 O-C-N 120.072 -1.642 . . . . 1.68 108.822 176.484 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 31.0 tt0 -62.41 -24.23 67.28 Favored 'General case' 0 CA--C 1.539 0.523 0 O-C-N 121.596 -0.69 . . . . 3.34 111.191 179.615 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -67.33 -33.89 76.19 Favored 'General case' 0 N--CA 1.454 -0.241 0 C-N-CA 124.15 0.98 . . . . 0.77 112.132 173.364 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 3.3 mt-10 -75.97 -49.61 17.22 Favored 'General case' 0 C--O 1.219 -0.525 0 N-CA-C 108.23 -1.026 . . . . 2.07 108.23 177.778 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 59.8 t80 -40.06 -51.31 2.59 Favored 'General case' 0 CA--C 1.537 0.464 0 C-N-CA 123.885 0.874 . . . . 0.37 111.874 170.932 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 62.9 t80 -60.82 -43.89 97.61 Favored 'General case' 0 CA--C 1.539 0.54 0 O-C-N 121.705 -0.622 . . . . 0.47 111.887 174.927 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -62.11 -52.07 65.34 Favored 'General case' 0 CA--C 1.535 0.368 0 C-N-CA 124.647 1.179 . . . . 0.33 112.352 -177.951 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 4.5 mp0 -57.29 -43.69 83.38 Favored 'General case' 0 CA--C 1.515 -0.402 0 O-C-N 121.075 -1.015 . . . . 4.46 109.89 172.56 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -57.49 -34.57 69.19 Favored 'General case' 0 N--CA 1.451 -0.396 0 CA-C-N 118.286 0.494 . . . . 0.5 110.421 -179.544 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -60.51 -55.67 30.58 Favored 'General case' 0 CA--C 1.534 0.363 0 C-N-CA 124.057 0.943 . . . . 2.99 111.385 169.917 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -48.92 -53.8 18.1 Favored 'General case' 0 CA--C 1.536 0.408 0 O-C-N 121.513 -0.742 . . . . 3.89 110.407 178.61 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -68.69 -49.16 61.14 Favored 'General case' 0 N--CA 1.449 -0.521 0 C-N-CA 126.465 1.906 . . . . 0.52 109.586 -171.509 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -63.16 -26.5 68.84 Favored 'General case' 0 CA--C 1.529 0.158 0 O-C-N 120.719 -1.238 . . . . 2.67 111.895 -178.506 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 75' ' ' HIS . . . . . 0.411 ' CE1' HD12 ' A' ' 15' ' ' ILE . 0.3 OUTLIER -91.23 -13.97 31.8 Favored 'General case' 0 C--N 1.338 0.106 0 CA-C-O 117.627 -1.177 . . . . 1.01 111.736 175.974 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 73.5 p -46.61 123.72 5.27 Favored 'General case' 0 N--CA 1.447 -0.585 0 CA-C-O 122.819 1.295 . . . . 2.17 108.611 -168.666 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -52.82 -39.75 62.7 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 113.604 -1.635 . . . . 1.36 109.206 -179.254 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 78' ' ' ASP . . . . . 0.417 ' OD2' ' HB3' ' A' ' 80' ' ' ALA . 17.3 t0 -68.1 104.45 1.79 Allowed 'General case' 0 N--CA 1.444 -0.759 0 CA-C-O 122.411 1.1 . . . . 2.03 110.466 167.816 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 9.0 p-80 -39.46 -40.9 0.9 Allowed 'General case' 0 N--CA 1.453 -0.299 0 CA-C-N 114.904 -1.044 . . . . 4.52 113.362 168.609 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 80' ' ' ALA . . . . . 0.417 ' HB3' ' OD2' ' A' ' 78' ' ' ASP . . . -65.15 -48.23 74.26 Favored 'General case' 0 N--CA 1.45 -0.469 0 CA-C-N 119.159 0.891 . . . . 0.64 110.273 -176.001 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 3.6 mt-10 -50.28 -38.14 39.65 Favored 'General case' 0 N--CA 1.454 -0.256 0 CA-C-N 118.884 0.766 . . . . 2.88 110.949 175.631 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 2.6 mtp180 -63.97 -52.51 59.32 Favored 'General case' 0 CA--C 1.516 -0.33 0 C-N-CA 119.156 -1.018 . . . . 2.44 109.733 177.8 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 1.3 mm? -60.19 -23.68 64.18 Favored 'General case' 0 N--CA 1.452 -0.356 0 CA-C-O 117.819 -1.086 . . . . 0.52 112.267 178.778 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 2.7 mptm? -61.46 -43.9 98.05 Favored 'General case' 0 C--O 1.224 -0.283 0 CA-C-N 120.811 1.641 . . . . 1.3 108.791 172.061 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 85' ' ' VAL . . . . . 0.514 HG22 HD22 ' A' ' 55' ' ' LEU . 61.7 t -62.22 -61.83 1.44 Allowed 'Isoleucine or valine' 0 C--O 1.221 -0.431 0 CA-C-N 118.898 0.772 . . . . 0.55 109.745 171.321 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -55.12 -30.55 59.98 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 119.046 0.839 . . . . 2.67 113.073 -168.274 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 43.1 tttt -75.98 -60.17 2.44 Favored 'General case' 0 N--CA 1.451 -0.402 0 C-N-CA 125.526 1.531 . . . . 2.32 109.932 173.117 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 10.0 m-20 -76.79 6.51 5.96 Favored 'General case' 0 CA--C 1.533 0.303 0 C-N-CA 123.776 0.83 . . . . 1.25 111.917 -172.798 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 89' ' ' ALA . . . . . 0.509 ' HB2' HD21 ' A' ' 55' ' ' LEU . . . -162.21 73.66 2.26 Favored Pre-proline 0 N--CA 1.445 -0.724 0 C-N-CA 125.657 1.583 . . . . 0.41 108.625 -176.85 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 68.7 Cg_endo -81.82 49.85 3.3 Favored 'Trans proline' 0 CA--C 1.539 0.749 0 C-N-CA 124.041 3.161 . . . . 2.04 111.513 -172.726 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 1.2 ptmt -175.01 -49.99 0.01 OUTLIER 'General case' 0 C--O 1.225 -0.229 0 C-N-CA 126.972 2.109 . . . . 2.42 109.407 -173.783 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 3.2 m -53.2 -41.97 65.83 Favored 'General case' 0 N--CA 1.462 0.163 0 O-C-N 121.293 -0.879 . . . . 0.41 111.448 176.694 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 34.2 t80 -57.88 -52.46 65.4 Favored 'General case' 0 CA--C 1.503 -0.854 0 C-N-CA 120.127 -0.629 . . . . 2.36 110.971 177.251 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 32.2 tt0 -53.22 -34.11 55.67 Favored 'General case' 0 N--CA 1.444 -0.764 0 CA-C-N 115.148 -0.933 . . . . 1.89 110.043 178.152 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 6.0 t80 -61.7 -58.13 9.23 Favored 'General case' 0 N--CA 1.451 -0.408 0 C-N-CA 123.138 0.575 . . . . 1.05 110.393 -176.711 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 4.2 mp -63.21 -33.87 63.58 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.195 0 O-C-N 120.912 -1.117 . . . . 0.89 109.695 176.912 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -60.89 -33.06 72.54 Favored 'General case' 0 CA--C 1.535 0.382 0 CA-C-N 118.814 0.734 . . . . 1.71 110.839 -178.592 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 28.0 t70 -59.59 -41.57 90.59 Favored 'General case' 0 N--CA 1.464 0.257 0 C-N-CA 124.542 1.137 . . . . 2.98 110.009 172.794 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 78.5 mm-40 -83.89 -42.44 16.35 Favored 'General case' 0 N--CA 1.447 -0.584 0 CA-C-N 115.857 -0.611 . . . . 2.94 112.415 -167.644 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 17.8 tt -80.04 75.05 0.76 Allowed 'Isoleucine or valine' 0 CA--C 1.533 0.326 0 CA-C-O 122.057 0.932 . . . . 6.07 110.445 -171.048 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -137.57 80.53 1.81 Allowed 'General case' 0 C--O 1.226 -0.166 0 O-C-N 121.235 -0.915 . . . . 8.97 109.366 -172.212 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 102' ' ' PHE . . . . . . . . . . . . . 46.0 m-85 43.05 79.81 0.04 OUTLIER 'General case' 0 CA--C 1.53 0.207 0 C-N-CA 124.819 1.248 . . . . 7.79 111.93 -172.314 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 10.8 tp -121.44 72.25 0.41 Allowed 'Isoleucine or valine' 0 N--CA 1.454 -0.239 0 N-CA-C 107.982 -1.118 . . . . 6.72 107.982 178.257 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 104' ' ' ILE . . . . . . . . . . . . . 11.4 pt -129.97 175.29 11.13 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.21 0 C-N-CA 124.256 1.022 . . . . 7.59 108.493 179.487 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 7.8 p30 -147.86 175.9 10.57 Favored 'General case' 0 C--N 1.33 -0.279 0 C-N-CA 124.843 1.257 . . . . 8.27 107.682 177.79 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 2.5 p . . . . . 0 C--O 1.249 1.067 0 CA-C-O 116.486 -1.721 . . . . 11.66 108.53 -173.975 . . . . . . . . 0 0 . 1 . 022 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.474 1.18 0 N-CA-C 109.154 -1.578 . . . . 11.93 109.154 . . . . . . . . . 0 0 . 1 . 022 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 26.5 t -155.38 177.0 11.85 Favored 'General case' 0 C--O 1.232 0.166 0 CA-C-N 118.339 1.069 . . . . 12.64 108.593 -175.416 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 37.9 ttpt -155.01 133.64 12.01 Favored 'General case' 0 N--CA 1.451 -0.388 0 N-CA-C 108.602 -0.888 . . . . 17.09 108.602 176.567 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 159.68 -166.41 34.9 Favored Glycine 0 N--CA 1.449 -0.443 0 N-CA-C 108.408 -1.877 . . . . 12.52 108.408 -179.469 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 31.6 m -90.25 -157.22 0.07 OUTLIER 'Isoleucine or valine' 0 N--CA 1.442 -0.845 0 N-CA-C 107.07 -1.455 . . . . 13.02 107.07 157.172 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 7.9 pt-20 -99.18 119.66 38.24 Favored 'General case' 0 N--CA 1.444 -0.757 0 CA-C-O 121.803 0.811 . . . . 9.6 110.862 174.981 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 7' ' ' LEU . . . . . 0.4 HD22 ' N ' ' A' ' 7' ' ' LEU . 1.8 mm? -109.51 32.57 4.92 Favored 'General case' 0 N--CA 1.453 -0.296 0 C-N-CA 123.854 0.862 . . . . 8.48 109.66 -178.818 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 21.5 mtp180 68.71 -67.37 0.21 Allowed 'General case' 0 N--CA 1.465 0.322 0 C-N-CA 125.704 1.602 . . . . 6.59 110.861 -172.165 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 14.0 m-20 -51.94 -35.67 46.68 Favored 'General case' 0 CA--C 1.513 -0.455 0 C-N-CA 123.952 0.901 . . . . 2.67 112.101 174.174 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 19.3 t70 -68.15 -43.44 78.27 Favored 'General case' 0 C--O 1.22 -0.482 0 C-N-CA 118.615 -1.234 . . . . 3.62 110.479 178.957 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 74.6 m -58.28 -59.08 5.87 Favored 'General case' 0 CA--C 1.531 0.217 0 CA-C-N 119.08 0.854 . . . . 1.5 111.601 177.189 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 12' ' ' GLU . . . . . 0.511 ' HA ' HD11 ' A' ' 15' ' ' ILE . 27.8 mt-10 -68.33 -27.6 66.41 Favored 'General case' 0 CA--C 1.53 0.204 0 CA-C-O 121.369 0.604 . . . . 3.85 110.575 -177.414 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -62.81 -41.08 99.92 Favored Glycine 0 CA--C 1.526 0.763 0 N-CA-C 111.047 -0.821 . . . . 0.58 111.047 170.949 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 1.1 t80 -67.78 -52.2 40.04 Favored 'General case' 0 N--CA 1.455 -0.176 0 CA-C-N 118.476 1.138 . . . . 2.61 109.139 -171.464 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 15' ' ' ILE . . . . . 0.511 HD11 ' HA ' ' A' ' 12' ' ' GLU . 1.1 pt -62.11 -36.37 73.9 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.301 0 CA-C-O 119.12 -0.467 . . . . 0.4 112.057 175.625 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 3.5 t60 -58.25 -54.52 46.05 Favored 'General case' 0 CA--C 1.534 0.363 0 N-CA-C 107.286 -1.376 . . . . 0.46 107.286 176.99 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 5.6 mt-10 -50.14 -49.05 53.28 Favored 'General case' 0 C--O 1.224 -0.255 0 C-N-CA 124.755 1.222 . . . . 3.03 109.38 176.673 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -53.72 -47.98 70.05 Favored 'General case' 0 CA--C 1.518 -0.265 0 C-N-CA 124.829 1.252 . . . . 2.29 110.933 -178.931 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -49.06 -49.65 29.48 Favored Glycine 0 CA--C 1.524 0.617 0 N-CA-C 110.393 -1.083 . . . . 0.43 110.393 173.614 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 20' ' ' HIS . . . . . 0.576 ' CE1' ' HB1' ' A' ' 64' ' ' ALA . 2.1 t-160 -61.33 -43.25 99.19 Favored 'General case' 0 N--CA 1.452 -0.331 0 O-C-N 121.901 -0.764 . . . . 1.95 111.413 178.041 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -61.94 -29.6 70.34 Favored 'General case' 0 N--CA 1.45 -0.464 0 O-C-N 120.909 -1.12 . . . . 0.62 110.396 -179.474 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 90.2 t -68.01 -41.11 84.25 Favored 'Isoleucine or valine' 0 CA--C 1.52 -0.201 0 O-C-N 121.332 -0.855 . . . . 0.81 110.07 174.594 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 17.0 t0 -55.65 -31.54 62.43 Favored 'General case' 0 C--O 1.234 0.263 0 CA-C-O 121.779 0.8 . . . . 2.1 111.087 173.9 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 14.3 t70 -77.42 -47.6 19.34 Favored 'General case' 0 N--CA 1.45 -0.472 0 C-N-CA 124.419 1.088 . . . . 2.01 109.372 -173.54 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 29.0 t80 -62.05 -52.24 64.74 Favored 'General case' 0 N--CA 1.452 -0.351 0 N-CA-C 109.264 -0.643 . . . . 2.44 109.264 179.338 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -54.43 -38.69 66.59 Favored 'General case' 0 N--CA 1.448 -0.541 0 CA-C-O 119.26 -0.4 . . . . 1.21 111.142 176.739 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -62.0 -53.54 42.06 Favored Glycine 0 CA--C 1.523 0.576 0 N-CA-C 110.669 -0.972 . . . . 1.39 110.669 177.398 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -59.03 -43.27 91.59 Favored 'General case' 0 N--CA 1.455 -0.198 0 C-N-CA 124.003 0.921 . . . . 2.23 110.517 -173.451 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -79.79 -33.3 40.63 Favored 'General case' 0 N--CA 1.449 -0.498 0 C-N-CA 124.112 0.965 . . . . 2.1 112.927 -177.155 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 14.4 mt -120.51 56.65 0.98 Allowed 'General case' 0 CA--C 1.521 -0.158 0 CA-C-N 119.037 0.835 . . . . 2.43 109.276 -165.659 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 63.2 t0 -64.27 120.79 12.83 Favored 'General case' 0 CA--C 1.533 0.297 0 N-CA-C 109.093 -0.706 . . . . 6.54 109.093 177.575 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 19.6 ptmt -171.11 -39.58 0.02 OUTLIER 'General case' 0 N--CA 1.465 0.283 0 C-N-CA 124.586 1.154 . . . . 10.42 110.887 179.279 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 50.8 t-20 -63.61 142.7 58.3 Favored 'General case' 0 C--O 1.225 -0.185 0 N-CA-C 107.804 -1.184 . . . . 9.65 107.804 174.474 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 6.2 tt0 -85.57 41.97 0.93 Allowed 'General case' 0 CA--C 1.535 0.395 0 CA-C-N 118.979 0.809 . . . . 10.7 109.569 176.631 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -150.36 159.66 44.29 Favored 'General case' 0 N--CA 1.45 -0.45 0 N-CA-C 107.284 -1.376 . . . . 6.7 107.284 -179.283 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 17.5 t0 -75.69 149.22 38.16 Favored 'General case' 0 N--CA 1.453 -0.278 0 N-CA-C 109.256 -0.646 . . . . 5.03 109.256 179.483 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 7.8 mp 61.56 164.05 0.08 Allowed 'General case' 0 CA--C 1.539 0.55 0 C-N-CA 126.531 1.933 . . . . 1.96 111.529 -173.402 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 9.7 p -65.12 -47.73 86.56 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.385 0 O-C-N 119.841 -1.787 . . . . 2.48 109.037 -178.88 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 71.4 p 51.49 -163.37 0.07 Allowed 'General case' 0 C--O 1.236 0.342 0 C-N-CA 128.414 2.685 . . . . 3.97 112.758 177.756 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 35.0 t30 -73.13 79.58 1.25 Allowed 'General case' 0 N--CA 1.452 -0.354 0 O-C-N 121.321 -0.862 . . . . 7.07 110.434 178.232 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 47.9 t -76.07 -62.49 1.58 Allowed 'General case' 0 CA--C 1.535 0.378 0 C-N-CA 124.348 1.059 . . . . 3.19 111.229 179.734 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 12.2 mttt -54.19 125.98 21.18 Favored 'General case' 0 N--CA 1.467 0.383 0 O-C-N 121.219 -0.926 . . . . 6.75 109.25 -179.069 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 80.67 -44.74 0.24 Allowed 'General case' 0 CA--C 1.533 0.326 0 C-N-CA 124.971 1.308 . . . . 7.09 110.136 177.973 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER 77.18 124.68 0.04 OUTLIER 'General case' 0 CA--C 1.529 0.137 0 C-N-CA 126.692 1.997 . . . . 5.64 109.468 171.146 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER 38.55 65.79 0.1 Allowed 'Isoleucine or valine' 0 CA--C 1.539 0.527 0 C-N-CA 126.271 1.828 . . . . 2.66 112.497 173.879 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 2.9 t70 -148.01 -66.08 0.25 Allowed 'General case' 0 C--O 1.225 -0.203 0 C-N-CA 123.934 0.894 . . . . 2.31 109.319 -168.624 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 7.9 mm -44.78 -57.19 0.75 Allowed 'Isoleucine or valine' 0 CA--C 1.539 0.53 0 C-N-CA 125.53 1.532 . . . . 0.67 109.075 169.799 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 18.0 t80 -60.2 -32.44 71.1 Favored 'General case' 0 C--O 1.222 -0.36 0 O-C-N 120.219 -1.551 . . . . 0.44 112.778 176.253 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 49' ' ' LYS . . . . . 0.537 ' HA ' ' HE2' ' A' ' 49' ' ' LYS . 7.0 mmpt? -66.17 -48.57 70.29 Favored 'General case' 0 C--N 1.327 -0.401 0 O-C-N 119.964 -1.71 . . . . 1.06 111.227 -177.259 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 6.2 tp10 -86.96 -62.96 1.39 Allowed 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 108.117 -1.068 . . . . 2.41 108.117 -175.162 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 29.8 mp0 -68.45 -30.3 69.13 Favored 'General case' 0 C--O 1.235 0.338 0 O-C-N 121.701 -0.624 . . . . 2.38 111.041 -173.361 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -70.37 44.67 0.59 Allowed Glycine 0 CA--C 1.529 0.948 0 C-N-CA 125.154 1.359 . . . . 0.4 113.927 169.123 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 52.3 p -150.72 31.77 0.63 Allowed 'General case' 0 N--CA 1.448 -0.563 0 O-C-N 120.879 -1.365 . . . . 1.86 109.942 159.962 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 3.4 t-20 -143.85 -44.28 0.27 Allowed 'General case' 0 N--CA 1.454 -0.269 0 N-CA-C 112.4 0.519 . . . . 1.68 112.4 -166.151 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 55' ' ' LEU . . . . . 0.59 HD21 ' HB2' ' A' ' 89' ' ' ALA . 15.4 mt -59.96 -35.62 75.36 Favored 'General case' 0 N--CA 1.464 0.235 0 O-C-N 122.324 -0.235 . . . . 0.5 111.124 -176.714 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER 178.15 171.61 0.7 Allowed 'General case' 0 CA--C 1.532 0.257 0 C-N-CA 126.148 1.779 . . . . 0.53 106.886 179.961 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 13.2 m -61.24 -35.15 76.47 Favored 'General case' 0 N--CA 1.455 -0.214 0 O-C-N 121.599 -0.688 . . . . 0.94 110.442 168.391 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -69.3 -4.06 16.51 Favored 'General case' 0 CA--C 1.535 0.383 0 N-CA-C 112.315 0.487 . . . . 1.41 112.315 173.182 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -93.73 -6.97 61.86 Favored Glycine 0 N--CA 1.446 -0.681 0 CA-C-O 118.771 -1.016 . . . . 0.42 111.084 173.131 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 54.1 ttt180 -111.15 -17.52 13.2 Favored 'General case' 0 C--O 1.23 0.076 0 CA-C-N 119.14 1.47 . . . . 3.38 111.832 179.555 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 21.7 p -61.56 -163.95 0.01 OUTLIER 'General case' 0 CA--C 1.54 0.57 0 C-N-CA 123.532 0.733 . . . . 0.84 109.73 167.976 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 2.8 m-20 -46.37 144.2 2.2 Favored 'General case' 0 CA--C 1.53 0.189 0 O-C-N 120.682 -1.262 . . . . 1.56 111.455 -176.951 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -55.38 -32.1 62.33 Favored 'General case' 0 CA--C 1.532 0.267 0 CA-C-O 121.811 0.815 . . . . 2.83 110.493 -179.604 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 64' ' ' ALA . . . . . 0.576 ' HB1' ' CE1' ' A' ' 20' ' ' HIS . . . -59.1 -39.68 82.95 Favored 'General case' 0 N--CA 1.448 -0.572 0 C-N-CA 123.74 0.816 . . . . 0.56 112.382 176.538 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 9.3 mt-10 -71.81 -43.02 66.35 Favored 'General case' 0 C--O 1.223 -0.315 0 O-C-N 121.306 -0.871 . . . . 2.21 110.618 175.67 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 53.3 t80 -50.01 -50.36 47.57 Favored 'General case' 0 CA--C 1.531 0.215 0 C-N-CA 123.524 0.73 . . . . 0.46 110.764 175.125 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 72.2 t80 -62.91 -45.05 94.33 Favored 'General case' 0 N--CA 1.451 -0.418 0 C-N-CA 123.738 0.815 . . . . 0.46 110.928 177.298 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -61.31 -48.89 79.29 Favored 'General case' 0 CA--C 1.537 0.455 0 O-C-N 121.078 -1.013 . . . . 0.31 111.464 -176.051 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 6.4 mm-40 -56.02 -44.12 78.41 Favored 'General case' 0 CA--C 1.515 -0.381 0 C-N-CA 124.244 1.018 . . . . 4.01 110.732 170.394 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -54.37 -43.71 71.59 Favored 'General case' 0 N--CA 1.451 -0.408 0 CA-C-O 118.662 -0.685 . . . . 0.37 109.423 -178.423 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 14.9 t80 -58.02 -52.28 66.19 Favored 'General case' 0 N--CA 1.463 0.188 0 C-N-CA 123.756 0.823 . . . . 2.18 111.995 171.849 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 4.0 tmm_? -47.14 -52.57 15.11 Favored 'General case' 0 N--CA 1.465 0.321 0 C-N-CA 123.592 0.757 . . . . 2.52 110.191 179.917 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 73' ' ' LEU . . . . . 0.749 HD12 HG23 ' A' ' 85' ' ' VAL . 0.2 OUTLIER -66.44 -37.96 86.34 Favored 'General case' 0 C--N 1.329 -0.298 0 C-N-CA 126.55 1.94 . . . . 0.49 111.003 178.297 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER -58.7 -37.57 76.38 Favored 'General case' 0 C--O 1.233 0.193 0 C-N-CA 123.385 0.674 . . . . 2.39 111.506 -172.093 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 75' ' ' HIS . . . . . 0.405 ' CE1' HD12 ' A' ' 15' ' ' ILE . 10.0 p80 -95.43 -7.81 37.28 Favored 'General case' 0 CA--C 1.529 0.145 0 CA-C-O 116.395 -1.764 . . . . 0.93 113.503 -179.979 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 7.6 m -38.53 125.01 1.36 Allowed 'General case' 0 C--N 1.342 0.277 0 CA-C-N 120.413 1.461 . . . . 0.99 111.861 -167.006 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 2.7 p -51.94 -43.4 63.45 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 113.491 -1.686 . . . . 0.99 109.045 176.7 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 10.6 t0 -66.84 106.15 1.8 Allowed 'General case' 0 N--CA 1.448 -0.531 0 N-CA-C 108.565 -0.902 . . . . 1.97 108.565 164.132 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 5.0 t-80 -62.36 -25.47 67.93 Favored 'General case' 0 N--CA 1.454 -0.264 0 O-C-N 121.373 -0.829 . . . . 6.05 111.213 179.491 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -64.24 -43.76 93.94 Favored 'General case' 0 N--CA 1.452 -0.33 0 CA-C-N 118.988 0.813 . . . . 0.75 110.529 176.87 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 81' ' ' GLU . . . . . 0.542 ' HA ' ' HE3' ' A' ' 84' ' ' LYS . 7.5 mt-10 -49.77 -39.06 36.66 Favored 'General case' 0 CA--C 1.513 -0.451 0 C-N-CA 124.094 0.958 . . . . 2.6 111.521 176.738 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 8.4 mtp180 -62.61 -47.68 82.71 Favored 'General case' 0 C--N 1.325 -0.482 0 N-CA-C 108.707 -0.849 . . . . 2.52 108.707 177.765 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 83' ' ' LEU . . . . . 0.416 HD13 ' HA ' ' A' ' 83' ' ' LEU . 1.6 mm? -64.81 -21.09 66.71 Favored 'General case' 0 N--CA 1.453 -0.316 0 CA-C-O 117.163 -1.398 . . . . 0.5 113.671 173.887 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 84' ' ' LYS . . . . . 0.542 ' HE3' ' HA ' ' A' ' 81' ' ' GLU . 0.0 OUTLIER -64.61 -43.52 93.48 Favored 'General case' 0 N--CA 1.463 0.202 0 CA-C-N 122.234 2.288 . . . . 2.22 107.594 170.053 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' A' A ' 85' ' ' VAL . . . . . 0.749 HG23 HD12 ' A' ' 73' ' ' LEU . 68.3 t -63.18 -59.23 4.69 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.603 0 CA-C-O 117.267 -1.349 . . . . 0.41 110.792 173.786 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 15.5 mt-30 -53.84 -44.15 70.05 Favored 'General case' 0 N--CA 1.465 0.286 0 CA-C-N 122.14 2.246 . . . . 1.78 112.29 -176.415 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 34.2 tttm -57.33 -48.24 79.48 Favored 'General case' 0 N--CA 1.449 -0.493 0 O-C-N 121.306 -0.871 . . . . 2.13 110.903 178.139 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 6.3 m-20 -90.12 -0.37 57.57 Favored 'General case' 0 C--N 1.328 -0.327 0 C-N-CA 122.584 0.353 . . . . 0.92 111.037 -174.635 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 89' ' ' ALA . . . . . 0.59 ' HB2' HD21 ' A' ' 55' ' ' LEU . . . -168.48 57.62 0.35 Allowed Pre-proline 0 CA--C 1.536 0.418 0 C-N-CA 124.876 1.27 . . . . 0.46 109.764 -163.789 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 34.3 Cg_endo -61.12 -36.33 81.87 Favored 'Trans proline' 0 N--CA 1.455 -0.744 0 C-N-CA 121.87 1.713 . . . . 2.32 109.501 -174.302 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 2.6 ptpt -75.82 -44.85 39.07 Favored 'General case' 0 N--CA 1.449 -0.489 0 C-N-CA 124.498 1.119 . . . . 2.4 112.342 177.706 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 3.6 m -58.64 -45.13 89.95 Favored 'General case' 0 N--CA 1.463 0.178 0 CA-C-N 120.355 1.434 . . . . 0.38 110.675 -176.424 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 17.2 t80 -59.46 -49.53 77.44 Favored 'General case' 0 CA--C 1.508 -0.657 0 CA-C-O 120.99 0.424 . . . . 2.2 110.083 178.267 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 26.1 tt0 -57.79 -28.72 64.26 Favored 'General case' 0 N--CA 1.445 -0.713 0 CA-C-N 115.283 -0.871 . . . . 1.4 110.449 -178.64 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 8.7 t80 -64.37 -57.79 8.33 Favored 'General case' 0 N--CA 1.452 -0.348 0 C-N-CA 123.683 0.793 . . . . 1.36 110.445 -176.579 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 96' ' ' ILE . . . . . 0.419 HD12 ' H ' ' A' ' 96' ' ' ILE . 3.7 mp -58.05 -39.45 72.5 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.187 0 N-CA-C 108.894 -0.78 . . . . 0.87 108.894 174.79 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 14.4 t30 -62.6 -30.83 71.63 Favored 'General case' 0 CA--C 1.536 0.412 0 O-C-N 121.55 -0.719 . . . . 1.48 111.601 -178.869 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 2.1 t0 -67.25 -55.21 14.93 Favored 'General case' 0 C--O 1.23 0.079 0 C-N-CA 125.306 1.442 . . . . 2.23 108.544 174.899 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 29.1 mm-40 -84.58 84.28 7.72 Favored 'General case' 0 N--CA 1.448 -0.547 0 CA-C-O 121.694 0.759 . . . . 3.2 109.932 -178.108 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 8.5 pt -47.38 135.68 3.64 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.388 0 CA-C-N 115.225 -0.898 . . . . 5.93 110.799 175.363 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 22.2 pttt -47.97 -31.56 5.44 Favored 'General case' 0 N--CA 1.464 0.248 0 N-CA-C 114.873 1.434 . . . . 9.8 114.873 -172.587 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 102' ' ' PHE . . . . . . . . . . . . . 71.7 t80 28.92 74.11 0.04 OUTLIER 'General case' 0 CA--C 1.536 0.42 0 C-N-CA 127.048 2.139 . . . . 9.35 113.294 171.707 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 14.5 tt -130.98 44.24 0.59 Allowed 'Isoleucine or valine' 0 CA--C 1.533 0.292 0 CA-C-O 121.494 0.664 . . . . 4.57 109.359 -174.276 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 104' ' ' ILE . . . . . . . . . . . . . 48.9 mm 68.45 154.76 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.536 0.412 0 C-N-CA 125.965 1.706 . . . . 7.68 110.577 -171.325 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 3.4 t-20 72.07 158.34 0.2 Allowed 'General case' 0 CA--C 1.537 0.458 0 C-N-CA 125.992 1.717 . . . . 8.32 110.465 -174.513 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 13.1 p . . . . . 0 C--O 1.252 1.208 0 CA-C-O 114.831 -2.509 . . . . 12.74 107.739 -174.478 . . . . . . . . 0 0 . 1 . 023 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.471 1.014 0 N-CA-C 108.823 -1.711 . . . . 16.47 108.823 . . . . . . . . . 0 0 . 1 . 023 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 7.1 m -107.19 -62.81 1.36 Allowed 'General case' 0 C--O 1.226 -0.176 0 CA-C-N 118.106 0.953 . . . . 17.55 111.267 -169.269 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -151.21 148.25 28.0 Favored 'General case' 0 N--CA 1.454 -0.235 0 N-CA-C 105.579 -2.008 . . . . 20.49 105.579 172.456 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 43.18 75.95 0.13 Allowed Glycine 0 C--N 1.336 0.564 0 C-N-CA 124.806 1.193 . . . . 14.89 114.008 176.142 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 21.5 m -76.01 -173.48 0.15 Allowed 'Isoleucine or valine' 0 N--CA 1.443 -0.776 0 C-N-CA 119.715 -0.794 . . . . 14.59 110.629 171.578 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 31.8 mt-10 -107.33 106.57 17.07 Favored 'General case' 0 N--CA 1.448 -0.561 0 O-C-N 121.843 -0.536 . . . . 11.84 110.925 -167.773 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -84.1 33.36 0.49 Allowed 'General case' 0 CA--C 1.536 0.433 0 C-N-CA 123.198 0.599 . . . . 11.39 110.582 -173.235 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 6.3 mmm180 -143.56 -72.79 0.28 Allowed 'General case' 0 N--CA 1.45 -0.459 0 C-N-CA 127.803 2.441 . . . . 6.29 106.835 -179.693 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 23.5 m-20 -54.93 -34.67 63.41 Favored 'General case' 0 CA--C 1.516 -0.333 0 C-N-CA 123.302 0.641 . . . . 3.8 112.442 178.337 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 20.4 t70 -66.87 -36.11 81.55 Favored 'General case' 0 C--O 1.222 -0.394 0 CA-C-N 119.176 0.898 . . . . 3.54 110.897 178.829 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 9.0 m -70.89 -51.5 25.84 Favored 'General case' 0 CA--C 1.534 0.335 0 O-C-N 121.18 -0.95 . . . . 2.78 111.713 178.162 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 2.4 mt-10 -68.57 -28.13 66.68 Favored 'General case' 0 N--CA 1.464 0.26 0 O-C-N 121.13 -0.981 . . . . 5.79 110.853 -179.62 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -69.25 -45.71 60.24 Favored Glycine 0 CA--C 1.525 0.704 0 N-CA-C 110.585 -1.006 . . . . 1.06 110.585 171.854 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 36.1 t80 -50.75 -51.62 48.48 Favored 'General case' 0 CA--C 1.515 -0.4 0 C-N-CA 125.191 1.396 . . . . 4.14 109.689 -173.521 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER -62.6 -36.22 74.07 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.32 0 O-C-N 122.064 -0.398 . . . . 0.55 111.815 -178.084 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 9.6 t60 -59.94 -55.49 33.43 Favored 'General case' 0 C--N 1.343 0.305 0 N-CA-C 107.168 -1.419 . . . . 0.48 107.168 176.715 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 43.6 mt-10 -58.7 -32.45 69.18 Favored 'General case' 0 N--CA 1.456 -0.173 0 C-N-CA 123.463 0.705 . . . . 1.96 112.251 -179.626 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 24.8 t80 -59.94 -40.75 90.03 Favored 'General case' 0 CA--C 1.517 -0.292 0 CA-C-N 118.797 0.726 . . . . 3.82 109.2 177.213 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -52.04 -46.98 55.5 Favored Glycine 0 CA--C 1.53 0.981 0 C-N-CA 120.622 -0.799 . . . . 0.58 111.452 170.583 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 42.3 m-70 -58.18 -47.11 84.44 Favored 'General case' 0 N--CA 1.464 0.262 0 CA-C-N 119.119 1.46 . . . . 3.65 111.384 176.121 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -59.43 -30.54 68.55 Favored 'General case' 0 N--CA 1.454 -0.267 0 O-C-N 122.105 -0.372 . . . . 0.84 110.943 -178.619 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 77.1 t -72.21 -42.33 66.51 Favored 'Isoleucine or valine' 0 C--O 1.232 0.146 0 O-C-N 121.205 -0.934 . . . . 1.07 110.5 177.581 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 23' ' ' ASP . . . . . 0.459 ' HB3' HD23 ' A' ' 37' ' ' LEU . 0.4 OUTLIER -53.57 -30.99 44.88 Favored 'General case' 0 C--N 1.329 -0.298 0 C-N-CA 123.195 0.598 . . . . 2.21 110.893 172.011 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 8.5 t70 -65.17 -51.22 62.46 Favored 'General case' 0 N--CA 1.455 -0.189 0 N-CA-C 108.522 -0.918 . . . . 2.49 108.522 -174.003 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -52.28 -47.33 65.93 Favored 'General case' 0 CA--C 1.523 -0.092 0 C-N-CA 123.52 0.728 . . . . 2.66 110.404 176.38 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -57.84 -39.38 77.58 Favored 'General case' 0 N--CA 1.45 -0.452 0 CA-C-O 119.312 -0.375 . . . . 1.28 111.223 179.134 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -85.53 -10.3 77.12 Favored Glycine 0 CA--C 1.526 0.764 0 CA-C-N 118.969 0.804 . . . . 1.66 112.952 -178.725 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -80.59 -45.61 17.06 Favored 'General case' 0 N--CA 1.452 -0.354 0 CA-C-N 118.216 1.008 . . . . 3.26 108.346 175.595 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -82.92 -35.21 26.28 Favored 'General case' 0 N--CA 1.449 -0.504 0 C-N-CA 124.925 1.29 . . . . 1.58 112.35 -178.17 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 4.0 mt -119.79 176.57 5.33 Favored 'General case' 0 CA--C 1.535 0.395 0 N-CA-C 107.662 -1.236 . . . . 2.61 107.662 -172.311 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 70.4 m-20 52.45 -132.97 1.88 Allowed 'General case' 0 CA--C 1.534 0.346 0 C-N-CA 124.094 0.957 . . . . 5.2 112.076 177.68 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 32' ' ' LYS . . . . . 0.474 ' HE3' ' CA ' ' A' ' 32' ' ' LYS . 0.0 OUTLIER -113.54 117.31 31.3 Favored 'General case' 0 C--N 1.341 0.235 0 CA-C-N 120.595 1.543 . . . . 7.58 108.127 178.775 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 39.8 t30 -74.52 78.0 1.95 Allowed 'General case' 0 N--CA 1.454 -0.251 0 O-C-N 121.834 -0.542 . . . . 12.68 110.938 177.509 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 20.7 tt0 -162.38 56.25 0.23 Allowed 'General case' 0 CA--C 1.533 0.315 0 N-CA-C 109.63 -0.507 . . . . 10.42 109.63 168.714 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 1.5 t 66.04 63.67 0.56 Allowed 'General case' 0 CA--C 1.533 0.315 0 CA-C-O 121.95 0.881 . . . . 9.46 110.798 -179.662 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 50.6 t0 -121.94 -52.5 1.99 Allowed 'General case' 0 C--O 1.234 0.254 0 C-N-CA 125.181 1.392 . . . . 6.09 108.77 -174.507 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 37' ' ' LEU . . . . . 0.459 HD23 ' HB3' ' A' ' 23' ' ' ASP . 4.8 mp 68.3 166.37 0.25 Allowed 'General case' 0 CA--C 1.536 0.406 0 C-N-CA 126.453 1.901 . . . . 2.0 108.674 179.394 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 10.9 p -84.7 39.89 0.05 OUTLIER 'Isoleucine or valine' 0 N--CA 1.471 0.598 0 O-C-N 120.342 -1.474 . . . . 2.19 110.592 -174.195 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 33.0 p -90.64 -61.75 1.61 Allowed 'General case' 0 N--CA 1.448 -0.57 0 CA-C-O 123.224 1.487 . . . . 3.75 109.215 -162.09 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 10.6 p30 -83.51 -10.26 58.44 Favored 'General case' 0 N--CA 1.449 -0.491 0 C-N-CA 124.863 1.265 . . . . 7.43 111.88 -174.748 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 45.4 m -132.09 80.13 1.9 Allowed 'General case' 0 C--O 1.224 -0.285 0 C-N-CA 123.655 0.782 . . . . 5.85 110.103 -174.641 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 11.3 tmtt? -144.84 -63.4 0.35 Allowed 'General case' 0 CA--C 1.519 -0.215 0 O-C-N 121.328 -0.857 . . . . 5.82 109.692 173.585 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 29.3 tttt -141.0 67.92 1.35 Allowed 'General case' 0 C--O 1.222 -0.371 0 N-CA-C 108.179 -1.045 . . . . 6.11 108.179 175.178 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER 37.5 46.0 0.63 Allowed 'General case' 0 CA--C 1.541 0.614 0 C-N-CA 125.346 1.458 . . . . 5.51 113.202 176.605 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER 34.28 57.22 0.15 Allowed 'Isoleucine or valine' 0 CA--C 1.541 0.614 0 C-N-CA 126.29 1.836 . . . . 2.79 113.27 -172.501 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 9.1 t70 -76.36 -63.27 1.37 Allowed 'General case' 0 CA--C 1.529 0.147 0 C-N-CA 125.611 1.564 . . . . 2.52 110.057 177.547 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 3.6 mm -51.1 -59.65 1.19 Allowed 'Isoleucine or valine' 0 CA--C 1.535 0.396 0 C-N-CA 125.81 1.644 . . . . 0.56 109.321 -174.067 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 24.8 t80 -54.94 -34.67 63.44 Favored 'General case' 0 C--N 1.329 -0.316 0 O-C-N 121.365 -0.835 . . . . 0.51 112.558 177.878 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 49' ' ' LYS . . . . . 0.56 ' HA ' ' HE2' ' A' ' 49' ' ' LYS . 0.1 OUTLIER -65.59 -40.54 92.81 Favored 'General case' 0 N--CA 1.452 -0.356 0 O-C-N 120.365 -1.459 . . . . 1.05 111.581 -176.127 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 4.9 tp10 -89.68 -65.78 0.98 Allowed 'General case' 0 N--CA 1.452 -0.362 0 N-CA-C 108.834 -0.802 . . . . 2.12 108.834 -178.719 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 51' ' ' GLU . . . . . 0.403 ' OE1' ' HE2' ' A' ' 91' ' ' LYS . 9.9 mp0 -68.49 -27.71 66.37 Favored 'General case' 0 C--O 1.234 0.285 0 O-C-N 121.478 -0.764 . . . . 3.09 111.109 -171.795 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 52' ' ' GLY . . . . . 0.415 ' HA2' ' CD1' ' A' ' 66' ' ' PHE . . . -67.99 37.29 0.24 Allowed Glycine 0 CA--C 1.53 1.01 0 C-N-CA 125.254 1.407 . . . . 0.34 114.018 169.81 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 59.6 p -146.62 20.77 1.32 Allowed 'General case' 0 N--CA 1.448 -0.559 0 O-C-N 120.695 -1.473 . . . . 2.07 111.485 159.996 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 46.8 t30 -130.93 -38.34 1.26 Allowed 'General case' 0 C--N 1.342 0.245 0 N-CA-C 112.954 0.724 . . . . 1.83 112.954 -165.227 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 22.9 mt -68.36 -36.23 78.91 Favored 'General case' 0 N--CA 1.463 0.198 0 O-C-N 121.434 -0.791 . . . . 0.57 110.615 -178.36 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 1.4 t 176.93 169.95 0.52 Allowed 'General case' 0 CA--C 1.53 0.189 0 C-N-CA 125.313 1.445 . . . . 0.57 108.043 -175.155 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 8.2 m -61.24 -31.3 71.09 Favored 'General case' 0 N--CA 1.453 -0.285 0 C-N-CA 123.466 0.707 . . . . 1.02 110.909 170.296 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -64.63 -23.13 67.16 Favored 'General case' 0 N--CA 1.464 0.237 0 CA-C-O 121.089 0.471 . . . . 1.01 111.253 173.269 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -74.51 -12.77 82.23 Favored Glycine 0 N--CA 1.443 -0.89 0 CA-C-O 118.722 -1.044 . . . . 0.47 111.313 175.156 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 60.0 ttt-85 -110.02 -16.01 13.92 Favored 'General case' 0 C--O 1.23 0.075 0 CA-C-N 119.177 1.489 . . . . 2.34 112.76 -177.623 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 1.5 p -60.71 -169.21 0.01 OUTLIER 'General case' 0 CA--C 1.536 0.436 0 C-N-CA 122.487 0.315 . . . . 0.91 110.281 166.645 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 5.3 m120 -45.92 147.29 1.02 Allowed 'General case' 0 C--N 1.341 0.211 0 O-C-N 121.346 -0.846 . . . . 2.09 111.065 179.606 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 14.1 tm-20 -61.44 -28.89 69.59 Favored 'General case' 0 CA--C 1.533 0.321 0 CA-C-O 120.649 0.261 . . . . 3.38 111.017 -173.999 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -52.36 -37.15 55.49 Favored 'General case' 0 CA--C 1.52 -0.203 0 N-CA-C 113.414 0.894 . . . . 0.49 113.414 171.854 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 2.3 mm-40 -84.89 -35.96 21.83 Favored 'General case' 0 C--N 1.322 -0.613 0 C-N-CA 124.468 1.107 . . . . 2.59 110.039 -173.84 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 66' ' ' PHE . . . . . 0.415 ' CD1' ' HA2' ' A' ' 52' ' ' GLY . 67.9 t80 -53.02 -50.47 64.2 Favored 'General case' 0 N--CA 1.453 -0.284 0 C-N-CA 124.403 1.081 . . . . 0.32 111.219 166.555 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 77.5 t80 -63.03 -48.14 80.03 Favored 'General case' 0 CA--C 1.535 0.375 0 O-C-N 121.237 -0.915 . . . . 0.38 110.432 178.424 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -61.66 -53.47 55.67 Favored 'General case' 0 CA--C 1.536 0.426 0 N-CA-C 114.106 1.151 . . . . 0.45 114.106 -176.524 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -58.81 -40.23 83.48 Favored 'General case' 0 C--N 1.329 -0.29 0 O-C-N 121.019 -1.051 . . . . 3.69 110.821 174.094 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -55.93 -42.04 75.51 Favored 'General case' 0 C--O 1.222 -0.35 0 CA-C-N 118.52 0.6 . . . . 0.61 110.326 174.258 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -54.56 -51.44 65.23 Favored 'General case' 0 N--CA 1.464 0.229 0 C-N-CA 123.943 0.897 . . . . 3.14 111.375 172.45 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 52.2 ttt-85 -51.96 -50.13 61.83 Favored 'General case' 0 N--CA 1.462 0.148 0 CA-C-N 117.918 0.326 . . . . 2.2 110.206 179.363 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 73' ' ' LEU . . . . . 0.503 ' CB ' HG21 ' A' ' 85' ' ' VAL . 0.1 OUTLIER -68.7 -30.81 69.55 Favored 'General case' 0 C--N 1.328 -0.351 0 C-N-CA 124.389 1.075 . . . . 0.56 110.938 -178.388 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 2.4 ttp -63.73 -34.54 78.1 Favored 'General case' 0 N--CA 1.454 -0.244 0 C-N-CA 123.267 0.627 . . . . 2.63 111.059 -174.614 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 10.0 p80 -99.21 1.46 44.85 Favored 'General case' 0 CA--C 1.531 0.227 0 CA-C-O 116.663 -1.637 . . . . 1.22 113.724 178.679 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 6.7 m -42.31 120.37 1.62 Allowed 'General case' 0 C--N 1.343 0.304 0 CA-C-N 120.573 1.533 . . . . 1.26 110.473 -171.843 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 2.7 p -48.34 -43.88 33.79 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 113.744 -1.571 . . . . 1.31 109.064 178.449 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 11.7 t0 -69.72 105.91 2.9 Favored 'General case' 0 N--CA 1.446 -0.652 0 CA-C-O 122.006 0.908 . . . . 1.99 109.291 163.942 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 49.4 p-80 -49.38 -38.4 28.46 Favored 'General case' 0 N--CA 1.453 -0.285 0 CA-C-N 115.476 -0.784 . . . . 4.34 111.98 173.605 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -61.52 -42.41 98.77 Favored 'General case' 0 C--N 1.331 -0.209 0 O-C-N 121.689 -0.632 . . . . 1.07 110.778 -177.741 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 81' ' ' GLU . . . . . 0.423 ' HA ' ' HD3' ' A' ' 84' ' ' LYS . 18.7 mm-40 -53.77 -36.87 62.86 Favored 'General case' 0 N--CA 1.451 -0.424 0 C-N-CA 123.183 0.593 . . . . 4.41 111.964 175.429 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 14.6 mtp180 -65.06 -46.26 81.93 Favored 'General case' 0 C--N 1.325 -0.471 0 C-N-CA 119.022 -1.071 . . . . 2.32 108.683 176.861 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 1.6 mm? -62.29 -23.17 66.58 Favored 'General case' 0 N--CA 1.455 -0.195 0 CA-C-O 117.724 -1.132 . . . . 0.47 112.909 175.88 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 84' ' ' LYS . . . . . 0.423 ' HD3' ' HA ' ' A' ' 81' ' ' GLU . 2.4 mptm? -60.98 -46.15 91.93 Favored 'General case' 0 CA--C 1.516 -0.329 0 CA-C-N 120.922 1.692 . . . . 1.38 108.18 169.891 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 85' ' ' VAL . . . . . 0.503 HG21 ' CB ' ' A' ' 73' ' ' LEU . 90.3 t -62.12 -61.08 1.79 Allowed 'Isoleucine or valine' 0 N--CA 1.45 -0.463 0 CA-C-O 118.141 -0.933 . . . . 0.43 109.951 176.448 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 2.5 mt-30 -50.03 -49.67 50.16 Favored 'General case' 0 CA--C 1.53 0.183 0 CA-C-N 119.842 1.201 . . . . 1.9 111.88 -173.058 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 13.2 ptpt -65.99 -40.37 91.12 Favored 'General case' 0 N--CA 1.456 -0.157 0 O-C-N 121.896 -0.503 . . . . 4.1 111.055 -176.227 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 52.1 m-20 -79.43 -10.78 59.88 Favored 'General case' 0 N--CA 1.461 0.105 0 N-CA-C 112.051 0.389 . . . . 1.77 112.051 -179.694 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -155.7 71.48 5.38 Favored Pre-proline 0 N--CA 1.446 -0.64 0 C-N-CA 124.409 1.084 . . . . 0.43 109.413 -170.568 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 76.5 Cg_endo -81.13 60.49 7.85 Favored 'Trans proline' 0 N--CA 1.459 -0.552 0 C-N-CA 124.506 3.471 . . . . 1.7 110.822 -173.769 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 91' ' ' LYS . . . . . 0.403 ' HE2' ' OE1' ' A' ' 51' ' ' GLU . 5.4 ptmt 175.03 -51.52 0.01 OUTLIER 'General case' 0 C--O 1.224 -0.287 0 C-N-CA 126.986 2.114 . . . . 2.14 109.716 -170.202 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 2.9 m -57.34 -44.93 84.67 Favored 'General case' 0 CA--C 1.522 -0.116 0 CA-C-N 119.286 0.948 . . . . 0.39 110.245 176.946 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 8.0 t80 -59.25 -47.46 85.27 Favored 'General case' 0 CA--C 1.506 -0.716 0 C-N-CA 120.309 -0.557 . . . . 1.95 110.391 177.709 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 54.4 tt0 -57.34 -33.83 68.16 Favored 'General case' 0 N--CA 1.44 -0.946 0 CA-C-N 115.173 -0.921 . . . . 1.75 110.594 178.085 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 6.2 t80 -62.63 -54.49 38.69 Favored 'General case' 0 C--N 1.333 -0.117 0 N-CA-C 108.645 -0.872 . . . . 1.15 108.645 -175.016 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 3.0 mp -60.34 -42.05 89.39 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.37 0 N-CA-C 108.475 -0.935 . . . . 0.83 108.475 176.677 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 3.2 t30 -62.32 -25.99 68.18 Favored 'General case' 0 CA--C 1.535 0.377 0 CA-C-N 118.413 0.551 . . . . 1.46 111.857 -177.305 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 7.8 t70 -74.79 -43.15 56.31 Favored 'General case' 0 C--O 1.228 -0.07 0 C-N-CA 124.627 1.171 . . . . 2.17 109.202 176.609 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 45.0 mm-40 -68.71 -54.61 15.1 Favored 'General case' 0 N--CA 1.451 -0.421 0 CA-C-N 115.591 -0.731 . . . . 3.02 111.007 -175.95 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 9.0 tp -71.3 113.37 7.65 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.44 0 N-CA-C 108.581 -0.896 . . . . 6.05 108.581 -174.316 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 23.5 tttt -146.6 -55.39 0.26 Allowed 'General case' 0 N--CA 1.453 -0.289 0 N-CA-C 108.626 -0.879 . . . . 9.43 108.626 -179.721 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 102' ' ' PHE . . . . . . . . . . . . . 7.9 p90 -145.99 121.81 10.59 Favored 'General case' 0 N--CA 1.45 -0.45 0 N-CA-C 106.604 -1.628 . . . . 8.33 106.604 174.699 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -152.84 129.15 1.83 Allowed 'Isoleucine or valine' 0 N--CA 1.448 -0.536 0 N-CA-C 105.356 -2.09 . . . . 3.72 105.356 174.345 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 104' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER 29.63 78.19 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.539 0.528 0 C-N-CA 127.487 2.315 . . . . 5.42 112.711 -178.646 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 3.2 m120 -53.68 128.32 29.02 Favored 'General case' 0 C--O 1.232 0.135 0 CA-C-N 116.065 -0.516 . . . . 9.54 109.887 176.779 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 27.4 t . . . . . 0 C--O 1.252 1.212 0 C-N-CA 125.312 1.445 . . . . 9.56 107.225 177.532 . . . . . . . . 0 0 . 1 . 024 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.472 1.063 0 N-CA-C 110.232 -1.147 . . . . 13.15 110.232 . . . . . . . . . 0 0 . 1 . 024 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 4.2 m -159.13 -30.88 0.07 Allowed 'General case' 0 N--CA 1.468 0.445 0 CA-C-N 118.274 1.037 . . . . 14.54 112.729 178.203 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -145.84 163.12 36.04 Favored 'General case' 0 N--CA 1.45 -0.429 0 N-CA-C 106.879 -1.526 . . . . 17.1 106.879 176.388 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 150.23 179.62 26.18 Favored Glycine 0 N--CA 1.45 -0.374 0 N-CA-C 108.605 -1.798 . . . . 14.61 108.605 -178.936 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 5' ' ' VAL . . . . . 0.415 HG23 ' CD1' ' A' ' 7' ' ' LEU . 0.0 OUTLIER -72.45 -176.68 0.21 Allowed 'Isoleucine or valine' 0 N--CA 1.449 -0.505 0 CA-C-O 121.584 0.707 . . . . 15.6 111.097 173.067 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 9.9 pt-20 -89.91 111.01 21.93 Favored 'General case' 0 N--CA 1.442 -0.83 0 CA-C-O 122.999 1.381 . . . . 11.82 110.878 179.389 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 7' ' ' LEU . . . . . 0.448 HD22 ' H ' ' A' ' 7' ' ' LEU . 0.0 OUTLIER -151.04 47.58 0.84 Allowed 'General case' 0 N--CA 1.447 -0.59 0 C-N-CA 126.414 1.886 . . . . 9.81 107.306 178.205 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 9.6 mtp85 59.36 37.62 23.28 Favored 'General case' 0 CA--C 1.532 0.276 0 C-N-CA 123.59 0.756 . . . . 6.68 111.814 -176.381 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -49.65 -37.17 27.25 Favored 'General case' 0 N--CA 1.468 0.475 0 C-N-CA 124.628 1.171 . . . . 4.12 111.568 175.99 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 4.2 t70 -59.71 -53.04 62.64 Favored 'General case' 0 N--CA 1.446 -0.648 0 C-N-CA 123.466 0.706 . . . . 2.46 111.163 175.79 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 5.1 t -66.79 -52.15 47.4 Favored 'General case' 0 N--CA 1.452 -0.364 0 CA-C-O 121.365 0.602 . . . . 1.89 109.911 -173.226 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 9.7 pt-20 -70.39 -30.98 68.02 Favored 'General case' 0 C--O 1.227 -0.09 0 O-C-N 121.817 -0.552 . . . . 4.42 109.593 -178.835 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -60.73 -42.21 99.32 Favored Glycine 0 N--CA 1.448 -0.537 0 N-CA-C 110.385 -1.086 . . . . 1.13 110.385 174.443 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -58.23 -57.47 12.74 Favored 'General case' 0 N--CA 1.455 -0.193 0 CA-C-O 122.071 0.939 . . . . 2.81 109.17 -176.532 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER -71.4 -29.3 34.86 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.453 0 CA-C-N 115.867 -0.606 . . . . 0.86 111.641 -176.249 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 3.9 t60 -59.96 -53.37 58.69 Favored 'General case' 0 N--CA 1.453 -0.303 0 N-CA-C 106.749 -1.575 . . . . 0.92 106.749 176.759 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 13.0 mm-40 -63.37 -30.72 71.8 Favored 'General case' 0 N--CA 1.449 -0.501 0 CA-C-O 117.943 -1.027 . . . . 4.6 111.672 -177.13 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 1.0 OUTLIER -53.37 -54.55 35.01 Favored 'General case' 0 N--CA 1.464 0.24 0 CA-C-N 119.975 1.261 . . . . 2.46 111.085 168.042 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -48.81 -47.19 31.3 Favored Glycine 0 CA--C 1.524 0.594 0 N-CA-C 109.808 -1.317 . . . . 0.96 109.808 174.997 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 1.8 t-160 -63.28 -41.65 99.03 Favored 'General case' 0 N--CA 1.447 -0.577 0 N-CA-C 113.295 0.85 . . . . 1.75 113.295 -176.565 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -65.93 -30.98 71.65 Favored 'General case' 0 N--CA 1.449 -0.506 0 C-N-CA 123.734 0.814 . . . . 1.22 109.238 -178.759 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 93.5 t -68.52 -37.1 77.25 Favored 'Isoleucine or valine' 0 C--O 1.233 0.222 0 C-N-CA 118.57 -1.252 . . . . 1.32 110.27 173.589 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 1.7 t70 -61.99 -24.92 67.32 Favored 'General case' 0 C--N 1.331 -0.217 0 N-CA-C 111.968 0.359 . . . . 2.05 111.968 173.291 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 24.8 t70 -67.98 -51.79 43.26 Favored 'General case' 0 C--O 1.221 -0.413 0 N-CA-C 108.6 -0.889 . . . . 2.19 108.6 -176.396 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 25' ' ' TYR . . . . . 0.403 ' CE1' HD21 ' A' ' 29' ' ' LEU . 35.6 t80 -50.43 -55.01 17.7 Favored 'General case' 0 CA--C 1.522 -0.129 0 C-N-CA 123.485 0.714 . . . . 4.28 110.332 172.892 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -54.72 -40.84 69.64 Favored 'General case' 0 N--CA 1.451 -0.388 0 C-N-CA 119.963 -0.695 . . . . 1.79 111.353 -177.916 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -65.92 -54.11 26.73 Favored Glycine 0 C--N 1.336 0.547 0 CA-C-N 119.318 0.963 . . . . 1.6 111.593 178.416 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 28' ' ' TYR . . . . . 0.437 ' HB3' HD22 ' A' ' 29' ' ' LEU . 0.2 OUTLIER -44.71 -42.35 7.55 Favored 'General case' 0 N--CA 1.456 -0.171 0 C-N-CA 126.223 1.809 . . . . 3.64 111.13 -179.29 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A ' 29' ' ' LEU . . . . . 0.437 HD22 ' HB3' ' A' ' 28' ' ' TYR . 3.3 mm? -90.94 -25.43 19.77 Favored 'General case' 0 N--CA 1.446 -0.631 0 CA-C-O 118.637 -0.697 . . . . 3.07 112.482 -177.82 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 14.5 mt -130.49 72.2 1.49 Allowed 'General case' 0 CA--C 1.534 0.334 0 CA-C-N 118.953 0.797 . . . . 3.8 110.187 -168.899 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 5.5 t0 -136.32 156.42 48.67 Favored 'General case' 0 N--CA 1.462 0.153 0 N-CA-C 108.129 -1.063 . . . . 6.37 108.129 171.003 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -137.08 23.75 3.03 Favored 'General case' 0 CA--C 1.536 0.422 0 C-N-CA 124.545 1.138 . . . . 10.17 109.264 -178.769 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 8.9 t-20 -139.75 -178.9 5.63 Favored 'General case' 0 CA--C 1.536 0.423 0 C-N-CA 125.09 1.356 . . . . 7.5 108.62 -175.933 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -82.44 -6.88 59.57 Favored 'General case' 0 CA--C 1.535 0.402 0 CA-C-N 118.817 0.735 . . . . 10.16 111.098 173.095 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 3.5 t -66.92 -174.72 0.35 Allowed 'General case' 0 CA--C 1.535 0.385 0 CA-C-N 118.338 0.517 . . . . 6.12 110.702 173.389 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 9.2 t0 -150.12 165.41 32.89 Favored 'General case' 0 CA--C 1.534 0.334 0 N-CA-C 107.932 -1.136 . . . . 6.88 107.932 175.381 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 1.1 mt 70.24 141.19 0.05 OUTLIER 'General case' 0 N--CA 1.465 0.293 0 C-N-CA 127.755 2.422 . . . . 3.02 110.47 -172.076 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 7.5 p -71.27 7.65 0.42 Allowed 'Isoleucine or valine' 0 CA--C 1.544 0.72 0 O-C-N 120.698 -1.251 . . . . 3.36 112.576 -176.404 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 14.2 t -53.72 -19.73 4.55 Favored 'General case' 0 CA--C 1.533 0.321 0 C-N-CA 125.44 1.496 . . . . 4.77 113.038 176.662 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 49.8 p30 -91.97 17.81 8.78 Favored 'General case' 0 CA--C 1.533 0.32 0 C-N-CA 123.785 0.834 . . . . 9.03 112.079 -179.268 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 4.8 t -158.6 -63.31 0.08 Allowed 'General case' 0 N--CA 1.456 -0.148 0 O-C-N 121.666 -0.646 . . . . 4.21 109.663 -175.496 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 42' ' ' LYS . . . . . 0.434 ' HE3' ' HA ' ' A' ' 42' ' ' LYS . 0.1 OUTLIER 42.72 43.98 3.57 Favored 'General case' 0 N--CA 1.454 -0.229 0 C-N-CA 126.205 1.802 . . . . 11.25 111.749 -172.257 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 73.31 -65.84 0.34 Allowed 'General case' 0 N--CA 1.468 0.461 0 C-N-CA 124.299 1.04 . . . . 11.51 109.566 178.133 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 16.5 m-85 -140.28 131.3 26.24 Favored 'General case' 0 N--CA 1.453 -0.304 0 CA-C-N 119.158 0.89 . . . . 8.12 109.123 169.602 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 0.6 OUTLIER -81.78 69.39 0.56 Allowed 'Isoleucine or valine' 0 CA--C 1.542 0.65 0 CA-C-O 121.751 0.786 . . . . 2.79 108.912 176.548 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 5.0 t70 -127.67 -54.75 1.33 Allowed 'General case' 0 N--CA 1.47 0.553 0 C-N-CA 126.154 1.782 . . . . 2.54 108.557 -179.397 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 47' ' ' ILE . . . . . 0.507 HD13 ' HE2' ' A' ' 91' ' ' LYS . 5.1 mm -49.17 -56.15 3.03 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.478 0 C-N-CA 125.976 1.71 . . . . 0.72 108.229 176.903 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 26.4 t80 -63.38 -30.35 71.5 Favored 'General case' 0 C--N 1.328 -0.351 0 O-C-N 120.51 -1.369 . . . . 0.95 113.052 175.803 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 49' ' ' LYS . . . . . 0.498 ' HA ' ' HE2' ' A' ' 49' ' ' LYS . 0.4 OUTLIER -63.67 -50.72 68.13 Favored 'General case' 0 C--N 1.33 -0.252 0 O-C-N 120.138 -1.601 . . . . 1.72 110.76 -178.898 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 17.3 tt0 -90.63 -53.41 4.43 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.957 0.408 . . . . 3.78 110.024 -171.823 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 10.0 mp0 -74.07 -29.66 61.99 Favored 'General case' 0 C--O 1.235 0.303 0 O-C-N 121.249 -0.907 . . . . 2.78 110.6 -176.978 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 52' ' ' GLY . . . . . 0.445 ' HA2' ' CD1' ' A' ' 66' ' ' PHE . . . -71.16 33.69 0.53 Allowed Glycine 0 CA--C 1.528 0.878 0 C-N-CA 124.613 1.101 . . . . 0.62 114.306 173.462 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 44.7 t -149.15 43.19 0.95 Allowed 'General case' 0 N--CA 1.447 -0.595 0 N-CA-C 107.678 -1.231 . . . . 1.69 107.678 158.592 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -145.4 -44.41 0.22 Allowed 'General case' 0 CA--C 1.518 -0.286 0 N-CA-C 113.226 0.824 . . . . 2.14 113.226 -176.436 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 19.3 mt -55.72 -40.63 72.7 Favored 'General case' 0 N--CA 1.462 0.16 0 CA-C-O 121.118 0.485 . . . . 0.46 111.445 -174.879 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 56' ' ' THR . . . . . 0.4 HG23 ' H ' ' A' ' 59' ' ' GLY . 0.0 OUTLIER -179.79 162.1 1.03 Allowed 'General case' 0 C--N 1.329 -0.309 0 N-CA-C 106.855 -1.535 . . . . 0.45 106.855 -178.254 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 74.3 m -59.11 -33.47 70.88 Favored 'General case' 0 N--CA 1.456 -0.151 0 O-C-N 122.155 -0.341 . . . . 1.31 110.235 171.779 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 58' ' ' TYR . . . . . 0.406 ' O ' HG22 ' A' ' 61' ' ' THR . 0.1 OUTLIER -61.71 -39.51 91.74 Favored 'General case' 0 C--O 1.226 -0.161 0 O-C-N 121.786 -0.571 . . . . 1.17 110.255 177.149 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A ' 59' ' ' GLY . . . . . 0.4 ' H ' HG23 ' A' ' 56' ' ' THR . . . -74.44 -2.02 62.44 Favored Glycine 0 CA--C 1.526 0.737 0 C-N-CA 123.613 0.625 . . . . 0.88 112.313 -179.956 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 59.9 ttt180 -97.33 -7.13 32.71 Favored 'General case' 0 N--CA 1.452 -0.361 0 CA-C-N 117.965 0.883 . . . . 4.14 111.561 174.46 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 61' ' ' THR . . . . . 0.457 HG23 ' N ' ' A' ' 62' ' ' ASN . 1.6 t -63.53 -167.24 0.02 OUTLIER 'General case' 0 CA--C 1.53 0.18 0 CA-C-O 121.574 0.702 . . . . 3.43 110.233 166.908 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 62' ' ' ASN . . . . . 0.457 ' N ' HG23 ' A' ' 61' ' ' THR . 2.3 m120 -46.71 150.56 0.69 Allowed 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 121.279 0.561 . . . . 2.59 111.166 170.344 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 12.6 tm-20 -53.87 -24.38 15.7 Favored 'General case' 0 CA--C 1.537 0.451 0 C-N-CA 124.098 0.959 . . . . 4.28 111.667 -177.877 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -47.11 -57.46 5.06 Favored 'General case' 0 N--CA 1.45 -0.465 0 C-N-CA 125.215 1.406 . . . . 0.84 113.738 169.763 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 3.3 mt-10 -85.55 -19.49 31.04 Favored 'General case' 0 CA--C 1.514 -0.434 0 C-N-CA 118.01 -1.476 . . . . 3.17 110.798 -175.824 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 66' ' ' PHE . . . . . 0.445 ' CD1' ' HA2' ' A' ' 52' ' ' GLY . 68.3 t80 -55.35 -51.56 66.39 Favored 'General case' 0 N--CA 1.449 -0.497 0 CA-C-N 118.277 0.49 . . . . 0.51 110.117 166.883 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 87.7 t80 -69.24 -47.17 65.49 Favored 'General case' 0 N--CA 1.445 -0.692 0 C-N-CA 123.58 0.752 . . . . 0.52 110.188 -176.981 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -65.18 -45.93 82.85 Favored 'General case' 0 CA--C 1.538 0.493 0 O-C-N 121.757 -0.589 . . . . 0.53 111.575 -175.747 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 9.4 mm-40 -61.37 -42.21 98.34 Favored 'General case' 0 N--CA 1.462 0.151 0 O-C-N 121.175 -0.953 . . . . 4.76 110.541 171.442 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -57.36 -41.16 79.59 Favored 'General case' 0 C--O 1.224 -0.285 0 O-C-N 121.25 -0.906 . . . . 0.45 110.23 -179.715 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 51.1 t80 -59.66 -50.13 75.06 Favored 'General case' 0 C--O 1.231 0.083 0 CA-C-N 118.777 0.717 . . . . 3.55 111.0 174.769 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 34.4 ttt180 -47.63 -58.23 4.52 Favored 'General case' 0 N--CA 1.465 0.292 0 O-C-N 121.755 -0.59 . . . . 2.26 109.902 176.281 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 73' ' ' LEU . . . . . 0.606 ' CB ' HG21 ' A' ' 85' ' ' VAL . 0.1 OUTLIER -64.23 -27.45 69.06 Favored 'General case' 0 C--N 1.329 -0.325 0 C-N-CA 125.376 1.471 . . . . 0.62 110.923 -177.101 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 1.7 ttp -58.99 -42.97 91.31 Favored 'General case' 0 N--CA 1.452 -0.365 0 C-N-CA 123.12 0.568 . . . . 2.53 110.772 -178.358 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 17.0 p80 -93.55 -37.56 11.84 Favored 'General case' 0 C--O 1.225 -0.23 0 CA-C-O 115.576 -2.154 . . . . 1.64 112.34 179.792 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 2.6 m 4.19 112.22 0.0 OUTLIER 'General case' 0 N--CA 1.471 0.579 0 C-N-CA 128.285 2.634 . . . . 1.15 115.099 -176.238 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 2.0 p -43.65 -44.32 6.3 Favored 'General case' 0 N--CA 1.452 -0.354 0 C-N-CA 125.628 1.571 . . . . 1.44 111.571 177.576 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 56.9 t0 -73.98 105.36 5.19 Favored 'General case' 0 N--CA 1.454 -0.264 0 C-N-CA 117.495 -1.682 . . . . 2.33 108.827 166.639 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 4.1 p-80 -39.91 -39.12 0.78 Allowed 'General case' 0 CA--C 1.531 0.231 0 C-N-CA 124.355 1.062 . . . . 5.28 112.665 170.616 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -60.86 -44.61 96.8 Favored 'General case' 0 N--CA 1.449 -0.497 0 CA-C-O 118.983 -0.532 . . . . 1.08 110.752 -177.582 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -52.44 -38.83 60.12 Favored 'General case' 0 CA--C 1.518 -0.251 0 CA-C-O 121.222 0.534 . . . . 3.89 110.522 177.83 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -64.82 -48.52 74.07 Favored 'General case' 0 N--CA 1.451 -0.381 0 N-CA-C 108.595 -0.891 . . . . 3.3 108.595 179.799 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 1.6 mm? -62.69 -25.72 68.3 Favored 'General case' 0 N--CA 1.454 -0.233 0 CA-C-O 118.132 -0.937 . . . . 1.24 112.724 175.99 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 14.8 mttt -65.18 -44.09 89.58 Favored 'General case' 0 CA--C 1.518 -0.261 0 CA-C-N 120.528 1.513 . . . . 1.45 108.084 174.256 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 85' ' ' VAL . . . . . 0.606 HG21 ' CB ' ' A' ' 73' ' ' LEU . 96.6 t -63.19 -60.18 3.18 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.544 0 CA-C-O 117.295 -1.336 . . . . 0.51 111.191 173.605 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 24.1 mt-30 -49.91 -51.11 43.32 Favored 'General case' 0 N--CA 1.463 0.189 0 CA-C-N 121.425 1.921 . . . . 2.34 111.827 -177.277 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.92 -37.65 88.36 Favored 'General case' 0 CA--C 1.531 0.234 0 O-C-N 121.545 -0.722 . . . . 2.42 110.933 -175.656 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 83.0 m-20 -85.45 -5.78 59.26 Favored 'General case' 0 CA--C 1.531 0.237 0 CA-C-N 118.091 0.405 . . . . 1.13 111.134 179.869 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -159.93 74.34 3.07 Favored Pre-proline 0 N--CA 1.446 -0.629 0 C-N-CA 125.016 1.326 . . . . 0.35 109.482 -173.903 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 85.3 Cg_endo -82.05 50.78 3.57 Favored 'Trans proline' 0 CA--C 1.536 0.582 0 C-N-CA 124.294 3.329 . . . . 1.65 110.96 -175.479 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 91' ' ' LYS . . . . . 0.507 ' HE2' HD13 ' A' ' 47' ' ' ILE . 0.1 OUTLIER -169.1 -57.57 0.02 OUTLIER 'General case' 0 N--CA 1.451 -0.393 0 C-N-CA 126.777 2.031 . . . . 2.31 108.28 -174.189 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 3.9 m -50.15 -45.5 53.27 Favored 'General case' 0 N--CA 1.464 0.226 0 C-N-CA 123.835 0.854 . . . . 0.48 112.276 178.02 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 16.6 t80 -57.31 -50.75 71.94 Favored 'General case' 0 CA--C 1.512 -0.507 0 CA-C-O 121.843 0.83 . . . . 2.57 110.712 179.03 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 23.2 tt0 -60.19 -28.33 67.88 Favored 'General case' 0 N--CA 1.441 -0.908 0 CA-C-N 114.221 -1.354 . . . . 2.83 110.007 -179.083 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 4.5 t80 -65.73 -55.75 15.69 Favored 'General case' 0 N--CA 1.452 -0.354 0 C-N-CA 124.364 1.065 . . . . 1.17 110.205 -177.754 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 2.8 mp -56.67 -45.1 82.54 Favored 'Isoleucine or valine' 0 C--O 1.228 -0.068 0 N-CA-C 107.961 -1.125 . . . . 0.83 107.961 176.34 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 5.3 t30 -58.24 -33.08 68.97 Favored 'General case' 0 CA--C 1.538 0.516 0 N-CA-C 111.962 0.356 . . . . 1.62 111.962 -178.891 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 28.8 t70 -71.31 -44.07 65.86 Favored 'General case' 0 CA--C 1.517 -0.306 0 C-N-CA 125.203 1.401 . . . . 1.97 110.777 178.459 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 11.7 mm100 -83.42 54.05 2.7 Favored 'General case' 0 CA--C 1.537 0.45 0 CA-C-O 121.486 0.66 . . . . 3.48 110.306 -172.806 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -70.85 116.78 12.95 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.43 0 O-C-N 121.389 -0.819 . . . . 4.03 108.814 -176.193 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 20.8 tttp -150.92 140.23 21.34 Favored 'General case' 0 N--CA 1.454 -0.228 0 N-CA-C 106.562 -1.644 . . . . 10.93 106.562 174.229 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 102' ' ' PHE . . . . . . . . . . . . . 31.2 p90 -96.46 139.97 31.8 Favored 'General case' 0 N--CA 1.452 -0.359 0 N-CA-C 107.248 -1.39 . . . . 7.13 107.248 164.309 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -132.27 119.33 39.4 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.362 0 N-CA-C 104.597 -2.372 . . . . 4.37 104.597 176.677 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 104' ' ' ILE . . . . . . . . . . . . . 24.0 mm 39.7 90.39 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.537 0.448 0 C-N-CA 126.52 1.928 . . . . 6.95 112.123 -173.366 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 7.5 m-20 -51.54 145.78 8.39 Favored 'General case' 0 CA--C 1.528 0.128 0 C-N-CA 123.361 0.664 . . . . 6.78 110.68 178.966 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 24.9 t . . . . . 0 C--O 1.253 1.256 0 C-N-CA 125.394 1.477 . . . . 9.57 107.261 179.728 . . . . . . . . 0 0 . 1 . 025 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.225 -0.451 0 N-CA-C 106.381 -2.687 . . . . 14.48 106.381 . . . . . . . . . 0 0 . 1 . 025 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 49.6 m -122.3 82.88 2.03 Favored 'General case' 0 N--CA 1.456 -0.172 0 CA-C-N 118.766 1.283 . . . . 16.65 108.121 172.164 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 5.2 mmpt? -144.99 145.0 31.33 Favored 'General case' 0 N--CA 1.452 -0.341 0 N-CA-C 106.81 -1.552 . . . . 20.86 106.81 179.239 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 145.18 175.14 18.06 Favored Glycine 0 CA--C 1.522 0.516 0 N-CA-C 108.281 -1.928 . . . . 15.85 108.281 -178.948 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 34.0 m -93.86 -162.07 0.1 OUTLIER 'Isoleucine or valine' 0 N--CA 1.444 -0.726 0 N-CA-C 106.965 -1.494 . . . . 16.76 106.965 156.473 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -81.1 113.45 19.29 Favored 'General case' 0 N--CA 1.447 -0.613 0 CA-C-O 122.156 0.979 . . . . 11.44 111.576 174.978 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 7' ' ' LEU . . . . . 0.464 HD22 ' H ' ' A' ' 7' ' ' LEU . 0.0 OUTLIER -145.12 52.0 1.21 Allowed 'General case' 0 N--CA 1.449 -0.492 0 C-N-CA 125.823 1.649 . . . . 10.28 108.354 174.897 . . . . . . . . 3 3 . 1 . 025 nuclear build full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 29.4 mtp180 62.15 48.35 5.04 Favored 'General case' 0 N--CA 1.461 0.09 0 C-N-CA 124.227 1.011 . . . . 7.19 111.827 -177.825 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 1.2 m120 -49.58 -33.98 16.53 Favored 'General case' 0 C--O 1.219 -0.552 0 N-CA-C 113.139 0.792 . . . . 3.52 113.139 178.401 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -56.23 -56.73 17.4 Favored 'General case' 0 N--CA 1.449 -0.518 0 C-N-CA 122.966 0.506 . . . . 2.78 111.524 176.322 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 26.6 m -79.73 -46.11 17.67 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 121.55 0.691 . . . . 1.64 110.196 -170.858 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 38.0 tt0 -68.86 -33.97 74.67 Favored 'General case' 0 CA--C 1.533 0.312 0 N-CA-C 108.381 -0.97 . . . . 3.71 108.381 -179.209 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -62.8 -55.71 25.3 Favored Glycine 0 C--O 1.222 -0.656 0 N-CA-C 108.8 -1.72 . . . . 0.85 108.8 174.411 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 3.2 t80 -46.43 -54.95 8.17 Favored 'General case' 0 C--O 1.227 -0.12 0 CA-C-N 118.549 1.175 . . . . 3.08 111.24 -175.11 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 0.5 OUTLIER -66.17 -34.37 69.74 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.501 0 O-C-N 121.567 -0.708 . . . . 0.62 112.159 -177.907 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 24.4 t-80 -63.38 -53.0 59.33 Favored 'General case' 0 N--CA 1.453 -0.295 0 N-CA-C 107.832 -1.173 . . . . 0.97 107.832 179.916 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 17.2 mt-10 -58.63 -38.66 78.54 Favored 'General case' 0 N--CA 1.449 -0.477 0 C-N-CA 127.398 2.279 . . . . 2.92 110.004 179.683 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -51.56 -47.05 63.6 Favored 'General case' 0 CA--C 1.519 -0.225 0 C-N-CA 123.709 0.804 . . . . 2.33 109.689 170.829 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -48.77 -49.26 28.57 Favored Glycine 0 CA--C 1.527 0.841 0 CA-C-O 119.728 -0.484 . . . . 0.58 111.912 171.851 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 60.4 m-70 -60.62 -45.4 94.17 Favored 'General case' 0 C--O 1.223 -0.299 0 CA-C-N 119.338 1.569 . . . . 3.55 111.422 176.115 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -62.19 -24.42 67.19 Favored 'General case' 0 CA--C 1.534 0.339 0 O-C-N 121.019 -1.051 . . . . 1.08 111.159 -179.474 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 78.3 t -78.26 -35.7 20.02 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.183 0 O-C-N 121.197 -0.94 . . . . 1.44 110.938 173.44 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 15.1 t0 -54.86 -33.13 61.46 Favored 'General case' 0 C--N 1.333 -0.109 0 C-N-CA 124.37 1.068 . . . . 2.7 109.716 171.278 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 11.9 t70 -61.21 -54.5 43.52 Favored 'General case' 0 CA--C 1.519 -0.214 0 N-CA-C 108.935 -0.765 . . . . 3.2 108.935 -177.384 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 31.4 t80 -56.39 -49.58 74.04 Favored 'General case' 0 N--CA 1.454 -0.228 0 C-N-CA 122.535 0.334 . . . . 5.03 110.101 -179.105 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -56.83 -38.32 72.48 Favored 'General case' 0 N--CA 1.451 -0.416 0 C-N-CA 120.566 -0.453 . . . . 1.85 110.99 -179.828 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -80.6 -22.25 62.49 Favored Glycine 0 CA--C 1.525 0.71 0 C-N-CA 124.163 0.887 . . . . 1.31 113.032 -177.758 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 1.1 t80 -76.57 -46.0 28.06 Favored 'General case' 0 N--CA 1.448 -0.571 0 O-C-N 121.029 -1.277 . . . . 2.92 108.348 179.586 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -72.97 -39.41 66.16 Favored 'General case' 0 N--CA 1.445 -0.678 0 C-N-CA 124.264 1.026 . . . . 3.26 111.527 179.768 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 7.9 mt -117.64 123.32 45.84 Favored 'General case' 0 N--CA 1.453 -0.325 0 N-CA-C 107.254 -1.387 . . . . 3.21 107.254 -170.486 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER 58.91 56.58 3.98 Favored 'General case' 0 CA--C 1.54 0.578 0 C-N-CA 124.249 1.02 . . . . 5.26 110.578 -175.689 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 2.6 tmtt? -48.89 102.24 0.03 OUTLIER 'General case' 0 N--CA 1.468 0.465 0 C-N-CA 124.426 1.09 . . . . 11.36 111.481 -169.477 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 33.1 t-20 -150.79 159.1 44.76 Favored 'General case' 0 N--CA 1.453 -0.292 0 N-CA-C 106.792 -1.559 . . . . 6.96 106.792 -179.493 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 34.0 tt0 -89.49 -35.1 16.16 Favored 'General case' 0 CA--C 1.531 0.241 0 CA-C-N 118.794 0.725 . . . . 12.98 109.889 171.086 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 15.2 t -107.22 22.13 16.45 Favored 'General case' 0 CA--C 1.53 0.202 0 C-N-CA 123.111 0.564 . . . . 7.43 111.089 -170.529 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 5.0 t0 -151.69 132.78 14.35 Favored 'General case' 0 C--N 1.331 -0.232 0 N-CA-C 104.294 -2.484 . . . . 7.18 104.294 173.074 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 1.2 mm? -116.62 -148.28 0.42 Allowed 'General case' 0 CA--C 1.531 0.226 0 CA-C-N 119.598 1.09 . . . . 2.67 108.393 -177.509 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 4.5 p -70.74 -19.68 21.7 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.398 0 O-C-N 121.142 -0.974 . . . . 2.79 111.161 176.502 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 4.5 t -46.65 148.2 1.06 Allowed 'General case' 0 N--CA 1.455 -0.218 0 C-N-CA 123.696 0.799 . . . . 3.61 109.796 167.301 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 40' ' ' ASN . . . . . 0.573 ' HA ' HG23 ' A' ' 45' ' ' ILE . 28.7 t30 52.59 46.28 27.01 Favored 'General case' 0 CA--C 1.529 0.172 0 O-C-N 121.708 -0.62 . . . . 6.82 112.044 173.34 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 11.4 t -52.99 96.13 0.01 OUTLIER 'General case' 0 C--O 1.224 -0.241 0 CA-C-O 118.516 -0.754 . . . . 4.35 111.303 -177.214 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 6.0 mmpt? 30.26 69.68 0.09 Allowed 'General case' 0 N--CA 1.466 0.327 0 C-N-CA 124.955 1.302 . . . . 15.9 112.362 -166.709 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 31.3 mmtt 57.43 33.95 23.99 Favored 'General case' 0 N--CA 1.465 0.312 0 C-N-CA 122.769 0.428 . . . . 16.23 112.088 177.536 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 3.6 m-30 -73.63 -75.23 0.15 Allowed 'General case' 0 C--O 1.222 -0.385 0 N-CA-C 108.405 -0.961 . . . . 6.89 108.405 162.444 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 45' ' ' ILE . . . . . 0.573 HG23 ' HA ' ' A' ' 40' ' ' ASN . 0.2 OUTLIER 36.08 80.96 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.544 0.745 0 O-C-N 123.768 0.667 . . . . 2.86 111.876 -164.107 . . . . . . . . 3 3 . 1 . 025 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 21.5 t70 -123.26 -60.11 1.52 Allowed 'General case' 0 N--CA 1.47 0.56 0 O-C-N 120.688 -1.257 . . . . 2.25 110.823 -174.191 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 5.2 mm -46.92 -52.13 4.37 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.622 0 C-N-CA 125.244 1.418 . . . . 0.96 108.839 174.175 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 33.9 t80 -63.97 -28.01 69.52 Favored 'General case' 0 N--CA 1.453 -0.287 0 O-C-N 120.785 -1.197 . . . . 0.44 113.288 179.322 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 49' ' ' LYS . . . . . 0.497 ' HA ' ' HE2' ' A' ' 49' ' ' LYS . 10.5 mmpt? -68.97 -48.76 62.35 Favored 'General case' 0 C--N 1.329 -0.323 0 O-C-N 119.908 -1.745 . . . . 0.98 110.834 -177.838 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 4.2 tp10 -84.88 -58.48 2.69 Favored 'General case' 0 N--CA 1.453 -0.322 0 N-CA-C 108.743 -0.836 . . . . 2.21 108.743 -174.232 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 20.7 mp0 -74.56 -31.74 62.19 Favored 'General case' 0 C--O 1.235 0.3 0 O-C-N 121.052 -1.03 . . . . 2.68 110.982 -174.844 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 52' ' ' GLY . . . . . 0.403 ' HA2' ' CD1' ' A' ' 66' ' ' PHE . . . -72.39 42.98 0.85 Allowed Glycine 0 CA--C 1.531 1.091 0 C-N-CA 125.097 1.332 . . . . 0.4 114.336 174.354 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 27.9 t -155.03 35.15 0.39 Allowed 'General case' 0 N--CA 1.451 -0.409 0 O-C-N 121.048 -1.266 . . . . 1.88 108.614 153.332 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 42.9 t30 -140.52 -40.56 0.42 Allowed 'General case' 0 C--N 1.341 0.197 0 N-CA-C 112.728 0.64 . . . . 1.94 112.728 -164.997 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 30.9 mt -64.31 -38.68 91.91 Favored 'General case' 0 C--N 1.332 -0.177 0 O-C-N 121.85 -0.531 . . . . 0.64 110.754 178.209 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 1.4 t 177.57 171.6 0.6 Allowed 'General case' 0 CA--C 1.531 0.241 0 C-N-CA 125.513 1.525 . . . . 0.67 107.612 -175.372 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 8.5 m -59.82 -31.32 69.62 Favored 'General case' 0 N--CA 1.455 -0.216 0 O-C-N 121.717 -0.614 . . . . 1.04 110.634 168.421 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -66.28 -19.05 65.71 Favored 'General case' 0 N--CA 1.463 0.183 0 N-CA-C 112.045 0.387 . . . . 1.31 112.045 174.735 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -83.04 -8.44 85.69 Favored Glycine 0 N--CA 1.439 -1.102 0 CA-C-O 118.579 -1.123 . . . . 0.43 110.546 175.792 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -110.77 -18.99 13.0 Favored 'General case' 0 C--O 1.232 0.166 0 CA-C-N 119.357 1.579 . . . . 2.71 112.527 -176.347 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 3.4 p -62.77 -163.57 0.01 OUTLIER 'General case' 0 CA--C 1.538 0.483 0 C-N-CA 124.177 0.991 . . . . 0.95 109.447 168.282 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 78.1 m-20 -53.29 148.33 8.84 Favored 'General case' 0 CA--C 1.53 0.175 0 O-C-N 120.449 -1.407 . . . . 2.78 110.445 -174.14 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 30.7 tt0 -59.77 -26.94 66.11 Favored 'General case' 0 CA--C 1.537 0.477 0 C-N-CA 123.226 0.61 . . . . 2.87 111.168 -176.07 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -62.38 -39.27 92.64 Favored 'General case' 0 N--CA 1.458 -0.063 0 O-C-N 121.367 -0.833 . . . . 0.59 112.509 171.63 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 13.9 mt-10 -69.2 -44.35 72.31 Favored 'General case' 0 CA--C 1.514 -0.439 0 O-C-N 121.041 -1.037 . . . . 2.21 110.435 177.45 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 66' ' ' PHE . . . . . 0.403 ' CD1' ' HA2' ' A' ' 52' ' ' GLY . 51.7 t80 -53.04 -46.03 68.3 Favored 'General case' 0 CA--C 1.534 0.328 0 C-N-CA 125.308 1.443 . . . . 0.34 111.296 173.485 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 62.3 t80 -64.01 -48.48 76.21 Favored 'General case' 0 CA--C 1.534 0.33 0 CA-C-O 122.217 1.008 . . . . 0.69 109.973 177.379 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -64.44 -41.96 96.26 Favored 'General case' 0 N--CA 1.446 -0.648 0 O-C-N 121.203 -0.936 . . . . 0.44 113.226 -174.564 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -68.67 -35.77 77.66 Favored 'General case' 0 C--N 1.332 -0.154 0 O-C-N 121.054 -1.029 . . . . 3.63 109.848 175.006 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -54.24 -41.27 68.56 Favored 'General case' 0 C--O 1.223 -0.315 0 CA-C-N 118.949 0.795 . . . . 0.38 110.327 171.101 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 19.7 t80 -58.48 -49.97 75.44 Favored 'General case' 0 N--CA 1.464 0.241 0 CA-C-N 120.027 1.285 . . . . 3.4 111.635 173.45 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -51.44 -54.38 27.46 Favored 'General case' 0 CA--C 1.531 0.239 0 O-C-N 121.709 -0.62 . . . . 4.12 110.506 179.035 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 73' ' ' LEU . . . . . 0.608 ' HB3' HG21 ' A' ' 85' ' ' VAL . 0.1 OUTLIER -66.65 -32.77 74.31 Favored 'General case' 0 C--N 1.324 -0.543 0 C-N-CA 124.377 1.071 . . . . 0.42 109.96 -174.468 . . . . . . . . 3 3 . 1 . 025 nuclear build full ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 1.8 tmt? -61.58 -39.32 90.75 Favored 'General case' 0 N--CA 1.447 -0.606 0 C-N-CA 123.676 0.79 . . . . 2.52 112.124 -177.774 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 13.0 p80 -94.59 -8.93 36.68 Favored 'General case' 0 C--O 1.232 0.133 0 CA-C-O 117.3 -1.333 . . . . 1.24 113.187 -179.655 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 9.7 m -40.03 127.37 2.16 Favored 'General case' 0 N--CA 1.45 -0.434 0 CA-C-O 123.24 1.495 . . . . 1.05 110.81 -168.459 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 1.4 p -52.63 -42.77 64.93 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 112.692 -2.049 . . . . 1.3 108.892 -178.315 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 78' ' ' ASP . . . . . 0.439 ' OD2' ' HB3' ' A' ' 80' ' ' ALA . 14.4 t0 -70.62 114.19 8.48 Favored 'General case' 0 N--CA 1.444 -0.739 0 CA-C-O 121.98 0.895 . . . . 1.92 108.916 169.548 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 52.5 m80 -57.72 -32.39 67.36 Favored 'General case' 0 N--CA 1.455 -0.194 0 O-C-N 121.639 -0.663 . . . . 5.33 110.615 174.597 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 80' ' ' ALA . . . . . 0.439 ' HB3' ' OD2' ' A' ' 78' ' ' ASP . . . -61.85 -50.83 70.68 Favored 'General case' 0 N--CA 1.451 -0.381 0 CA-C-O 118.401 -0.809 . . . . 0.85 110.313 179.722 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 4.2 mt-10 -43.17 -45.45 5.57 Favored 'General case' 0 C--N 1.339 0.138 0 C-N-CA 124.725 1.21 . . . . 2.78 110.204 176.648 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 1.9 mtp180 -63.91 -52.75 58.42 Favored 'General case' 0 N--CA 1.453 -0.32 0 CA-C-N 115.828 -0.623 . . . . 2.92 109.778 -178.497 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 1.3 mm? -63.67 -21.08 66.2 Favored 'General case' 0 N--CA 1.452 -0.33 0 CA-C-O 117.651 -1.166 . . . . 0.71 112.701 178.042 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 2.5 mptm? -64.12 -44.55 91.89 Favored 'General case' 0 C--O 1.225 -0.221 0 CA-C-N 121.324 1.875 . . . . 1.48 107.639 171.2 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 85' ' ' VAL . . . . . 0.608 HG21 ' HB3' ' A' ' 73' ' ' LEU . 84.4 t -62.11 -60.82 2.11 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.489 0 CA-C-O 118.144 -0.931 . . . . 0.4 110.368 175.324 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -51.13 -48.14 61.87 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 119.765 1.166 . . . . 2.09 111.197 -174.493 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 37.4 tttm -56.85 -48.54 77.84 Favored 'General case' 0 N--CA 1.449 -0.519 0 C-N-CA 123.769 0.828 . . . . 3.22 111.754 176.457 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 47.4 m-20 -79.29 -7.81 58.58 Favored 'General case' 0 CA--C 1.532 0.261 0 C-N-CA 123.231 0.612 . . . . 1.14 111.556 -177.244 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -165.8 73.19 1.3 Allowed Pre-proline 0 N--CA 1.448 -0.558 0 C-N-CA 125.488 1.515 . . . . 0.74 110.345 -167.72 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 74.4 Cg_endo -73.31 8.14 1.91 Allowed 'Trans proline' 0 N--CA 1.457 -0.62 0 C-N-CA 123.099 2.532 . . . . 1.95 112.875 -175.093 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -122.43 -47.93 2.09 Favored 'General case' 0 N--CA 1.45 -0.431 0 C-N-CA 125.221 1.408 . . . . 2.29 109.638 -177.625 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 2.7 m -53.92 -46.87 71.61 Favored 'General case' 0 C--N 1.334 -0.081 0 C-N-CA 123.706 0.803 . . . . 0.81 111.132 177.568 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 10.3 t80 -60.27 -47.45 85.94 Favored 'General case' 0 CA--C 1.508 -0.635 0 CA-C-O 121.355 0.598 . . . . 2.49 110.567 178.499 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 24.2 tt0 -56.58 -33.76 66.5 Favored 'General case' 0 N--CA 1.441 -0.912 0 CA-C-N 114.693 -1.139 . . . . 2.05 109.882 -179.914 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 3.2 t80 -63.33 -57.94 8.73 Favored 'General case' 0 N--CA 1.455 -0.221 0 C-N-CA 124.443 1.097 . . . . 1.16 109.633 -175.891 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 47.0 mm -51.9 -46.72 41.18 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.14 0 C-N-CA 123.345 0.658 . . . . 1.88 109.67 175.575 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 40.3 t30 -63.75 -32.99 74.67 Favored 'General case' 0 CA--C 1.53 0.205 0 N-CA-C 111.714 0.264 . . . . 2.03 111.714 -176.559 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -63.31 -44.54 94.69 Favored 'General case' 0 CA--C 1.523 -0.075 0 C-N-CA 124.304 1.042 . . . . 2.17 108.639 176.778 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 30.5 mm100 -81.88 58.89 4.05 Favored 'General case' 0 N--CA 1.452 -0.339 0 C-N-CA 123.223 0.609 . . . . 2.77 110.628 178.439 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 6.9 tp -75.11 72.09 0.35 Allowed 'Isoleucine or valine' 0 CA--C 1.54 0.588 0 C-N-CA 124.578 1.151 . . . . 4.08 110.106 179.967 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 2.3 ttmt -169.13 -176.21 2.52 Favored 'General case' 0 CA--C 1.527 0.07 0 O-C-N 120.66 -1.275 . . . . 8.06 108.973 176.22 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 102' ' ' PHE . . . . . . . . . . . . . 6.2 p90 -149.16 157.59 43.5 Favored 'General case' 0 C--N 1.33 -0.282 0 N-CA-C 108.286 -1.005 . . . . 8.0 108.286 178.044 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -68.79 -48.25 71.96 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.377 0 N-CA-C 108.663 -0.866 . . . . 5.65 108.663 173.941 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 104' ' ' ILE . . . . . . . . . . . . . 4.8 tt -154.54 175.8 0.48 Allowed 'Isoleucine or valine' 0 N--CA 1.454 -0.262 0 N-CA-C 107.561 -1.274 . . . . 7.67 107.561 177.941 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 30.7 p-10 -142.16 174.26 10.77 Favored 'General case' 0 N--CA 1.453 -0.314 0 C-N-CA 124.687 1.195 . . . . 6.51 108.702 -178.773 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 15.6 t . . . . . 0 C--O 1.253 1.238 0 CA-C-O 115.383 -2.246 . . . . 10.59 108.506 172.457 . . . . . . . . 0 0 . 1 . 026 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.469 0.841 0 N-CA-C 108.956 -1.658 . . . . 20.18 108.956 . . . . . . . . . 0 0 . 1 . 026 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 5.5 m 21.21 101.12 0.0 OUTLIER 'General case' 0 CA--C 1.531 0.235 0 C-N-CA 129.036 2.934 . . . . 20.58 116.425 160.426 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 4.2 ptpt -146.57 130.32 17.06 Favored 'General case' 0 C--O 1.226 -0.163 0 N-CA-C 108.246 -1.02 . . . . 21.53 108.246 172.705 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 63.64 -150.63 49.63 Favored Glycine 0 CA--C 1.522 0.514 0 CA-C-N 118.209 0.458 . . . . 18.77 112.148 177.585 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 33.7 m -80.43 -154.16 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.446 -0.627 0 C-N-CA 123.609 0.764 . . . . 17.36 109.032 172.957 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 20.8 mt-10 -102.14 109.93 21.76 Favored 'General case' 0 N--CA 1.449 -0.485 0 O-C-N 121.147 -0.971 . . . . 11.64 110.103 175.909 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 7' ' ' LEU . . . . . 0.441 HD22 ' N ' ' A' ' 7' ' ' LEU . 1.9 mm? -99.21 33.11 2.5 Favored 'General case' 0 N--CA 1.455 -0.181 0 C-N-CA 123.746 0.819 . . . . 10.5 109.696 -178.403 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 4.6 mmm-85 -146.88 110.2 4.82 Favored 'General case' 0 N--CA 1.445 -0.679 0 N-CA-C 107.593 -1.262 . . . . 11.09 107.593 -175.161 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 3.7 m-20 -52.59 -29.95 28.51 Favored 'General case' 0 C--O 1.221 -0.423 0 C-N-CA 123.595 0.758 . . . . 2.89 111.832 170.683 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 3.8 t0 -56.13 -56.68 17.94 Favored 'General case' 0 C--N 1.323 -0.586 0 C-N-CA 125.76 1.624 . . . . 2.75 110.651 173.268 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 11.9 m -67.24 -51.05 57.83 Favored 'General case' 0 CA--C 1.533 0.31 0 O-C-N 121.219 -0.926 . . . . 2.08 111.019 178.467 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 3.7 tt0 -67.99 -22.01 65.03 Favored 'General case' 0 CA--C 1.542 0.647 0 C-N-CA 125.703 1.601 . . . . 3.31 110.09 -171.851 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -88.22 -38.15 7.38 Favored Glycine 0 CA--C 1.524 0.627 0 C-N-CA 125.785 1.66 . . . . 0.78 110.781 174.974 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -51.0 -50.44 58.5 Favored 'General case' 0 CA--C 1.522 -0.097 0 CA-C-N 118.52 1.16 . . . . 4.13 109.853 179.823 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER -62.36 -33.65 60.24 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.313 0 N-CA-C 112.617 0.599 . . . . 0.54 112.617 178.838 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 10.1 t60 -61.62 -52.33 64.8 Favored 'General case' 0 CA--C 1.531 0.213 0 N-CA-C 106.684 -1.599 . . . . 0.67 106.684 178.349 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 36.7 mt-10 -57.21 -36.84 71.37 Favored 'General case' 0 CA--C 1.53 0.207 0 O-C-N 121.473 -0.767 . . . . 2.63 111.337 176.946 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 1.1 t80 -56.9 -41.73 78.63 Favored 'General case' 0 C--N 1.33 -0.25 0 O-C-N 121.511 -0.743 . . . . 2.14 110.881 175.398 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -52.88 -45.11 61.59 Favored Glycine 0 CA--C 1.53 0.97 0 N-CA-C 111.249 -0.74 . . . . 0.73 111.249 172.631 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 71.6 m-70 -59.7 -49.02 79.35 Favored 'General case' 0 C--O 1.227 -0.105 0 CA-C-N 118.216 1.008 . . . . 3.62 111.279 175.403 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -58.69 -29.29 66.52 Favored 'General case' 0 CA--C 1.533 0.291 0 O-C-N 122.018 -0.426 . . . . 0.6 110.982 -179.185 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 49.3 t -66.57 -42.21 89.59 Favored 'Isoleucine or valine' 0 C--O 1.233 0.223 0 O-C-N 121.08 -1.012 . . . . 1.0 111.053 176.27 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 65.0 m-20 -62.02 -21.25 64.73 Favored 'General case' 0 C--O 1.232 0.146 0 CA-C-N 117.904 0.32 . . . . 2.17 111.648 175.777 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 45.5 t0 -71.21 -51.17 26.22 Favored 'General case' 0 N--CA 1.457 -0.121 0 CA-C-O 121.981 0.896 . . . . 2.2 109.06 -176.052 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -53.86 -52.31 60.85 Favored 'General case' 0 C--O 1.233 0.195 0 N-CA-C 109.011 -0.737 . . . . 2.78 109.011 175.075 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -59.99 -28.79 67.99 Favored 'General case' 0 N--CA 1.451 -0.388 0 N-CA-C 112.093 0.405 . . . . 0.89 112.093 178.713 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -66.45 -36.28 91.3 Favored Glycine 0 CA--C 1.52 0.37 0 N-CA-C 111.1 -0.8 . . . . 1.15 111.1 177.99 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 0.8 OUTLIER -78.98 -42.83 25.75 Favored 'General case' 0 N--CA 1.454 -0.249 0 CA-C-N 117.866 0.833 . . . . 2.88 110.909 -177.974 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 2.9 mm? -80.64 -32.37 36.2 Favored 'General case' 0 N--CA 1.449 -0.487 0 C-N-CA 123.844 0.858 . . . . 1.67 113.178 -173.116 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 14.2 mt -111.97 -134.84 0.35 Allowed 'General case' 0 N--CA 1.45 -0.442 0 N-CA-C 106.793 -1.558 . . . . 2.6 106.793 -172.975 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 18.19 93.02 0.01 OUTLIER 'General case' 0 N--CA 1.468 0.432 0 C-N-CA 127.971 2.508 . . . . 5.72 115.993 168.705 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 6.9 ptmm? -60.32 167.03 2.66 Favored 'General case' 0 CA--C 1.533 0.3 0 CA-C-O 121.508 0.67 . . . . 8.06 112.55 -178.352 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 56.0 t30 -48.39 146.06 3.06 Favored 'General case' 0 CA--C 1.532 0.286 0 C-N-CA 124.731 1.212 . . . . 7.94 112.157 -178.594 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 45.6 mt-30 66.69 24.14 10.07 Favored 'General case' 0 CA--C 1.531 0.22 0 C-N-CA 126.844 2.058 . . . . 8.67 112.159 -164.1 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 3.9 t -135.31 153.98 51.69 Favored 'General case' 0 N--CA 1.448 -0.527 0 N-CA-C 104.895 -2.261 . . . . 6.24 104.895 153.765 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 49.7 t0 -150.12 129.48 12.91 Favored 'General case' 0 C--N 1.329 -0.286 0 N-CA-C 107.099 -1.445 . . . . 5.38 107.099 179.788 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 6.2 mp 60.79 147.53 0.02 OUTLIER 'General case' 0 CA--C 1.536 0.433 0 C-N-CA 125.47 1.508 . . . . 2.06 110.464 -156.574 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 7.7 p -71.58 128.93 35.2 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.192 0 O-C-N 120.294 -1.504 . . . . 3.15 107.723 174.18 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 59.0 p -134.56 109.31 8.6 Favored 'General case' 0 CA--C 1.529 0.155 0 CA-C-N 119.042 0.837 . . . . 3.73 108.984 173.72 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 7.6 m-80 37.43 49.86 1.01 Allowed 'General case' 0 CA--C 1.532 0.273 0 C-N-CA 127.235 2.214 . . . . 7.02 115.332 179.429 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 34.3 t -55.71 -50.24 70.86 Favored 'General case' 0 CA--C 1.533 0.326 0 O-C-N 121.059 -1.026 . . . . 3.34 112.343 -179.357 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 6.4 mtpm? -66.5 -20.51 66.05 Favored 'General case' 0 N--CA 1.465 0.323 0 O-C-N 121.41 -0.806 . . . . 6.2 112.714 -176.817 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 24.7 mttt -143.26 71.91 1.35 Allowed 'General case' 0 N--CA 1.451 -0.406 0 N-CA-C 106.392 -1.706 . . . . 7.56 106.392 -174.572 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 9.3 m-85 -38.71 101.4 0.02 OUTLIER 'General case' 0 N--CA 1.456 -0.169 0 C-N-CA 125.639 1.576 . . . . 5.51 111.164 -172.117 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 2.4 tt 36.94 57.48 0.18 Allowed 'Isoleucine or valine' 0 CA--C 1.542 0.655 0 C-N-CA 125.73 1.612 . . . . 2.37 111.856 -179.518 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 1.6 t70 -118.62 -57.85 2.02 Favored 'General case' 0 N--CA 1.468 0.432 0 C-N-CA 125.661 1.584 . . . . 2.19 109.612 -176.677 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 4.4 mm -50.3 -53.25 12.52 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.26 0 C-N-CA 123.988 0.915 . . . . 0.47 109.383 178.262 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 20.2 t80 -60.11 -32.22 70.78 Favored 'General case' 0 N--CA 1.452 -0.338 0 C-N-CA 123.504 0.722 . . . . 0.4 112.243 178.465 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 49' ' ' LYS . . . . . 0.501 ' HA ' ' HE2' ' A' ' 49' ' ' LYS . 0.6 OUTLIER -63.38 -51.14 67.09 Favored 'General case' 0 CA--C 1.519 -0.22 0 O-C-N 120.336 -1.478 . . . . 0.91 110.502 -179.331 . . . . . . . . 3 3 . 1 . 026 nuclear build full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 3.1 tp10 -79.44 -65.98 0.93 Allowed 'General case' 0 N--CA 1.452 -0.338 0 CA-C-O 122.27 1.033 . . . . 2.13 108.559 -175.368 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 3.8 mm-40 -72.14 -30.23 64.82 Favored 'General case' 0 N--CA 1.453 -0.316 0 C-N-CA 124.006 0.923 . . . . 2.3 109.956 -167.336 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 52' ' ' GLY . . . . . 0.413 ' HA2' ' CD1' ' A' ' 66' ' ' PHE . . . -68.99 41.68 0.34 Allowed Glycine 0 CA--C 1.527 0.815 0 C-N-CA 125.706 1.622 . . . . 0.33 113.838 169.036 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 65.3 p -145.77 22.42 1.44 Allowed 'General case' 0 N--CA 1.448 -0.55 0 O-C-N 120.871 -1.37 . . . . 1.98 111.49 159.681 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 47.9 t-20 -135.44 -44.32 0.69 Allowed 'General case' 0 C--O 1.226 -0.16 0 N-CA-C 111.906 0.336 . . . . 1.58 111.906 -165.529 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 28.7 mt -58.55 -38.55 78.07 Favored 'General case' 0 N--CA 1.462 0.163 0 CA-C-O 120.985 0.421 . . . . 0.4 111.142 -174.987 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER 178.16 172.03 0.68 Allowed 'General case' 0 CA--C 1.531 0.22 0 C-N-CA 125.468 1.507 . . . . 0.53 107.591 -178.244 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 14.4 m -56.89 -35.55 69.08 Favored 'General case' 0 N--CA 1.453 -0.283 0 O-C-N 121.572 -0.705 . . . . 1.0 110.319 166.7 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -64.67 -21.43 66.73 Favored 'General case' 0 CA--C 1.534 0.343 0 CA-C-O 121.085 0.469 . . . . 1.31 111.858 175.969 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -80.73 -12.49 82.76 Favored Glycine 0 N--CA 1.444 -0.791 0 N-CA-C 111.125 -0.79 . . . . 0.45 111.125 176.372 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 36.4 ttt-85 -110.98 -11.59 14.31 Favored 'General case' 0 CA--C 1.529 0.171 0 CA-C-N 118.758 1.279 . . . . 2.32 112.151 -179.15 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 2.2 p -63.9 -161.63 0.01 OUTLIER 'General case' 0 CA--C 1.54 0.568 0 C-N-CA 123.616 0.766 . . . . 0.99 109.9 167.059 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 16.3 t-20 -52.34 151.83 3.78 Favored 'General case' 0 CA--C 1.532 0.287 0 O-C-N 120.907 -1.121 . . . . 2.14 110.709 -177.574 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 35.7 tt0 -59.91 -36.37 76.85 Favored 'General case' 0 CA--C 1.53 0.182 0 CA-C-N 118.915 0.78 . . . . 2.47 110.349 -176.527 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -55.37 -30.14 59.78 Favored 'General case' 0 C--N 1.331 -0.198 0 O-C-N 121.522 -0.736 . . . . 0.42 112.813 176.924 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 1.6 mm-40 -82.16 -38.67 24.34 Favored 'General case' 0 N--CA 1.447 -0.589 0 CA-C-O 118.612 -0.709 . . . . 2.65 110.362 -179.177 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 66' ' ' PHE . . . . . 0.413 ' CD1' ' HA2' ' A' ' 52' ' ' GLY . 59.0 t80 -55.16 -47.29 75.36 Favored 'General case' 0 N--CA 1.452 -0.361 0 C-N-CA 124.267 1.027 . . . . 0.36 111.43 170.73 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 56.9 t80 -65.03 -48.11 75.02 Favored 'General case' 0 CA--C 1.538 0.501 0 O-C-N 121.061 -1.024 . . . . 0.49 109.819 176.141 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -58.82 -55.69 31.92 Favored 'General case' 0 CA--C 1.536 0.44 0 N-CA-C 113.252 0.834 . . . . 0.27 113.252 -174.7 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -55.4 -39.56 70.34 Favored 'General case' 0 C--N 1.331 -0.218 0 O-C-N 121.027 -1.045 . . . . 3.87 111.355 171.264 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -60.17 -32.95 71.54 Favored 'General case' 0 CA--C 1.533 0.311 0 CA-C-N 119.737 1.153 . . . . 0.42 110.872 175.516 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -59.17 -49.71 76.83 Favored 'General case' 0 N--CA 1.464 0.229 0 CA-C-N 119.127 0.876 . . . . 3.37 111.901 168.681 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 72' ' ' ARG . . . . . 0.494 ' HE ' ' CD2' ' A' ' 73' ' ' LEU . 10.7 ttp180 -51.92 -61.61 2.15 Favored 'General case' 0 CA--C 1.534 0.352 0 O-C-N 121.392 -0.818 . . . . 2.09 110.82 174.905 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 73' ' ' LEU . . . . . 0.494 ' CD2' ' HE ' ' A' ' 72' ' ' ARG . 0.1 OUTLIER -62.25 -45.89 91.3 Favored 'General case' 0 C--O 1.221 -0.436 0 C-N-CA 125.56 1.544 . . . . 0.49 110.649 -170.94 . . . . . . . . 3 3 . 1 . 026 nuclear build full ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -63.61 -25.96 68.46 Favored 'General case' 0 C--N 1.331 -0.216 0 O-C-N 120.276 -1.515 . . . . 4.57 111.808 -179.867 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -91.96 -12.11 34.28 Favored 'General case' 0 C--O 1.232 0.169 0 CA-C-O 117.063 -1.446 . . . . 1.03 112.327 175.214 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 80.3 p -48.9 122.66 5.99 Favored 'General case' 0 N--CA 1.446 -0.642 0 CA-C-N 119.8 1.182 . . . . 2.25 108.31 -167.436 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 2.2 p -51.21 -39.36 56.36 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 114.646 -1.161 . . . . 1.11 109.641 177.102 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 13.5 t0 -63.98 104.35 0.7 Allowed 'General case' 0 N--CA 1.448 -0.528 0 CA-C-O 121.641 0.734 . . . . 2.06 109.846 166.685 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 39.3 p-80 -50.17 -35.23 25.28 Favored 'General case' 0 C--N 1.332 -0.171 0 C-N-CA 122.991 0.517 . . . . 4.54 111.994 174.268 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -61.12 -51.24 69.93 Favored 'General case' 0 N--CA 1.449 -0.512 0 CA-C-O 118.516 -0.754 . . . . 0.63 110.736 -178.072 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 1.2 mt-10 -50.42 -39.52 47.53 Favored 'General case' 0 C--O 1.233 0.198 0 CA-C-N 119.132 0.878 . . . . 3.25 110.478 177.759 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -62.97 -52.96 60.98 Favored 'General case' 0 N--CA 1.453 -0.312 0 C-N-CA 119.218 -0.993 . . . . 3.03 108.891 -178.588 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 1.2 mm? -65.64 -18.1 65.08 Favored 'General case' 0 N--CA 1.451 -0.423 0 CA-C-O 117.866 -1.064 . . . . 0.55 112.114 178.851 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 6.0 mttt -65.83 -44.65 84.91 Favored 'General case' 0 CA--C 1.516 -0.335 0 CA-C-N 120.824 1.647 . . . . 1.23 108.299 169.371 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 95.8 t -58.2 -60.28 2.44 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.497 0 CA-C-N 118.757 0.708 . . . . 0.5 110.051 171.254 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -57.37 -45.54 84.34 Favored 'General case' 0 CA--C 1.53 0.202 0 CA-C-N 119.512 1.051 . . . . 2.35 111.812 -169.721 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 56.6 tttt -58.09 -53.44 58.25 Favored 'General case' 0 N--CA 1.451 -0.404 0 C-N-CA 123.723 0.809 . . . . 2.16 109.712 177.03 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 4.3 m-20 -77.23 -6.5 53.27 Favored 'General case' 0 N--CA 1.453 -0.283 0 CA-C-O 118.825 -0.607 . . . . 0.92 111.229 -173.927 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -164.46 72.9 1.61 Allowed Pre-proline 0 N--CA 1.447 -0.609 0 C-N-CA 124.952 1.301 . . . . 0.39 110.587 -171.75 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 72.9 Cg_endo -74.27 16.89 0.55 Allowed 'Trans proline' 0 CA--C 1.536 0.584 0 C-N-CA 123.461 2.774 . . . . 1.47 113.283 -173.861 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -133.75 -41.82 0.84 Allowed 'General case' 0 N--CA 1.454 -0.252 0 C-N-CA 125.385 1.474 . . . . 2.69 109.29 -177.635 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 5.7 m -54.55 -48.1 72.4 Favored 'General case' 0 CA--C 1.521 -0.154 0 O-C-N 121.159 -0.963 . . . . 0.38 110.615 171.517 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 2.7 t80 -59.12 -46.67 87.72 Favored 'General case' 0 CA--C 1.506 -0.733 0 C-N-CA 119.849 -0.741 . . . . 2.45 110.492 179.342 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 50.2 tt0 -54.09 -37.13 63.93 Favored 'General case' 0 N--CA 1.442 -0.85 0 O-C-N 123.964 0.79 . . . . 2.41 110.319 177.708 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 4.4 t80 -60.66 -57.63 11.9 Favored 'General case' 0 N--CA 1.457 -0.078 0 CA-C-N 118.549 0.613 . . . . 0.94 109.568 -174.557 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 3.2 mp -60.9 -39.01 80.58 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.284 0 N-CA-C 109.588 -0.523 . . . . 0.75 109.588 177.598 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 9.3 t-20 -62.0 -35.41 78.43 Favored 'General case' 0 N--CA 1.455 -0.198 0 O-C-N 121.597 -0.689 . . . . 2.45 111.443 -174.789 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -57.16 -52.45 65.28 Favored 'General case' 0 C--O 1.231 0.11 0 C-N-CA 125.679 1.592 . . . . 2.1 108.303 174.904 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 7.6 mm100 -78.6 85.91 4.62 Favored 'General case' 0 N--CA 1.449 -0.486 0 CA-C-N 115.832 -0.622 . . . . 2.98 109.796 177.577 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 2.9 pt -39.71 118.64 0.13 Allowed 'Isoleucine or valine' 0 CA--C 1.533 0.302 0 C-N-CA 124.271 1.029 . . . . 5.18 111.038 177.176 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -80.51 60.42 3.88 Favored 'General case' 0 CA--C 1.532 0.286 0 O-C-N 121.789 -0.57 . . . . 12.07 111.221 -175.307 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 102' ' ' PHE . . . . . . . . . . . . . 81.2 m-85 -142.04 44.33 1.68 Allowed 'General case' 0 N--CA 1.452 -0.359 0 C-N-CA 125.708 1.603 . . . . 8.89 107.38 -179.574 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 11.2 tp -66.23 149.88 11.26 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.247 0 N-CA-C 108.275 -1.009 . . . . 4.54 108.275 172.433 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 104' ' ' ILE . . . . . . . . . . . . . 97.7 mt -126.84 159.18 36.97 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.186 0 N-CA-C 106.301 -1.74 . . . . 7.69 106.301 -176.316 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 6.8 p30 -124.6 162.99 22.9 Favored 'General case' 0 C--N 1.332 -0.195 0 C-N-CA 124.146 0.978 . . . . 7.62 108.424 -177.481 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 14.1 t . . . . . 0 C--O 1.252 1.219 0 CA-C-O 116.469 -1.729 . . . . 12.39 109.068 -160.122 . . . . . . . . 0 0 . 1 . 027 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.466 0.674 0 N-CA-C 107.988 -2.045 . . . . 14.24 107.988 . . . . . . . . . 0 0 . 1 . 027 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 1.7 m -65.82 164.14 15.38 Favored 'General case' 0 CA--C 1.537 0.445 0 C-N-CA 124.352 1.061 . . . . 13.38 110.728 179.582 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 5.8 ttmt -159.78 147.41 16.88 Favored 'General case' 0 C--N 1.339 0.135 0 N-CA-C 108.784 -0.821 . . . . 18.24 108.784 177.448 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 156.19 -172.5 34.07 Favored Glycine 0 C--N 1.333 0.371 0 N-CA-C 108.734 -1.746 . . . . 13.13 108.734 -174.925 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 28.0 m -98.01 -158.76 0.09 OUTLIER 'Isoleucine or valine' 0 N--CA 1.444 -0.759 0 N-CA-C 106.966 -1.494 . . . . 13.4 106.966 159.837 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 5.3 pt-20 -99.66 119.98 38.97 Favored 'General case' 0 N--CA 1.447 -0.591 0 CA-C-O 121.879 0.847 . . . . 9.27 110.83 176.58 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 1.6 mm? -112.4 30.35 7.16 Favored 'General case' 0 N--CA 1.453 -0.297 0 C-N-CA 124.164 0.986 . . . . 9.18 109.936 -179.004 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER 68.31 -68.56 0.17 Allowed 'General case' 0 N--CA 1.465 0.303 0 C-N-CA 125.316 1.447 . . . . 7.02 110.606 -172.141 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 3.5 m120 -50.12 -34.06 20.86 Favored 'General case' 0 CA--C 1.513 -0.475 0 C-N-CA 124.64 1.176 . . . . 2.49 112.793 172.21 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 16.3 t70 -68.18 -40.67 82.17 Favored 'General case' 0 C--O 1.223 -0.332 0 C-N-CA 119.932 -0.707 . . . . 3.62 110.913 177.99 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 50.6 m -62.66 -57.88 9.46 Favored 'General case' 0 N--CA 1.455 -0.212 0 CA-C-N 119.154 0.888 . . . . 1.92 110.99 176.518 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 9.1 pt-20 -70.12 -21.13 63.14 Favored 'General case' 0 CA--C 1.536 0.412 0 O-C-N 121.625 -0.672 . . . . 3.37 110.404 -176.375 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -76.61 -38.79 31.41 Favored Glycine 0 CA--C 1.528 0.89 0 C-N-CA 124.366 0.984 . . . . 0.58 111.873 175.668 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 34.0 t80 -58.21 -51.98 67.49 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 118.72 1.26 . . . . 3.39 109.344 -174.876 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 0.7 OUTLIER -63.1 -33.97 63.94 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.469 0 O-C-N 121.625 -0.672 . . . . 0.5 111.956 179.694 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 2.2 t-160 -60.29 -53.69 54.63 Favored 'General case' 0 CA--C 1.533 0.32 0 N-CA-C 106.7 -1.592 . . . . 0.57 106.7 176.554 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 86.4 mt-10 -51.54 -44.7 62.75 Favored 'General case' 0 C--O 1.223 -0.32 0 C-N-CA 124.455 1.102 . . . . 2.47 110.05 177.669 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -53.37 -56.98 12.3 Favored 'General case' 0 CA--C 1.519 -0.25 0 C-N-CA 124.476 1.11 . . . . 2.41 110.892 177.987 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -48.03 -46.66 26.6 Favored Glycine 0 CA--C 1.523 0.537 0 N-CA-C 110.466 -1.054 . . . . 0.5 110.466 175.652 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 20' ' ' HIS . . . . . 0.64 ' CE1' ' HB1' ' A' ' 64' ' ' ALA . 2.6 t-160 -60.68 -46.35 90.67 Favored 'General case' 0 N--CA 1.45 -0.428 0 O-C-N 122.052 -0.675 . . . . 1.79 112.028 -179.525 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -60.38 -31.46 70.37 Favored 'General case' 0 N--CA 1.447 -0.575 0 N-CA-C 109.428 -0.582 . . . . 0.67 109.428 -179.214 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 26.3 t -66.47 -41.54 88.77 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.182 0 C-N-CA 118.567 -1.253 . . . . 0.86 111.682 175.44 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 33.3 t0 -57.87 -29.54 65.1 Favored 'General case' 0 N--CA 1.464 0.243 0 CA-C-O 122.098 0.952 . . . . 2.06 111.114 174.925 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 6.8 t70 -74.17 -51.99 13.85 Favored 'General case' 0 N--CA 1.446 -0.626 0 N-CA-C 108.407 -0.96 . . . . 2.28 108.407 -174.482 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 1.2 t80 -59.75 -47.8 84.22 Favored 'General case' 0 N--CA 1.454 -0.249 0 C-N-CA 124.232 1.013 . . . . 3.64 109.304 -179.161 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -61.32 -30.06 70.26 Favored 'General case' 0 N--CA 1.446 -0.638 0 CA-C-O 118.284 -0.865 . . . . 0.9 111.469 178.289 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -88.71 -4.32 76.1 Favored Glycine 0 CA--C 1.525 0.68 0 CA-C-N 119.839 1.199 . . . . 1.4 112.56 179.188 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -90.15 -49.55 6.5 Favored 'General case' 0 N--CA 1.451 -0.416 0 N-CA-C 108.715 -0.846 . . . . 2.67 108.715 173.012 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 3.0 mm? -79.58 -38.62 33.62 Favored 'General case' 0 N--CA 1.449 -0.509 0 C-N-CA 125.151 1.38 . . . . 1.61 111.976 -177.037 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 2.7 mt -116.51 173.65 6.49 Favored 'General case' 0 N--CA 1.445 -0.678 0 N-CA-C 106.32 -1.733 . . . . 2.23 106.32 -177.994 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER 57.48 99.18 0.02 OUTLIER 'General case' 0 CA--C 1.537 0.468 0 CA-C-O 122.941 1.353 . . . . 5.66 112.063 -177.07 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 24.5 mttm -68.62 168.51 12.89 Favored 'General case' 0 C--O 1.226 -0.141 0 O-C-N 120.216 -1.553 . . . . 7.72 110.255 -176.583 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -58.67 88.53 0.01 OUTLIER 'General case' 0 CA--C 1.533 0.31 0 C-N-CA 124.616 1.166 . . . . 7.09 112.284 -165.234 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 1.1 mt-30 -149.47 -48.02 0.14 Allowed 'General case' 0 C--N 1.332 -0.165 0 C-N-CA 124.312 1.045 . . . . 11.04 109.968 -174.322 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 34.4 t -127.78 157.47 40.31 Favored 'General case' 0 N--CA 1.452 -0.37 0 N-CA-C 106.564 -1.643 . . . . 5.84 106.564 167.05 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 16.3 t70 -91.87 143.09 26.86 Favored 'General case' 0 N--CA 1.449 -0.476 0 N-CA-C 107.091 -1.448 . . . . 5.22 107.091 174.393 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 4.0 mp 63.87 152.13 0.04 OUTLIER 'General case' 0 CA--C 1.541 0.617 0 C-N-CA 125.917 1.687 . . . . 1.92 111.044 -168.266 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 11.2 p -66.09 -45.22 91.06 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.498 0 O-C-N 120.337 -1.477 . . . . 2.79 109.866 -174.413 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 24.1 p 46.32 -146.7 0.17 Allowed 'General case' 0 CA--C 1.538 0.49 0 C-N-CA 125.07 1.348 . . . . 3.64 112.255 179.847 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 40.3 t-20 -100.59 76.4 1.82 Allowed 'General case' 0 C--O 1.232 0.153 0 O-C-N 121.034 -1.041 . . . . 7.34 110.405 -177.349 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 25.3 p -69.04 -49.86 53.84 Favored 'General case' 0 N--CA 1.453 -0.322 0 CA-C-N 116.481 -0.327 . . . . 3.76 111.191 -178.135 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 6.8 mtpm? -57.5 -34.75 69.4 Favored 'General case' 0 N--CA 1.465 0.318 0 N-CA-C 113.5 0.926 . . . . 7.27 113.5 -175.958 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 34.1 mmtt -134.44 97.21 3.76 Favored 'General case' 0 N--CA 1.452 -0.34 0 N-CA-C 106.575 -1.639 . . . . 6.62 106.575 -177.282 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 27.3 t80 -48.85 95.23 0.01 OUTLIER 'General case' 0 N--CA 1.456 -0.154 0 C-N-CA 125.396 1.478 . . . . 7.0 110.88 -167.672 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 44.9 pt 39.1 79.67 0.02 OUTLIER 'Isoleucine or valine' 0 CA--C 1.538 0.497 0 C-N-CA 126.4 1.88 . . . . 3.11 112.911 -172.05 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 42.2 t0 -116.48 -58.32 2.1 Favored 'General case' 0 N--CA 1.467 0.41 0 C-N-CA 123.693 0.797 . . . . 2.28 110.335 -174.145 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 5.4 mm -51.94 -54.74 12.18 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.397 0 C-N-CA 124.74 1.216 . . . . 0.53 109.523 172.673 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 48' ' ' PHE . . . . . 0.474 ' CD2' ' HE3' ' A' ' 49' ' ' LYS . 22.1 t80 -57.77 -28.62 64.14 Favored 'General case' 0 N--CA 1.452 -0.325 0 O-C-N 120.414 -1.429 . . . . 0.47 112.148 176.538 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 49' ' ' LYS . . . . . 0.474 ' HE3' ' CD2' ' A' ' 48' ' ' PHE . 0.2 OUTLIER -69.17 -46.21 68.08 Favored 'General case' 0 N--CA 1.45 -0.431 0 O-C-N 120.353 -1.467 . . . . 1.11 111.251 -178.317 . . . . . . . . 3 3 . 1 . 027 nuclear build full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 52.3 tp10 -83.68 -66.01 0.94 Allowed 'General case' 0 C--N 1.33 -0.264 0 N-CA-C 109.009 -0.738 . . . . 2.82 109.009 -179.688 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 29.9 mp0 -69.19 -32.6 72.0 Favored 'General case' 0 C--O 1.236 0.384 0 O-C-N 121.384 -0.823 . . . . 2.69 111.35 -172.082 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -72.14 42.27 0.78 Allowed Glycine 0 CA--C 1.529 0.913 0 C-N-CA 124.652 1.12 . . . . 0.39 113.949 172.5 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 22.9 t -146.38 24.43 1.26 Allowed 'General case' 0 N--CA 1.447 -0.584 0 O-C-N 121.246 -1.149 . . . . 1.58 109.511 159.257 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -138.06 -27.99 0.88 Allowed 'General case' 0 C--N 1.342 0.273 0 N-CA-C 113.778 1.029 . . . . 2.28 113.778 -169.979 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 55' ' ' LEU . . . . . 0.624 HD22 HG22 ' A' ' 85' ' ' VAL . 32.0 mt -68.28 -40.02 81.96 Favored 'General case' 0 C--N 1.333 -0.151 0 CA-C-N 119.06 0.845 . . . . 0.45 110.793 -179.441 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER 177.71 165.42 0.65 Allowed 'General case' 0 C--N 1.33 -0.253 0 C-N-CA 125.511 1.524 . . . . 0.44 106.961 -173.477 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 7.2 m -59.8 -35.18 74.14 Favored 'General case' 0 N--CA 1.453 -0.278 0 C-N-CA 123.027 0.531 . . . . 1.05 110.637 170.262 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -71.18 -6.09 36.84 Favored 'General case' 0 CA--C 1.533 0.306 0 C-N-CA 122.88 0.472 . . . . 1.01 112.032 176.127 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -101.85 4.23 52.97 Favored Glycine 0 CA--C 1.524 0.606 0 C-N-CA 124.524 1.059 . . . . 0.54 111.196 172.853 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -114.1 -17.89 11.81 Favored 'General case' 0 CA--C 1.527 0.064 0 C-N-CA 124.356 1.062 . . . . 3.59 111.514 177.274 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 13.9 p -61.74 -160.13 0.01 OUTLIER 'General case' 0 CA--C 1.541 0.607 0 C-N-CA 125.443 1.497 . . . . 0.85 109.691 168.069 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 3.7 m120 -50.49 146.62 5.26 Favored 'General case' 0 CA--C 1.535 0.373 0 O-C-N 119.983 -1.698 . . . . 2.16 111.469 -177.081 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 38.8 tt0 -56.52 -30.62 63.24 Favored 'General case' 0 N--CA 1.467 0.398 0 CA-C-O 121.443 0.64 . . . . 2.65 110.493 179.095 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 64' ' ' ALA . . . . . 0.64 ' HB1' ' CE1' ' A' ' 20' ' ' HIS . . . -53.69 -45.05 70.24 Favored 'General case' 0 N--CA 1.452 -0.367 0 C-N-CA 123.841 0.857 . . . . 0.58 112.183 172.643 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 8.7 mt-10 -72.75 -39.26 66.99 Favored 'General case' 0 C--O 1.221 -0.397 0 O-C-N 121.562 -0.712 . . . . 2.29 110.756 178.484 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 55.4 t80 -51.45 -52.93 42.2 Favored 'General case' 0 C--N 1.332 -0.159 0 C-N-CA 123.337 0.655 . . . . 0.31 111.18 173.99 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 73.4 t80 -66.61 -45.54 78.83 Favored 'General case' 0 N--CA 1.449 -0.492 0 C-N-CA 123.711 0.804 . . . . 0.41 110.579 -178.567 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -60.12 -47.6 85.22 Favored 'General case' 0 CA--C 1.539 0.537 0 O-C-N 121.198 -0.939 . . . . 0.25 111.963 -178.666 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 48.1 mm-40 -55.41 -44.79 76.55 Favored 'General case' 0 CA--C 1.517 -0.292 0 C-N-CA 125.011 1.324 . . . . 4.23 109.975 169.36 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -55.7 -45.94 77.77 Favored 'General case' 0 N--CA 1.446 -0.632 0 CA-C-O 118.06 -0.971 . . . . 0.39 109.508 -175.869 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 73.9 t80 -56.82 -50.8 71.3 Favored 'General case' 0 N--CA 1.464 0.271 0 CA-C-N 119.343 0.974 . . . . 2.66 111.913 172.799 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 18.3 ttp180 -46.15 -58.02 4.0 Favored 'General case' 0 CA--C 1.531 0.25 0 CA-C-N 118.283 0.492 . . . . 2.61 110.826 178.103 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 73' ' ' LEU . . . . . 0.611 HD12 HG23 ' A' ' 85' ' ' VAL . 0.1 OUTLIER -65.14 -32.51 74.23 Favored 'General case' 0 C--N 1.324 -0.528 0 C-N-CA 125.332 1.453 . . . . 0.41 110.92 -178.428 . . . . . . . . 3 3 . 1 . 027 nuclear build full ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -59.48 -39.57 84.14 Favored 'General case' 0 CA--C 1.517 -0.315 0 C-N-CA 123.701 0.8 . . . . 2.52 110.012 -178.047 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 22.9 p80 -90.52 -36.45 14.48 Favored 'General case' 0 N--CA 1.45 -0.443 0 CA-C-O 115.723 -2.084 . . . . 0.96 110.867 -176.948 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 15.9 m -8.14 111.32 0.01 OUTLIER 'General case' 0 C--N 1.348 0.53 0 C-N-CA 127.883 2.473 . . . . 1.03 113.342 -171.765 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 4.1 p -46.56 -42.62 16.19 Favored 'General case' 0 N--CA 1.45 -0.465 0 C-N-CA 125.186 1.394 . . . . 0.98 110.567 -177.013 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 78' ' ' ASP . . . . . 0.419 ' OD2' ' HB3' ' A' ' 80' ' ' ALA . 14.6 t0 -70.13 105.63 2.99 Favored 'General case' 0 N--CA 1.447 -0.586 0 C-N-CA 118.073 -1.451 . . . . 2.26 110.162 164.333 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 5.9 p-80 -39.38 -43.36 1.19 Allowed 'General case' 0 N--CA 1.45 -0.464 0 CA-C-N 114.457 -1.247 . . . . 4.34 113.039 169.657 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 80' ' ' ALA . . . . . 0.419 ' HB3' ' OD2' ' A' ' 78' ' ' ASP . . . -66.98 -40.1 87.35 Favored 'General case' 0 N--CA 1.453 -0.291 0 O-C-N 121.872 -0.517 . . . . 0.91 110.195 -172.549 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 81' ' ' GLU . . . . . 0.472 ' OE1' HD13 ' A' ' 73' ' ' LEU . 1.1 tm-20 -50.94 -41.79 59.24 Favored 'General case' 0 C--N 1.328 -0.327 0 C-N-CA 124.604 1.161 . . . . 3.33 110.097 172.625 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -63.53 -47.18 82.68 Favored 'General case' 0 CA--C 1.519 -0.234 0 C-N-CA 119.327 -0.949 . . . . 3.26 108.795 176.926 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 83' ' ' LEU . . . . . 0.403 HD13 ' HA ' ' A' ' 83' ' ' LEU . 2.1 mm? -56.57 -25.11 51.52 Favored 'General case' 0 N--CA 1.456 -0.129 0 CA-C-O 118.042 -0.98 . . . . 0.62 113.308 174.061 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 14.9 mptt -64.64 -48.33 75.23 Favored 'General case' 0 CA--C 1.52 -0.21 0 CA-C-N 121.082 1.764 . . . . 3.04 108.956 172.337 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 85' ' ' VAL . . . . . 0.624 HG22 HD22 ' A' ' 55' ' ' LEU . 2.4 t -57.87 -60.51 2.1 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.5 0 CA-C-N 118.608 0.64 . . . . 0.69 109.921 173.488 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 86' ' ' GLN . . . . . 0.436 ' HG2' ' CG ' ' A' ' 93' ' ' PHE . 36.0 mt-30 -52.48 -50.44 62.73 Favored 'General case' 0 N--CA 1.453 -0.32 0 CA-C-N 118.909 0.777 . . . . 4.59 111.091 -171.064 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 8.5 pttp -65.02 -41.09 95.61 Favored 'General case' 0 N--CA 1.455 -0.214 0 O-C-N 121.623 -0.673 . . . . 3.4 110.842 -179.249 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 89.9 m-20 -79.75 -8.5 59.29 Favored 'General case' 0 CA--C 1.529 0.16 0 O-C-N 122.077 -0.389 . . . . 1.07 110.891 -177.27 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 89' ' ' ALA . . . . . 0.542 ' HB2' HD21 ' A' ' 55' ' ' LEU . . . -160.9 62.52 1.63 Allowed Pre-proline 0 N--CA 1.446 -0.648 0 C-N-CA 123.606 0.763 . . . . 0.51 110.769 -169.416 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 28.5 Cg_endo -59.99 -35.9 91.61 Favored 'Trans proline' 0 N--CA 1.452 -0.929 0 C-N-CA 122.018 1.812 . . . . 2.16 110.56 -174.153 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 3.4 tttt -77.56 -44.23 29.23 Favored 'General case' 0 N--CA 1.453 -0.285 0 C-N-CA 123.496 0.718 . . . . 4.66 111.219 -177.038 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 12.0 m -58.21 -42.47 86.26 Favored 'General case' 0 CA--C 1.518 -0.288 0 O-C-N 121.22 -0.925 . . . . 0.53 110.394 177.734 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 93' ' ' PHE . . . . . 0.436 ' CG ' ' HG2' ' A' ' 86' ' ' GLN . 56.3 t80 -54.9 -51.38 66.2 Favored 'General case' 0 CA--C 1.502 -0.893 0 C-N-CA 120.07 -0.652 . . . . 2.74 111.161 178.144 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 36.6 tt0 -50.94 -35.61 34.24 Favored 'General case' 0 N--CA 1.445 -0.701 0 O-C-N 124.374 1.046 . . . . 2.03 111.016 178.74 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 4.1 t80 -58.75 -58.95 6.32 Favored 'General case' 0 CA--C 1.532 0.288 0 C-N-CA 123.268 0.627 . . . . 0.98 110.102 -177.55 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 3.9 mp -62.89 -35.29 70.55 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.128 0 O-C-N 121.419 -0.801 . . . . 0.88 109.59 178.781 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 7.5 t-20 -63.23 -29.81 71.08 Favored 'General case' 0 N--CA 1.452 -0.328 0 C-N-CA 122.693 0.397 . . . . 2.0 110.206 -179.012 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 10.7 t70 -70.91 -45.72 63.79 Favored 'General case' 0 C--N 1.333 -0.116 0 CA-C-O 121.546 0.689 . . . . 2.56 109.734 174.57 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 5.5 mm-40 -62.08 -52.57 63.36 Favored 'General case' 0 CA--C 1.532 0.286 0 C-N-CA 123.493 0.717 . . . . 3.37 111.893 -175.015 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -75.5 103.71 3.32 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.291 0 N-CA-C 107.575 -1.268 . . . . 4.72 107.575 -174.167 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 4.2 tmtt? -154.64 -42.82 0.09 Allowed 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.016 -0.538 . . . . 10.55 110.423 -165.386 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 102' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -135.75 -46.26 0.67 Allowed 'General case' 0 N--CA 1.456 -0.141 0 C-N-CA 124.186 0.994 . . . . 8.54 109.963 177.566 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 7.2 tp -61.39 136.72 24.6 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.327 0 N-CA-C 109.555 -0.535 . . . . 5.82 109.555 178.428 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 104' ' ' ILE . . . . . . . . . . . . . 7.9 tp -155.0 -53.89 0.02 OUTLIER 'Isoleucine or valine' 0 CA--C 1.528 0.113 0 N-CA-C 109.519 -0.548 . . . . 9.29 109.519 176.793 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 2.9 t-20 -158.02 175.9 13.23 Favored 'General case' 0 C--O 1.233 0.212 0 N-CA-C 107.787 -1.19 . . . . 6.98 107.787 176.932 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 89.5 p . . . . . 0 C--O 1.248 0.979 0 CA-C-O 116.354 -1.784 . . . . 9.56 108.15 170.188 . . . . . . . . 0 0 . 1 . 028 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.472 1.087 0 N-CA-C 108.932 -1.667 . . . . 15.25 108.932 . . . . . . . . . 0 0 . 1 . 028 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 13.1 m -153.19 84.5 1.2 Allowed 'General case' 0 CA--C 1.519 -0.228 0 CA-C-N 118.652 1.226 . . . . 17.28 109.935 -177.759 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 2.6 ttmt -167.1 41.37 0.05 OUTLIER 'General case' 0 C--O 1.224 -0.246 0 C-N-CA 121.047 -0.261 . . . . 20.85 111.534 178.315 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 58.77 39.54 93.83 Favored Glycine 0 C--N 1.336 0.559 0 N-CA-C 111.586 -0.606 . . . . 15.23 111.586 -175.103 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 30.2 m -84.81 -169.93 0.13 Allowed 'Isoleucine or valine' 0 N--CA 1.439 -0.99 0 N-CA-C 109.627 -0.509 . . . . 12.35 109.627 179.466 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 12.2 pt-20 -82.02 111.04 17.81 Favored 'General case' 0 N--CA 1.448 -0.559 0 CA-C-O 122.31 1.052 . . . . 8.55 111.114 179.779 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -95.55 40.37 1.11 Allowed 'General case' 0 N--CA 1.451 -0.379 0 N-CA-C 108.498 -0.927 . . . . 10.38 108.498 -178.942 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 69.7 mtt180 -137.52 -84.47 0.32 Allowed 'General case' 0 N--CA 1.448 -0.575 0 C-N-CA 125.714 1.605 . . . . 7.19 107.504 -173.022 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 2.3 m120 -62.68 -61.42 2.43 Favored 'General case' 0 C--O 1.224 -0.27 0 CA-C-N 119.291 0.951 . . . . 2.96 111.953 179.276 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 32.7 t70 -52.87 -43.22 65.95 Favored 'General case' 0 N--CA 1.465 0.28 0 CA-C-N 119.425 1.011 . . . . 2.4 111.309 179.642 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 62.0 m -58.61 -60.43 3.82 Favored 'General case' 0 C--O 1.225 -0.201 0 O-C-N 121.575 -0.703 . . . . 1.58 112.655 177.242 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 12' ' ' GLU . . . . . 0.504 ' HA ' HD11 ' A' ' 15' ' ' ILE . 30.0 mt-10 -69.36 -37.27 77.53 Favored 'General case' 0 C--N 1.329 -0.321 0 C-N-CA 125.076 1.35 . . . . 3.33 109.998 -168.825 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -54.36 -63.77 4.9 Favored Glycine 0 CA--C 1.526 0.723 0 N-CA-C 109.993 -1.243 . . . . 0.72 109.993 167.079 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 79.4 t80 -49.84 -55.9 12.46 Favored 'General case' 0 C--O 1.224 -0.256 0 C-N-CA 124.031 0.932 . . . . 3.12 111.28 -175.635 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 15' ' ' ILE . . . . . 0.504 HD11 ' HA ' ' A' ' 12' ' ' GLU . 0.9 OUTLIER -66.69 -31.0 51.54 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.192 0 O-C-N 121.457 -0.777 . . . . 0.5 112.632 -179.199 . . . . . . . . 3 3 . 1 . 028 nuclear build full ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 5.7 t60 -59.65 -57.2 13.97 Favored 'General case' 0 C--N 1.341 0.228 0 N-CA-C 106.406 -1.702 . . . . 0.62 106.406 176.359 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 44.0 mt-10 -54.11 -39.51 66.47 Favored 'General case' 0 N--CA 1.452 -0.343 0 C-N-CA 124.607 1.163 . . . . 2.1 110.713 178.384 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 4.0 t80 -58.78 -48.08 82.5 Favored 'General case' 0 CA--C 1.521 -0.16 0 C-N-CA 124.054 0.942 . . . . 2.02 110.488 178.625 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -51.15 -45.44 51.74 Favored Glycine 0 CA--C 1.525 0.67 0 N-CA-C 110.322 -1.111 . . . . 0.42 110.322 172.983 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 20' ' ' HIS . . . . . 0.544 ' CE1' ' HB1' ' A' ' 64' ' ' ALA . 2.3 t-160 -60.81 -48.68 80.72 Favored 'General case' 0 N--CA 1.45 -0.426 0 O-C-N 122.109 -0.642 . . . . 1.88 111.32 179.434 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -60.3 -30.89 69.77 Favored 'General case' 0 N--CA 1.453 -0.319 0 O-C-N 121.696 -0.628 . . . . 0.67 110.169 179.846 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 74.2 t -69.95 -39.47 77.52 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.163 0 O-C-N 121.338 -0.851 . . . . 0.84 110.633 176.8 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 9.5 t0 -59.49 -30.66 68.71 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-O 121.364 0.602 . . . . 2.14 110.698 172.242 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 8.5 t0 -67.88 -52.45 36.34 Favored 'General case' 0 N--CA 1.452 -0.367 0 N-CA-C 107.714 -1.217 . . . . 1.99 107.714 -174.881 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 40.8 t80 -56.08 -49.61 73.32 Favored 'General case' 0 N--CA 1.454 -0.231 0 CA-C-N 115.898 -0.592 . . . . 2.42 110.239 177.869 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -57.6 -38.71 75.36 Favored 'General case' 0 N--CA 1.448 -0.537 0 C-N-CA 120.851 -0.34 . . . . 1.04 111.206 -179.332 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -71.46 -41.13 58.8 Favored Glycine 0 CA--C 1.525 0.668 0 N-CA-C 111.084 -0.806 . . . . 1.09 111.084 -179.194 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 1.7 t80 -61.77 -47.2 86.23 Favored 'General case' 0 N--CA 1.454 -0.242 0 C-N-CA 123.487 0.715 . . . . 2.05 109.411 -176.39 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -81.81 -32.65 31.19 Favored 'General case' 0 N--CA 1.451 -0.41 0 C-N-CA 123.275 0.63 . . . . 1.93 112.432 -176.59 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 2.6 mt -124.53 75.61 1.42 Allowed 'General case' 0 N--CA 1.451 -0.386 0 N-CA-C 107.106 -1.442 . . . . 2.21 107.106 -169.487 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -46.92 -51.76 16.13 Favored 'General case' 0 N--CA 1.468 0.453 0 C-N-CA 124.635 1.174 . . . . 6.64 111.301 -165.398 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 32' ' ' LYS . . . . . 0.426 ' HE3' ' HA ' ' A' ' 32' ' ' LYS . 0.1 OUTLIER 34.27 74.6 0.06 Allowed 'General case' 0 CA--C 1.54 0.563 0 C-N-CA 127.819 2.448 . . . . 9.67 113.072 174.215 . . . . . . . . 3 3 . 1 . 028 nuclear build full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 17.2 t-20 71.09 140.97 0.05 OUTLIER 'General case' 0 C--O 1.22 -0.455 0 C-N-CA 130.043 3.337 . . . . 8.48 112.381 -175.099 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 11.3 pt20 -80.62 36.44 0.38 Allowed 'General case' 0 CA--C 1.534 0.36 0 C-N-CA 123.37 0.668 . . . . 8.7 111.563 -176.655 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -147.77 147.04 29.45 Favored 'General case' 0 N--CA 1.451 -0.396 0 N-CA-C 107.793 -1.188 . . . . 7.2 107.793 178.809 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 38.5 m-20 54.82 -163.78 0.12 Allowed 'General case' 0 CA--C 1.54 0.581 0 C-N-CA 124.888 1.275 . . . . 11.08 109.923 -173.266 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 2.7 mm? -116.91 -144.49 0.38 Allowed 'General case' 0 CA--C 1.539 0.552 0 N-CA-C 106.831 -1.544 . . . . 4.02 106.831 176.277 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 3.0 p -74.61 -24.48 18.5 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.446 0 O-C-N 119.941 -1.725 . . . . 3.61 110.392 -179.256 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 8.8 t -49.8 151.75 1.71 Allowed 'General case' 0 CA--C 1.538 0.498 0 C-N-CA 124.956 1.302 . . . . 5.0 111.792 169.143 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 13.5 m-80 38.83 46.2 1.03 Allowed 'General case' 0 CA--C 1.538 0.491 0 C-N-CA 126.214 1.806 . . . . 6.87 113.839 -176.875 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 10.5 t -74.13 -65.69 0.81 Allowed 'General case' 0 CA--C 1.537 0.456 0 O-C-N 120.861 -1.149 . . . . 3.45 112.377 -177.856 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 3.8 mptt -55.91 -62.16 1.88 Allowed 'General case' 0 N--CA 1.469 0.511 0 O-C-N 121.138 -0.977 . . . . 6.37 111.124 -173.677 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -89.52 101.46 14.14 Favored 'General case' 0 N--CA 1.449 -0.497 0 N-CA-C 105.537 -2.023 . . . . 6.35 105.537 167.328 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 57.7 m-85 -52.57 128.14 25.08 Favored 'General case' 0 N--CA 1.452 -0.366 0 O-C-N 124.137 0.898 . . . . 5.66 108.968 173.44 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 45' ' ' ILE . . . . . 0.406 HD11 ' HE3' ' A' ' 49' ' ' LYS . 5.0 tt 34.36 78.41 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.543 0.7 0 C-N-CA 126.519 1.928 . . . . 2.26 112.74 176.76 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 14.8 t70 -140.39 -58.24 0.53 Allowed 'General case' 0 N--CA 1.465 0.31 0 C-N-CA 124.684 1.194 . . . . 2.12 110.396 -170.086 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 5.7 mm -53.31 -50.08 49.38 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.19 0 N-CA-C 108.339 -0.986 . . . . 0.46 108.339 172.052 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 19.6 t80 -63.61 -25.76 68.38 Favored 'General case' 0 N--CA 1.454 -0.225 0 O-C-N 121.906 -0.496 . . . . 0.42 112.008 177.667 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 49' ' ' LYS . . . . . 0.545 ' HA ' ' CE ' ' A' ' 49' ' ' LYS . 0.6 OUTLIER -71.22 -48.37 51.75 Favored 'General case' 0 N--CA 1.45 -0.43 0 O-C-N 119.774 -1.829 . . . . 1.49 110.888 -178.192 . . . . . . . . 3 3 . 1 . 028 nuclear build full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 22.8 tp10 -85.63 -63.53 1.31 Allowed 'General case' 0 C--N 1.328 -0.331 0 N-CA-C 108.582 -0.896 . . . . 2.6 108.582 -176.927 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 3.4 mm-40 -67.22 -32.86 74.2 Favored 'General case' 0 CA--C 1.536 0.407 0 C-N-CA 123.833 0.853 . . . . 2.73 109.789 -170.175 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 52' ' ' GLY . . . . . 0.446 ' HA2' ' CD1' ' A' ' 66' ' ' PHE . . . -68.05 43.9 0.3 Allowed Glycine 0 CA--C 1.53 1.028 0 C-N-CA 126.917 2.199 . . . . 0.34 114.587 171.132 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 33.1 p -154.2 32.25 0.43 Allowed 'General case' 0 N--CA 1.448 -0.536 0 O-C-N 121.104 -1.233 . . . . 1.96 109.869 160.274 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -137.35 -43.94 0.55 Allowed 'General case' 0 CA--C 1.517 -0.296 0 N-CA-C 112.908 0.707 . . . . 1.81 112.908 -168.719 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 55' ' ' LEU . . . . . 0.5 HD22 HG22 ' A' ' 85' ' ' VAL . 15.3 mt -63.11 -36.48 83.74 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 120.872 0.367 . . . . 0.38 110.749 -175.926 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 1.1 t 176.53 171.01 0.45 Allowed 'General case' 0 CA--C 1.531 0.234 0 C-N-CA 125.835 1.654 . . . . 0.45 107.501 -177.919 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 20.8 m -57.38 -33.71 68.1 Favored 'General case' 0 N--CA 1.453 -0.306 0 O-C-N 121.713 -0.617 . . . . 0.91 110.555 168.016 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -61.15 -30.89 70.66 Favored 'General case' 0 CA--C 1.53 0.199 0 CA-C-N 118.475 0.58 . . . . 1.08 110.894 174.207 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -71.8 -11.56 73.69 Favored Glycine 0 C--O 1.221 -0.663 0 O-C-N 121.354 -0.841 . . . . 0.37 111.729 176.524 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 32.1 ttt180 -105.14 -12.54 16.07 Favored 'General case' 0 CA--C 1.533 0.294 0 CA-C-N 118.817 1.308 . . . . 2.78 112.473 177.224 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 41.4 p -66.39 -134.9 0.0 OUTLIER 'General case' 0 N--CA 1.47 0.573 0 CA-C-N 118.833 0.742 . . . . 0.77 111.211 178.204 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 6.7 t-20 -69.07 152.91 44.62 Favored 'General case' 0 N--CA 1.453 -0.307 0 O-C-N 119.465 -2.022 . . . . 2.9 107.943 179.871 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 5.3 tm-20 -60.7 -33.1 72.36 Favored 'General case' 0 CA--C 1.531 0.246 0 CA-C-N 118.72 0.691 . . . . 3.4 109.625 177.487 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 64' ' ' ALA . . . . . 0.544 ' HB1' ' CE1' ' A' ' 20' ' ' HIS . . . -61.0 -30.73 70.46 Favored 'General case' 0 N--CA 1.45 -0.435 0 N-CA-C 113.246 0.832 . . . . 0.52 113.246 174.848 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 2.4 mt-10 -80.13 -42.31 23.76 Favored 'General case' 0 CA--C 1.51 -0.567 0 CA-C-O 118.392 -0.813 . . . . 2.36 110.592 176.5 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 66' ' ' PHE . . . . . 0.446 ' CD1' ' HA2' ' A' ' 52' ' ' GLY . 54.7 t80 -48.99 -49.0 42.92 Favored 'General case' 0 N--CA 1.453 -0.309 0 C-N-CA 123.596 0.758 . . . . 0.33 111.164 172.816 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 82.7 t80 -63.29 -44.42 95.11 Favored 'General case' 0 CA--C 1.539 0.53 0 O-C-N 121.319 -0.863 . . . . 0.38 110.772 177.074 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -62.21 -56.44 18.66 Favored 'General case' 0 CA--C 1.54 0.586 0 O-C-N 121.296 -0.878 . . . . 0.31 113.021 -175.594 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 1.1 pp20? -56.19 -38.45 70.98 Favored 'General case' 0 C--N 1.333 -0.123 0 O-C-N 120.962 -1.086 . . . . 3.73 111.204 171.376 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -57.91 -42.55 84.99 Favored 'General case' 0 N--CA 1.45 -0.438 0 CA-C-O 118.493 -0.765 . . . . 0.37 110.562 175.347 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 55.7 t80 -59.98 -50.08 75.16 Favored 'General case' 0 N--CA 1.464 0.268 0 CA-C-N 120.37 1.441 . . . . 2.8 111.544 174.453 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 6.9 ttt180 -44.71 -62.22 1.29 Allowed 'General case' 0 N--CA 1.465 0.294 0 N-CA-C 109.097 -0.705 . . . . 2.28 109.097 178.08 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 73' ' ' LEU . . . . . 0.528 HD12 HG23 ' A' ' 85' ' ' VAL . 0.1 OUTLIER -60.43 -37.93 82.47 Favored 'General case' 0 CA--C 1.515 -0.372 0 C-N-CA 125.651 1.58 . . . . 0.42 111.107 -177.253 . . . . . . . . 3 3 . 1 . 028 nuclear build full ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 1.6 tmt? -65.81 -33.01 74.86 Favored 'General case' 0 N--CA 1.451 -0.393 0 O-C-N 122.189 -0.319 . . . . 2.81 111.263 -174.593 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 75' ' ' HIS . . . . . 0.425 ' CE1' HD12 ' A' ' 15' ' ' ILE . 5.2 p80 -92.8 -20.43 20.74 Favored 'General case' 0 CA--C 1.527 0.096 0 CA-C-O 117.159 -1.4 . . . . 0.87 112.708 177.35 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 76' ' ' SER . . . . . 0.425 ' O ' ' HD2' ' A' ' 82' ' ' ARG . 32.0 m -33.77 114.43 0.19 Allowed 'General case' 0 C--O 1.22 -0.491 0 C-N-CA 125.981 1.712 . . . . 1.19 112.446 -169.547 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 1.4 p -46.11 -39.96 10.24 Favored 'General case' 0 C--N 1.326 -0.441 0 C-N-CA 124.863 1.265 . . . . 1.43 110.832 -178.968 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 11.5 t0 -65.03 103.42 0.74 Allowed 'General case' 0 N--CA 1.451 -0.407 0 CA-C-O 121.823 0.821 . . . . 1.87 110.238 165.486 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 11.7 p80 -46.15 -37.7 7.32 Favored 'General case' 0 N--CA 1.455 -0.212 0 C-N-CA 123.574 0.75 . . . . 4.47 112.13 173.316 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -61.1 -47.05 88.09 Favored 'General case' 0 N--CA 1.451 -0.394 0 CA-C-N 118.378 0.535 . . . . 0.75 110.292 -178.555 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 2.9 mt-10 -52.8 -40.22 63.04 Favored 'General case' 0 CA--C 1.512 -0.484 0 CA-C-O 121.116 0.484 . . . . 3.13 111.365 177.348 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 82' ' ' ARG . . . . . 0.425 ' HD2' ' O ' ' A' ' 76' ' ' SER . 15.3 mtp180 -64.77 -56.49 13.25 Favored 'General case' 0 N--CA 1.45 -0.468 0 C-N-CA 119.173 -1.011 . . . . 2.46 108.343 178.762 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 83' ' ' LEU . . . . . 0.418 HD13 ' HA ' ' A' ' 83' ' ' LEU . 0.9 OUTLIER -56.34 -23.77 39.48 Favored 'General case' 0 C--O 1.223 -0.291 0 N-CA-C 113.28 0.844 . . . . 0.57 113.28 178.883 . . . . . . . . 3 3 . 1 . 028 nuclear build full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 32.1 mttt -67.66 -45.3 75.68 Favored 'General case' 0 CA--C 1.517 -0.31 0 CA-C-N 120.242 1.383 . . . . 1.65 108.777 173.64 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 85' ' ' VAL . . . . . 0.528 HG23 HD12 ' A' ' 73' ' ' LEU . 39.8 t -60.11 -53.48 48.0 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.614 0 CA-C-O 118.661 -0.685 . . . . 0.42 110.671 170.95 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 60.1 mt-30 -60.6 -44.59 96.11 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 120.394 1.452 . . . . 4.31 110.965 -171.125 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 22.4 tttt -59.87 -51.32 70.24 Favored 'General case' 0 N--CA 1.452 -0.362 0 C-N-CA 123.948 0.899 . . . . 2.22 110.6 175.751 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 38.9 m-20 -78.41 -8.24 58.26 Favored 'General case' 0 C--N 1.331 -0.212 0 C-N-CA 122.944 0.498 . . . . 1.15 111.474 -174.144 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 89' ' ' ALA . . . . . 0.462 ' HB2' HD21 ' A' ' 55' ' ' LEU . . . -159.37 69.61 3.29 Favored Pre-proline 0 N--CA 1.447 -0.598 0 C-N-CA 125.013 1.325 . . . . 0.43 109.305 -173.144 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 36.2 Cg_endo -61.36 -25.76 80.61 Favored 'Trans proline' 0 N--CA 1.453 -0.907 0 C-N-CA 122.454 2.103 . . . . 1.74 110.759 -176.462 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 7.1 mttp -81.62 -52.96 6.64 Favored 'General case' 0 N--CA 1.449 -0.493 0 C-N-CA 123.211 0.604 . . . . 4.79 110.557 177.902 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 2.3 m -55.51 -39.9 71.1 Favored 'General case' 0 N--CA 1.467 0.385 0 CA-C-N 119.28 0.946 . . . . 0.6 111.296 -175.67 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 3.2 t80 -48.96 -65.67 0.53 Allowed 'General case' 0 CA--C 1.503 -0.836 0 CA-C-O 121.423 0.63 . . . . 4.64 112.562 175.261 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 44.7 tt0 -54.2 -31.98 54.44 Favored 'General case' 0 N--CA 1.44 -0.965 0 CA-C-N 113.926 -1.488 . . . . 1.51 109.727 -178.162 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 4.7 t80 -68.9 -58.53 4.01 Favored 'General case' 0 N--CA 1.451 -0.398 0 C-N-CA 122.87 0.468 . . . . 2.03 110.442 -173.102 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 35.5 mm -48.27 -46.41 13.75 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.139 0 C-N-CA 123.9 0.88 . . . . 1.55 109.961 172.279 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 12.4 t-20 -64.82 -32.7 74.52 Favored 'General case' 0 CA--C 1.535 0.373 0 CA-C-N 117.853 0.297 . . . . 1.73 111.631 -176.153 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 12.5 t70 -61.4 -45.38 94.6 Favored 'General case' 0 N--CA 1.464 0.236 0 CA-C-O 121.61 0.719 . . . . 2.06 109.404 174.723 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -72.09 -46.93 54.87 Favored 'General case' 0 CA--C 1.536 0.425 0 CA-C-N 115.492 -0.776 . . . . 4.25 110.805 -172.137 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 20.7 mm -72.19 97.31 0.7 Allowed 'Isoleucine or valine' 0 N--CA 1.454 -0.237 0 N-CA-C 108.498 -0.927 . . . . 6.9 108.498 -175.291 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -134.27 84.83 2.14 Favored 'General case' 0 C--O 1.222 -0.349 0 O-C-N 121.601 -0.687 . . . . 9.72 109.498 177.376 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 102' ' ' PHE . . . . . . . . . . . . . 7.8 m-85 48.58 89.12 0.02 OUTLIER 'General case' 0 CA--C 1.535 0.402 0 C-N-CA 125.658 1.583 . . . . 7.89 112.67 178.437 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 0.5 OUTLIER -112.69 4.6 8.19 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.489 0 O-C-N 121.897 -0.502 . . . . 4.56 111.418 179.495 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 104' ' ' ILE . . . . . . . . . . . . . 6.9 pt -87.43 68.53 0.62 Allowed 'Isoleucine or valine' 0 CA--C 1.529 0.164 0 O-C-N 120.813 -1.18 . . . . 8.82 110.46 -176.768 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 1.5 t-20 70.25 176.86 0.27 Allowed 'General case' 0 CA--C 1.534 0.33 0 C-N-CA 123.955 0.902 . . . . 7.93 110.436 -178.389 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 20.3 t . . . . . 0 C--O 1.253 1.238 0 CA-C-O 116.574 -1.679 . . . . 13.28 110.661 -174.987 . . . . . . . . 0 0 . 1 . 029 nuclear build full ' A' A ' 1' ' ' GLY . . . . . 0.533 ' HA2' ' OE2' ' A' ' 17' ' ' GLU . . . . . . . . 0 N--CA 1.469 0.862 0 N-CA-C 109.638 -1.385 . . . . 12.25 109.638 . . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 11.5 p -125.85 -105.95 0.33 Allowed 'General case' 0 N--CA 1.449 -0.482 0 N-CA-C 106.038 -1.838 . . . . 12.44 106.038 170.628 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 71.85 166.21 0.3 Allowed 'General case' 0 N--CA 1.466 0.333 0 C-N-CA 125.965 1.706 . . . . 15.85 111.038 -176.378 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 95.89 -167.92 25.8 Favored Glycine 0 C--N 1.333 0.415 0 N-CA-C 110.499 -1.04 . . . . 11.77 110.499 177.132 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 33.5 m -95.52 -163.2 0.11 Allowed 'Isoleucine or valine' 0 N--CA 1.443 -0.801 0 N-CA-C 108.027 -1.101 . . . . 12.75 108.027 169.549 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 9.8 pt-20 -81.51 121.97 26.96 Favored 'General case' 0 N--CA 1.45 -0.43 0 CA-C-O 121.734 0.778 . . . . 10.15 110.877 174.52 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 7' ' ' LEU . . . . . 0.437 HD22 ' N ' ' A' ' 7' ' ' LEU . 0.0 OUTLIER -158.04 38.99 0.26 Allowed 'General case' 0 N--CA 1.451 -0.382 0 C-N-CA 124.653 1.181 . . . . 8.2 110.372 178.572 . . . . . . . . 3 3 . 1 . 029 nuclear build full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 76.96 -55.66 0.55 Allowed 'General case' 0 N--CA 1.468 0.463 0 C-N-CA 125.317 1.447 . . . . 9.62 111.776 -176.999 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 1.9 m120 -55.94 -33.96 65.21 Favored 'General case' 0 CA--C 1.51 -0.583 0 C-N-CA 123.974 0.91 . . . . 2.51 111.483 -178.131 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 13.6 t70 -60.95 -52.46 64.91 Favored 'General case' 0 N--CA 1.443 -0.821 0 CA-C-O 119.108 -0.472 . . . . 2.16 110.672 173.753 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 19.3 m -58.65 -57.05 14.7 Favored 'General case' 0 CA--C 1.531 0.231 0 CA-C-N 119.444 1.02 . . . . 1.54 111.488 -179.124 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 12' ' ' GLU . . . . . 0.529 ' HA ' HD11 ' A' ' 15' ' ' ILE . 0.0 OUTLIER -71.23 -27.7 63.66 Favored 'General case' 0 CA--C 1.536 0.416 0 CA-C-O 121.472 0.654 . . . . 3.95 110.197 -172.759 . . . . . . . . 3 3 . 1 . 029 nuclear build full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -73.03 -37.78 55.99 Favored Glycine 0 CA--C 1.522 0.504 0 N-CA-C 110.68 -0.968 . . . . 0.62 110.68 176.485 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 15.3 t80 -64.15 -54.86 27.07 Favored 'General case' 0 CA--C 1.517 -0.29 0 CA-C-N 118.082 0.941 . . . . 2.51 108.481 -176.359 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 15' ' ' ILE . . . . . 0.529 HD11 ' HA ' ' A' ' 12' ' ' GLU . 0.6 OUTLIER -61.43 -34.5 61.57 Favored 'Isoleucine or valine' 0 CA--C 1.528 0.113 0 CA-C-O 118.864 -0.589 . . . . 0.52 112.579 175.547 . . . . . . . . 3 3 . 1 . 029 nuclear build full ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 4.6 t60 -56.44 -55.09 37.92 Favored 'General case' 0 C--N 1.341 0.211 0 N-CA-C 106.916 -1.513 . . . . 0.52 106.916 177.309 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 17' ' ' GLU . . . . . 0.533 ' OE2' ' HA2' ' A' ' 1' ' ' GLY . 48.3 mt-10 -62.41 -32.11 72.9 Favored 'General case' 0 N--CA 1.452 -0.367 0 CA-C-O 118.709 -0.662 . . . . 2.63 111.802 179.608 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 17.7 t80 -59.19 -50.21 74.9 Favored 'General case' 0 N--CA 1.452 -0.326 0 CA-C-N 118.999 0.818 . . . . 2.17 109.618 177.34 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -51.87 -43.08 54.49 Favored Glycine 0 CA--C 1.529 0.909 0 N-CA-C 111.011 -0.836 . . . . 0.55 111.011 173.889 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 26.1 t-80 -63.28 -53.04 59.04 Favored 'General case' 0 N--CA 1.453 -0.307 0 O-C-N 121.82 -0.812 . . . . 1.7 111.593 -177.738 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -63.65 -27.56 69.31 Favored 'General case' 0 N--CA 1.451 -0.388 0 C-N-CA 123.094 0.558 . . . . 1.02 110.172 -179.352 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 25.1 t -68.28 -42.39 84.44 Favored 'Isoleucine or valine' 0 C--O 1.235 0.307 0 O-C-N 121.342 -0.848 . . . . 1.25 109.646 177.049 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 2.8 t70 -65.24 -20.63 66.52 Favored 'General case' 0 N--CA 1.451 -0.381 0 C-N-CA 120.204 -0.599 . . . . 2.8 111.837 176.209 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 28.1 t70 -63.93 -49.51 72.32 Favored 'General case' 0 N--CA 1.453 -0.282 0 N-CA-C 108.014 -1.106 . . . . 2.22 108.014 -177.942 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -55.4 -43.48 75.26 Favored 'General case' 0 N--CA 1.453 -0.3 0 CA-C-N 115.354 -0.839 . . . . 4.34 111.229 173.049 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -59.45 -39.68 84.39 Favored 'General case' 0 N--CA 1.449 -0.508 0 C-N-CA 119.77 -0.772 . . . . 0.88 110.717 179.619 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -72.87 -40.42 52.3 Favored Glycine 0 CA--C 1.523 0.545 0 CA-C-N 119.083 0.856 . . . . 1.2 111.142 -177.998 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -60.68 -44.57 96.33 Favored 'General case' 0 N--CA 1.452 -0.339 0 O-C-N 121.555 -0.967 . . . . 2.68 109.794 -176.246 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 3.0 mm? -79.7 -35.28 39.28 Favored 'General case' 0 N--CA 1.445 -0.698 0 C-N-CA 123.627 0.771 . . . . 1.51 112.338 179.647 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 2.8 mt -125.97 117.89 24.23 Favored 'General case' 0 CA--C 1.535 0.387 0 N-CA-C 108.021 -1.103 . . . . 2.11 108.021 -168.037 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 46.4 t0 68.54 68.81 0.3 Allowed 'General case' 0 N--CA 1.474 0.735 0 C-N-CA 126.014 1.726 . . . . 4.65 110.802 -166.811 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -69.6 75.96 0.42 Allowed 'General case' 0 CA--C 1.534 0.334 0 C-N-CA 124.552 1.141 . . . . 7.22 111.002 -179.447 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 3.0 t-20 -121.95 173.36 7.57 Favored 'General case' 0 C--N 1.328 -0.341 0 O-C-N 121.631 -0.668 . . . . 6.05 109.25 -163.827 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 15.5 pt20 -66.64 -20.96 66.11 Favored 'General case' 0 CA--C 1.532 0.264 0 O-C-N 121.379 -0.825 . . . . 7.79 111.353 172.773 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -93.26 115.2 27.8 Favored 'General case' 0 N--CA 1.447 -0.578 0 N-CA-C 106.701 -1.592 . . . . 5.58 106.701 173.483 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 26.1 m-20 -71.79 175.27 5.88 Favored 'General case' 0 CA--C 1.534 0.361 0 N-CA-C 109.65 -0.5 . . . . 5.76 109.65 172.316 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 5.8 mp 70.17 153.37 0.11 Allowed 'General case' 0 N--CA 1.467 0.377 0 C-N-CA 127.478 2.311 . . . . 2.79 111.754 -173.61 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 38' ' ' VAL . . . . . 0.412 HG22 ' HB2' ' A' ' 41' ' ' SER . 6.7 p -93.0 33.47 0.13 Allowed 'Isoleucine or valine' 0 CA--C 1.535 0.401 0 O-C-N 121.037 -1.04 . . . . 2.2 109.47 178.19 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 12.3 t -52.21 -40.42 61.55 Favored 'General case' 0 N--CA 1.454 -0.255 0 C-N-CA 123.993 0.917 . . . . 2.84 110.182 179.103 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 20.4 t-20 -75.48 82.38 2.53 Favored 'General case' 0 N--CA 1.448 -0.528 0 N-CA-C 108.678 -0.86 . . . . 6.55 108.678 172.761 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 41' ' ' SER . . . . . 0.412 ' HB2' HG22 ' A' ' 38' ' ' VAL . 13.5 t -156.53 -175.59 5.51 Favored 'General case' 0 N--CA 1.451 -0.411 0 N-CA-C 109.169 -0.678 . . . . 4.95 109.169 176.445 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 1.9 tpmt? 56.91 -73.24 0.02 OUTLIER 'General case' 0 N--CA 1.463 0.212 0 C-N-CA 126.754 2.021 . . . . 7.3 110.746 -165.522 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 13.4 mttt -141.86 46.56 1.66 Allowed 'General case' 0 C--O 1.222 -0.386 0 C-N-CA 123.639 0.776 . . . . 6.7 110.168 176.74 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 29.4 p90 44.14 65.78 0.97 Allowed 'General case' 0 CA--C 1.534 0.348 0 C-N-CA 125.256 1.422 . . . . 6.62 113.297 169.433 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 1.1 mp 69.84 100.34 0.05 OUTLIER 'Isoleucine or valine' 0 CA--C 1.541 0.598 0 C-N-CA 124.365 1.066 . . . . 3.62 108.159 -171.867 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 50.8 t0 -160.83 -62.85 0.06 Allowed 'General case' 0 N--CA 1.465 0.322 0 O-C-N 120.615 -1.303 . . . . 2.19 108.4 -179.474 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 2.0 mm -52.71 -51.6 34.34 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.29 0 C-N-CA 124.781 1.232 . . . . 0.57 110.211 -179.203 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 37.5 t80 -57.71 -31.54 66.52 Favored 'General case' 0 N--CA 1.454 -0.254 0 N-CA-C 113.044 0.757 . . . . 0.41 113.044 178.305 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 49' ' ' LYS . . . . . 0.447 ' HA ' ' HE2' ' A' ' 49' ' ' LYS . 1.0 OUTLIER -62.19 -44.8 95.79 Favored 'General case' 0 C--N 1.331 -0.216 0 O-C-N 120.967 -1.083 . . . . 1.09 111.091 -178.255 . . . . . . . . 3 3 . 1 . 029 nuclear build full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 17.8 tp10 -90.62 -61.61 1.64 Allowed 'General case' 0 CA--C 1.531 0.25 0 CA-C-O 122.442 1.115 . . . . 2.58 109.625 -177.141 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 51' ' ' GLU . . . . . 0.479 ' OE2' ' HE3' ' A' ' 91' ' ' LYS . 28.3 mm-40 -71.41 -34.23 70.16 Favored 'General case' 0 C--N 1.329 -0.305 0 C-N-CA 123.773 0.829 . . . . 2.43 109.889 -169.785 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 52' ' ' GLY . . . . . 0.427 ' HA2' ' CD1' ' A' ' 66' ' ' PHE . . . -69.84 38.8 0.4 Allowed Glycine 0 CA--C 1.528 0.889 0 C-N-CA 125.705 1.621 . . . . 0.4 113.894 168.162 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 34.3 t -153.37 37.82 0.48 Allowed 'General case' 0 N--CA 1.446 -0.656 0 O-C-N 121.133 -1.216 . . . . 1.68 108.191 159.371 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -141.18 -47.63 0.4 Allowed 'General case' 0 CA--C 1.518 -0.251 0 N-CA-C 112.384 0.513 . . . . 1.91 112.384 -169.203 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 55' ' ' LEU . . . . . 0.44 HD22 HG22 ' A' ' 85' ' ' VAL . 37.7 mt -63.31 -36.76 84.77 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 120.808 0.337 . . . . 0.51 110.911 -176.361 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER 177.09 166.5 0.55 Allowed 'General case' 0 CA--C 1.529 0.172 0 C-N-CA 124.673 1.189 . . . . 0.46 108.289 -173.602 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 9.3 m -60.04 -35.07 74.31 Favored 'General case' 0 N--CA 1.454 -0.253 0 C-N-CA 123.212 0.605 . . . . 0.91 110.608 168.73 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -67.59 -10.75 54.83 Favored 'General case' 0 CA--C 1.533 0.324 0 C-N-CA 123.126 0.57 . . . . 1.68 111.716 175.359 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -93.05 -8.62 61.49 Favored Glycine 0 N--CA 1.445 -0.721 0 C-N-CA 124.887 1.232 . . . . 0.43 110.982 174.895 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 37.0 ttt180 -108.88 -11.58 14.99 Favored 'General case' 0 CA--C 1.528 0.118 0 CA-C-N 118.598 1.199 . . . . 2.68 111.88 177.725 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 31.9 p -65.33 -156.1 0.01 OUTLIER 'General case' 0 CA--C 1.541 0.611 0 N-CA-C 109.361 -0.607 . . . . 0.87 109.361 170.098 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 1.3 m-20 -52.82 145.84 11.7 Favored 'General case' 0 CA--C 1.53 0.188 0 O-C-N 120.119 -1.613 . . . . 1.72 110.312 -178.01 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 31.4 tt0 -60.97 -27.91 68.61 Favored 'General case' 0 CA--C 1.537 0.461 0 CA-C-O 122.118 0.961 . . . . 3.17 111.083 -177.595 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -58.62 -41.45 85.93 Favored 'General case' 0 N--CA 1.452 -0.351 0 C-N-CA 124.848 1.259 . . . . 0.51 112.447 170.626 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 6.0 mt-10 -71.73 -42.03 67.8 Favored 'General case' 0 C--O 1.219 -0.534 0 CA-C-O 118.163 -0.922 . . . . 1.79 110.323 176.405 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 66' ' ' PHE . . . . . 0.427 ' CD1' ' HA2' ' A' ' 52' ' ' GLY . 52.7 t80 -50.33 -52.92 32.65 Favored 'General case' 0 N--CA 1.456 -0.143 0 C-N-CA 123.377 0.671 . . . . 0.38 111.077 175.488 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 52.2 t80 -59.64 -42.98 93.98 Favored 'General case' 0 CA--C 1.539 0.555 0 O-C-N 121.712 -0.617 . . . . 0.57 110.53 177.003 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -64.1 -54.28 36.48 Favored 'General case' 0 CA--C 1.538 0.505 0 O-C-N 121.278 -0.889 . . . . 0.37 113.054 -175.124 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 1.4 pp20? -61.56 -37.48 83.98 Favored 'General case' 0 C--N 1.332 -0.195 0 O-C-N 120.97 -1.081 . . . . 3.9 110.174 175.523 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -58.73 -36.27 74.03 Favored 'General case' 0 N--CA 1.451 -0.409 0 CA-C-N 118.377 0.535 . . . . 0.5 110.938 173.761 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 41.6 t80 -63.68 -51.04 66.84 Favored 'General case' 0 CA--C 1.531 0.221 0 CA-C-N 119.758 1.163 . . . . 3.23 111.359 171.627 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 6.2 ttp180 -45.15 -54.14 7.22 Favored 'General case' 0 N--CA 1.468 0.426 0 C-N-CA 123.244 0.618 . . . . 2.31 109.463 177.311 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -67.25 -55.26 14.72 Favored 'General case' 0 C--N 1.329 -0.325 0 C-N-CA 126.615 1.966 . . . . 0.76 110.793 -174.24 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -56.82 -31.73 65.03 Favored 'General case' 0 N--CA 1.464 0.268 0 CA-C-N 119.576 1.08 . . . . 2.78 111.416 -177.622 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 75' ' ' HIS . . . . . 0.432 ' CE1' HD12 ' A' ' 15' ' ' ILE . 0.0 OUTLIER -90.72 -19.92 23.02 Favored 'General case' 0 N--CA 1.454 -0.233 0 CA-C-O 117.342 -1.313 . . . . 0.9 111.748 179.284 . . . . . . . . 3 3 . 1 . 029 nuclear build full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 3.1 m -47.01 115.94 1.22 Allowed 'General case' 0 CA--C 1.507 -0.705 0 CA-C-N 119.953 1.251 . . . . 1.56 108.031 -174.815 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -46.12 -39.45 9.49 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 114.793 -1.094 . . . . 1.91 110.306 -179.533 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 18.0 t0 -57.3 104.78 0.18 Allowed 'General case' 0 N--CA 1.452 -0.337 0 CA-C-O 122.7 1.238 . . . . 2.04 111.556 168.562 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 1.9 p80 -46.73 -38.25 9.66 Favored 'General case' 0 N--CA 1.45 -0.428 0 CA-C-N 114.664 -1.153 . . . . 5.26 112.612 171.539 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -61.2 -58.76 6.98 Favored 'General case' 0 N--CA 1.45 -0.454 0 CA-C-N 119.276 0.944 . . . . 1.12 109.245 -176.346 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -48.27 -39.9 23.06 Favored 'General case' 0 N--CA 1.453 -0.275 0 C-N-CA 123.595 0.758 . . . . 3.68 112.101 179.125 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 12.8 mtt180 -64.23 -53.93 41.49 Favored 'General case' 0 C--N 1.328 -0.362 0 C-N-CA 120.441 -0.504 . . . . 3.2 110.904 178.6 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 83' ' ' LEU . . . . . 0.413 HD13 ' HA ' ' A' ' 83' ' ' LEU . 1.1 mm? -62.06 -23.26 66.37 Favored 'General case' 0 N--CA 1.449 -0.486 0 CA-C-O 117.883 -1.056 . . . . 0.67 111.57 177.654 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 1.7 mptm? -64.57 -42.46 95.62 Favored 'General case' 0 C--O 1.224 -0.281 0 CA-C-N 120.857 1.662 . . . . 1.64 108.283 171.867 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 85' ' ' VAL . . . . . 0.44 HG22 HD22 ' A' ' 55' ' ' LEU . 69.6 t -61.99 -63.45 0.81 Allowed 'Isoleucine or valine' 0 C--O 1.218 -0.557 0 CA-C-O 118.13 -0.938 . . . . 0.4 110.107 172.928 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -48.96 -47.47 43.89 Favored 'General case' 0 CA--C 1.536 0.412 0 CA-C-N 120.328 1.422 . . . . 1.95 111.704 -173.619 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 32.7 tttm -63.0 -50.53 70.39 Favored 'General case' 0 N--CA 1.452 -0.353 0 C-N-CA 124.449 1.1 . . . . 2.13 111.784 179.102 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 25.3 m-20 -86.78 5.16 37.86 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 119.038 -0.506 . . . . 1.07 110.997 -175.006 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 89' ' ' ALA . . . . . 0.422 ' HB2' HD21 ' A' ' 55' ' ' LEU . . . -162.28 69.36 2.16 Favored Pre-proline 0 N--CA 1.447 -0.575 0 C-N-CA 125.54 1.536 . . . . 0.37 109.277 -176.112 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 90.3 Cg_endo -79.45 59.86 7.57 Favored 'Trans proline' 0 N--CA 1.458 -0.566 0 C-N-CA 124.214 3.276 . . . . 1.96 110.801 -173.659 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 91' ' ' LYS . . . . . 0.479 ' HE3' ' OE2' ' A' ' 51' ' ' GLU . 0.0 OUTLIER 175.89 -48.4 0.01 OUTLIER 'General case' 0 CA--C 1.531 0.232 0 C-N-CA 127.046 2.139 . . . . 2.35 109.713 -172.574 . . . . . . . . 3 3 . 1 . 029 nuclear build full ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 8.6 m -57.74 -43.55 85.46 Favored 'General case' 0 CA--C 1.516 -0.333 0 O-C-N 121.101 -0.999 . . . . 0.46 111.445 179.991 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 3.7 t80 -54.28 -48.43 71.24 Favored 'General case' 0 CA--C 1.515 -0.402 0 C-N-CA 120.114 -0.635 . . . . 2.23 110.021 176.251 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 30.0 tt0 -60.82 -29.72 69.65 Favored 'General case' 0 N--CA 1.441 -0.888 0 CA-C-N 115.025 -0.989 . . . . 1.56 111.118 -179.799 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -63.41 -61.97 1.99 Allowed 'General case' 0 N--CA 1.463 0.205 0 C-N-CA 124.427 1.091 . . . . 1.62 108.919 -177.223 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 3.8 mp -53.35 -45.06 56.17 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.323 0 N-CA-C 108.48 -0.933 . . . . 0.99 108.48 177.246 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -57.69 -35.35 70.48 Favored 'General case' 0 C--O 1.225 -0.197 0 N-CA-C 112.352 0.501 . . . . 1.87 112.352 -179.655 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -64.67 -42.66 95.22 Favored 'General case' 0 C--N 1.334 -0.1 0 C-N-CA 124.845 1.258 . . . . 2.35 109.203 178.636 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 26.5 mm100 -79.76 69.16 6.03 Favored 'General case' 0 CA--C 1.532 0.26 0 C-N-CA 123.532 0.733 . . . . 3.08 110.479 179.892 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 68.7 mt -63.41 -70.1 0.18 Allowed 'Isoleucine or valine' 0 CA--C 1.531 0.215 0 C-N-CA 124.269 1.028 . . . . 5.53 109.264 178.784 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 4.7 tttm 51.25 -161.15 0.08 Allowed 'General case' 0 CA--C 1.539 0.529 0 C-N-CA 124.019 0.927 . . . . 11.38 110.911 -172.178 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 102' ' ' PHE . . . . . . . . . . . . . 0.8 OUTLIER -157.36 121.17 4.18 Favored 'General case' 0 N--CA 1.453 -0.316 0 N-CA-C 104.438 -2.43 . . . . 5.95 104.438 161.337 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 7.9 tp -151.97 128.3 1.91 Allowed 'Isoleucine or valine' 0 N--CA 1.448 -0.54 0 N-CA-C 108.69 -0.856 . . . . 3.86 108.69 173.932 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 104' ' ' ILE . . . . . . . . . . . . . 6.9 mt 65.02 133.61 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.537 0.452 0 C-N-CA 125.761 1.624 . . . . 7.53 109.087 -172.347 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 13.2 t-20 -125.64 161.77 26.51 Favored 'General case' 0 C--O 1.234 0.256 0 O-C-N 120.954 -1.091 . . . . 7.35 108.197 -178.151 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 20.0 m . . . . . 0 C--O 1.247 0.965 0 CA-C-O 116.207 -1.854 . . . . 9.08 109.57 166.99 . . . . . . . . 0 0 . 1 . 030 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.469 0.847 0 N-CA-C 110.159 -1.177 . . . . 10.97 110.159 . . . . . . . . . 0 0 . 1 . 030 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 73.6 m -85.73 -67.59 0.79 Allowed 'General case' 0 C--O 1.226 -0.162 0 CA-C-N 118.477 1.139 . . . . 12.6 111.602 -179.956 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 9.6 ptpt -158.14 140.06 13.98 Favored 'General case' 0 N--CA 1.455 -0.195 0 N-CA-C 107.889 -1.152 . . . . 16.09 107.889 -176.367 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 157.29 -178.18 33.77 Favored Glycine 0 N--CA 1.451 -0.308 0 N-CA-C 109.258 -1.537 . . . . 12.23 109.258 -179.729 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 35.6 m -91.75 -164.3 0.1 Allowed 'Isoleucine or valine' 0 N--CA 1.442 -0.846 0 N-CA-C 107.146 -1.427 . . . . 13.31 107.146 156.343 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 5.3 pt-20 -83.05 124.59 30.59 Favored 'General case' 0 N--CA 1.443 -0.792 0 CA-C-O 121.71 0.767 . . . . 9.67 111.475 176.994 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 3.1 mt -125.79 25.67 6.83 Favored 'General case' 0 N--CA 1.454 -0.264 0 C-N-CA 123.725 0.81 . . . . 8.75 109.545 -175.331 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 22.4 mtp180 65.92 -69.33 0.11 Allowed 'General case' 0 C--O 1.227 -0.09 0 C-N-CA 124.981 1.312 . . . . 6.57 110.269 -161.53 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 2.3 m120 -49.78 -38.87 36.05 Favored 'General case' 0 CA--C 1.512 -0.494 0 C-N-CA 123.78 0.832 . . . . 2.72 112.53 177.218 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 7.7 t70 -70.39 -35.49 73.51 Favored 'General case' 0 N--CA 1.455 -0.217 0 C-N-CA 117.387 -1.725 . . . . 4.22 111.397 -177.14 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 18.5 m -67.79 -56.4 9.36 Favored 'General case' 0 C--O 1.231 0.127 0 C-N-CA 125.031 1.333 . . . . 1.78 111.073 178.009 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 35.8 mt-10 -68.61 -26.0 65.14 Favored 'General case' 0 CA--C 1.532 0.274 0 CA-C-O 121.289 0.566 . . . . 3.83 110.331 -178.799 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -61.62 -53.56 42.75 Favored Glycine 0 C--O 1.218 -0.862 0 N-CA-C 109.89 -1.284 . . . . 0.61 109.89 163.308 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 11.2 t80 -50.98 -49.56 59.96 Favored 'General case' 0 CA--C 1.519 -0.236 0 O-C-N 120.814 -1.403 . . . . 2.67 110.677 -169.996 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 0.6 OUTLIER -69.46 -32.85 54.63 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.328 0 CA-C-O 118.809 -0.615 . . . . 0.44 112.571 178.894 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 9.3 t60 -59.94 -58.51 8.23 Favored 'General case' 0 CA--C 1.53 0.21 0 N-CA-C 107.227 -1.397 . . . . 0.64 107.227 175.775 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 1.5 mp0 -51.37 -44.55 62.16 Favored 'General case' 0 C--O 1.226 -0.135 0 C-N-CA 124.154 0.982 . . . . 4.04 110.634 176.697 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 18' ' ' PHE . . . . . 0.453 ' O ' HG23 ' A' ' 22' ' ' VAL . 0.2 OUTLIER -54.2 -52.17 62.09 Favored 'General case' 0 CA--C 1.517 -0.322 0 C-N-CA 123.582 0.753 . . . . 2.61 109.505 179.884 . . . . . . . . 3 3 . 1 . 030 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -45.97 -49.05 13.88 Favored Glycine 0 CA--C 1.524 0.646 0 N-CA-C 110.808 -0.917 . . . . 0.48 110.808 174.435 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 4.3 t-80 -59.16 -47.06 86.68 Favored 'General case' 0 N--CA 1.452 -0.346 0 O-C-N 122.015 -0.697 . . . . 1.83 111.393 179.209 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -61.03 -32.66 72.27 Favored 'General case' 0 N--CA 1.453 -0.294 0 O-C-N 121.635 -0.666 . . . . 0.82 110.47 178.438 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 22' ' ' VAL . . . . . 0.582 HG22 HG21 ' A' ' 103' ' ' ILE . 40.4 t -67.63 -35.28 72.39 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.267 0 O-C-N 121.235 -0.915 . . . . 0.93 110.393 178.271 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 8.0 t0 -59.3 -29.59 67.72 Favored 'General case' 0 N--CA 1.451 -0.391 0 CA-C-O 121.506 0.669 . . . . 1.9 110.983 176.611 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 26.8 t0 -73.87 -47.21 39.74 Favored 'General case' 0 N--CA 1.454 -0.254 0 N-CA-C 108.927 -0.768 . . . . 2.49 108.927 -176.411 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 33.6 t80 -49.97 -48.76 51.97 Favored 'General case' 0 CA--C 1.521 -0.141 0 CA-C-N 115.855 -0.612 . . . . 3.05 109.429 170.788 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 26' ' ' ALA . . . . . 0.48 ' HB1' ' HB ' ' A' ' 38' ' ' VAL . . . -58.98 -37.22 76.31 Favored 'General case' 0 N--CA 1.443 -0.789 0 CA-C-O 118.492 -0.766 . . . . 1.04 112.31 -179.264 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -77.11 -18.84 78.06 Favored Glycine 0 CA--C 1.526 0.766 0 CA-C-N 118.944 0.793 . . . . 1.11 112.209 -178.189 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 1.1 t80 -81.95 -49.93 9.73 Favored 'General case' 0 N--CA 1.452 -0.354 0 O-C-N 121.783 -0.834 . . . . 3.01 109.474 175.246 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -72.27 -43.9 63.62 Favored 'General case' 0 CA--C 1.514 -0.436 0 C-N-CA 124.503 1.121 . . . . 2.23 112.145 -175.83 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 5.7 mt -109.76 143.94 38.88 Favored 'General case' 0 N--CA 1.441 -0.886 0 N-CA-C 104.319 -2.474 . . . . 2.27 104.319 -176.965 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 30.1 m-20 71.96 -64.49 0.39 Allowed 'General case' 0 CA--C 1.535 0.39 0 C-N-CA 124.283 1.033 . . . . 5.56 110.845 -179.015 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 2.6 tmmm? 73.87 62.64 0.08 Allowed 'General case' 0 CA--C 1.518 -0.288 0 C-N-CA 126.702 2.001 . . . . 9.31 108.962 175.127 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 57.2 t30 -154.61 157.79 38.73 Favored 'General case' 0 N--CA 1.45 -0.466 0 CA-C-N 116.06 -0.518 . . . . 6.01 109.95 175.263 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 4.0 tt0 -81.02 15.45 1.85 Allowed 'General case' 0 CA--C 1.536 0.439 0 N-CA-C 112.796 0.665 . . . . 10.29 112.796 -172.744 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 64.1 p -143.96 23.88 1.69 Allowed 'General case' 0 C--O 1.23 0.061 0 CA-C-N 119.058 0.845 . . . . 5.19 111.703 178.843 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 2.7 m-20 -138.47 125.29 21.04 Favored 'General case' 0 N--CA 1.453 -0.284 0 N-CA-C 105.241 -2.133 . . . . 8.77 105.241 -170.194 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 4.7 mp -147.2 167.3 24.55 Favored 'General case' 0 CA--C 1.534 0.356 0 N-CA-C 107.968 -1.123 . . . . 3.8 107.968 -167.617 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 38' ' ' VAL . . . . . 0.48 ' HB ' ' HB1' ' A' ' 26' ' ' ALA . 4.3 p -94.69 42.85 0.09 OUTLIER 'Isoleucine or valine' 0 N--CA 1.467 0.406 0 O-C-N 120.41 -1.431 . . . . 4.39 110.496 -172.986 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 1.3 t -116.05 -47.03 2.79 Favored 'General case' 0 N--CA 1.45 -0.446 0 C-N-CA 124.621 1.168 . . . . 4.38 108.424 174.338 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 22.6 p-10 -111.11 83.46 1.77 Allowed 'General case' 0 N--CA 1.441 -0.897 0 N-CA-C 107.582 -1.266 . . . . 5.57 107.582 -163.283 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 31.0 t -97.55 -174.2 2.85 Favored 'General case' 0 CA--C 1.533 0.323 0 N-CA-C 109.425 -0.583 . . . . 4.72 109.425 177.713 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 24.47 95.42 0.0 OUTLIER 'General case' 0 N--CA 1.469 0.524 0 C-N-CA 128.981 2.913 . . . . 7.19 113.777 -178.022 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 29.4 tptt 70.09 10.83 7.51 Favored 'General case' 0 N--CA 1.463 0.218 0 C-N-CA 125.199 1.4 . . . . 13.62 111.479 -173.205 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 74.4 m-85 55.58 28.18 11.52 Favored 'General case' 0 N--CA 1.451 -0.402 0 C-N-CA 125.315 1.446 . . . . 7.01 112.049 -177.375 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 45' ' ' ILE . . . . . 0.42 ' CG1' ' HE3' ' A' ' 49' ' ' LYS . 2.1 tt -172.52 108.61 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.537 0.469 0 N-CA-C 108.758 -0.831 . . . . 3.06 108.758 -177.38 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 16.2 t70 -159.85 -69.34 0.08 Allowed 'General case' 0 N--CA 1.468 0.456 0 O-C-N 121.088 -1.008 . . . . 2.2 109.112 176.072 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 2.8 mm -54.69 -49.46 67.86 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.449 0 C-N-CA 125.338 1.455 . . . . 0.52 108.548 178.304 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 38.4 t80 -59.85 -26.35 65.76 Favored 'General case' 0 N--CA 1.453 -0.319 0 O-C-N 120.596 -1.315 . . . . 0.82 113.462 177.683 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 49' ' ' LYS . . . . . 0.628 ' HA ' ' HE2' ' A' ' 49' ' ' LYS . 9.0 mmpt? -70.04 -48.0 59.72 Favored 'General case' 0 CA--C 1.516 -0.339 0 O-C-N 120.095 -1.628 . . . . 1.51 110.859 -179.482 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 4.4 tp10 -87.51 -56.64 3.27 Favored 'General case' 0 CA--C 1.533 0.314 0 N-CA-C 109.039 -0.726 . . . . 2.11 109.039 -173.622 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 51' ' ' GLU . . . . . 0.465 ' OE1' ' HE3' ' A' ' 91' ' ' LYS . 19.0 mp0 -76.81 -31.87 57.25 Favored 'General case' 0 C--O 1.235 0.321 0 O-C-N 121.024 -1.048 . . . . 2.8 111.452 -175.952 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 52' ' ' GLY . . . . . 0.42 ' HA2' ' CD1' ' A' ' 66' ' ' PHE . . . -70.04 38.76 0.42 Allowed Glycine 0 CA--C 1.532 1.124 0 C-N-CA 124.997 1.284 . . . . 0.39 114.343 171.595 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 39.2 t -154.21 49.37 0.63 Allowed 'General case' 0 N--CA 1.448 -0.537 0 N-CA-C 107.234 -1.395 . . . . 1.96 107.234 153.692 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -145.34 -49.7 0.24 Allowed 'General case' 0 CA--C 1.516 -0.339 0 N-CA-C 112.644 0.609 . . . . 2.06 112.644 -177.306 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 55' ' ' LEU . . . . . 0.537 HD21 ' HB2' ' A' ' 89' ' ' ALA . 17.5 mt -60.46 -35.54 76.12 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-O 120.891 0.377 . . . . 0.35 111.047 -172.962 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER 178.28 169.58 0.78 Allowed 'General case' 0 CA--C 1.53 0.209 0 C-N-CA 125.752 1.621 . . . . 0.45 107.487 -179.307 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 26.4 m -59.16 -33.36 70.82 Favored 'General case' 0 N--CA 1.454 -0.233 0 O-C-N 121.673 -0.642 . . . . 1.04 110.633 169.93 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -59.58 -34.19 72.4 Favored 'General case' 0 C--N 1.34 0.189 0 CA-C-N 118.31 0.505 . . . . 1.35 109.992 173.114 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -67.95 -9.91 57.67 Favored Glycine 0 C--O 1.22 -0.741 0 CA-C-O 119.074 -0.848 . . . . 0.42 111.836 178.184 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 41.3 ttt180 -107.77 -8.92 15.9 Favored 'General case' 0 N--CA 1.454 -0.237 0 CA-C-N 119.082 1.441 . . . . 3.5 112.582 178.084 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 68.7 p -69.45 -126.34 0.0 OUTLIER 'General case' 0 CA--C 1.537 0.461 0 CA-C-N 118.404 0.547 . . . . 1.08 111.196 179.456 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 4.2 t-20 -75.13 148.65 39.49 Favored 'General case' 0 N--CA 1.45 -0.43 0 O-C-N 120.081 -1.637 . . . . 1.83 107.497 176.156 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 30.7 tt0 -60.61 -31.98 71.12 Favored 'General case' 0 CA--C 1.538 0.5 0 CA-C-O 121.828 0.823 . . . . 3.26 110.37 179.425 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -61.36 -34.45 75.32 Favored 'General case' 0 CA--C 1.53 0.192 0 O-C-N 121.172 -0.955 . . . . 0.55 113.105 173.542 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 4.6 mt-10 -77.55 -39.27 46.48 Favored 'General case' 0 C--O 1.222 -0.378 0 O-C-N 121.016 -1.053 . . . . 2.07 110.137 179.246 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 66' ' ' PHE . . . . . 0.42 ' CD1' ' HA2' ' A' ' 52' ' ' GLY . 43.7 t80 -50.34 -45.66 55.16 Favored 'General case' 0 CA--C 1.532 0.253 0 C-N-CA 124.775 1.23 . . . . 0.41 110.959 170.434 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 72.1 t80 -65.86 -43.96 86.85 Favored 'General case' 0 CA--C 1.533 0.309 0 O-C-N 120.994 -1.067 . . . . 0.48 111.758 175.311 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -62.96 -53.98 45.63 Favored 'General case' 0 CA--C 1.537 0.449 0 O-C-N 121.381 -0.824 . . . . 0.41 112.002 -174.369 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -55.94 -40.97 73.94 Favored 'General case' 0 C--N 1.332 -0.182 0 O-C-N 120.92 -1.112 . . . . 3.89 111.299 169.868 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -55.99 -40.17 72.93 Favored 'General case' 0 C--O 1.223 -0.297 0 CA-C-N 119.122 0.874 . . . . 0.4 110.844 177.471 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 56.9 t80 -58.06 -49.93 75.19 Favored 'General case' 0 C--O 1.233 0.224 0 CA-C-N 119.683 1.129 . . . . 3.32 111.504 174.316 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 48.3 ttt180 -49.56 -53.8 21.66 Favored 'General case' 0 N--CA 1.467 0.377 0 N-CA-C 109.322 -0.621 . . . . 2.08 109.322 177.605 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 73' ' ' LEU . . . . . 0.553 ' HB3' HG21 ' A' ' 85' ' ' VAL . 0.1 OUTLIER -65.38 -34.24 77.84 Favored 'General case' 0 C--N 1.327 -0.392 0 C-N-CA 124.187 0.995 . . . . 0.43 110.289 -175.851 . . . . . . . . 3 3 . 1 . 030 nuclear build full ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER -60.04 -42.37 94.3 Favored 'General case' 0 C--N 1.333 -0.139 0 C-N-CA 123.77 0.828 . . . . 2.36 110.939 -176.341 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 9.3 p80 -95.13 -4.99 45.14 Favored 'General case' 0 N--CA 1.457 -0.113 0 CA-C-O 116.964 -1.493 . . . . 0.86 113.365 -178.306 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 12.4 m -40.92 126.29 2.48 Favored 'General case' 0 N--CA 1.452 -0.34 0 CA-C-O 123.222 1.487 . . . . 1.04 110.806 -168.349 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 1.1 p -52.82 -42.19 64.89 Favored 'General case' 0 N--CA 1.447 -0.584 0 CA-C-N 112.642 -2.072 . . . . 0.95 108.8 179.481 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 62.3 t0 -72.55 111.68 7.94 Favored 'General case' 0 N--CA 1.451 -0.414 0 CA-C-O 122.089 0.947 . . . . 2.07 108.673 168.885 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 4.2 t-160 -54.3 -33.05 57.91 Favored 'General case' 0 CA--C 1.532 0.268 0 CA-C-N 115.738 -0.665 . . . . 5.62 109.802 176.899 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -56.87 -52.19 66.1 Favored 'General case' 0 N--CA 1.451 -0.4 0 CA-C-N 117.904 0.32 . . . . 0.65 110.708 176.672 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 5.2 mt-10 -52.12 -39.57 60.06 Favored 'General case' 0 CA--C 1.514 -0.428 0 C-N-CA 123.365 0.666 . . . . 2.86 110.966 -177.59 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 2.4 mtp180 -61.92 -53.54 54.36 Favored 'General case' 0 N--CA 1.448 -0.546 0 C-N-CA 119.971 -0.692 . . . . 2.7 109.738 176.864 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 1.3 mm? -61.01 -24.53 66.23 Favored 'General case' 0 N--CA 1.453 -0.294 0 CA-C-O 117.421 -1.276 . . . . 0.53 112.936 177.655 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 2.0 mptm? -63.73 -43.11 97.5 Favored 'General case' 0 CA--C 1.522 -0.131 0 CA-C-N 121.499 1.954 . . . . 1.17 107.981 173.882 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 85' ' ' VAL . . . . . 0.553 HG21 ' HB3' ' A' ' 73' ' ' LEU . 99.7 t -64.13 -63.3 0.89 Allowed 'Isoleucine or valine' 0 C--O 1.214 -0.808 0 CA-C-O 118.437 -0.792 . . . . 0.45 110.009 173.233 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -49.44 -38.57 29.88 Favored 'General case' 0 CA--C 1.532 0.256 0 CA-C-N 120.325 1.42 . . . . 2.05 112.277 -172.492 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 22.7 tttt -64.52 -58.98 4.88 Favored 'General case' 0 N--CA 1.45 -0.439 0 C-N-CA 124.81 1.244 . . . . 2.02 110.833 174.025 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 61.6 m-20 -80.48 2.37 25.54 Favored 'General case' 0 CA--C 1.535 0.373 0 C-N-CA 123.505 0.722 . . . . 1.11 111.815 -173.733 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 89' ' ' ALA . . . . . 0.537 ' HB2' HD21 ' A' ' 55' ' ' LEU . . . -156.66 73.63 4.74 Favored Pre-proline 0 N--CA 1.446 -0.639 0 C-N-CA 126.802 2.041 . . . . 0.5 108.012 -175.387 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 62.1 Cg_endo -80.69 60.81 8.01 Favored 'Trans proline' 0 N--CA 1.454 -0.824 0 C-N-CA 124.057 3.171 . . . . 1.96 109.351 -179.837 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 91' ' ' LYS . . . . . 0.465 ' HE3' ' OE1' ' A' ' 51' ' ' GLU . 0.0 OUTLIER 171.28 -56.81 0.01 OUTLIER 'General case' 0 C--O 1.224 -0.269 0 C-N-CA 126.411 1.884 . . . . 2.36 110.466 -170.345 . . . . . . . . 3 3 . 1 . 030 nuclear build full ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 1.4 m -53.69 -46.01 70.56 Favored 'General case' 0 N--CA 1.466 0.373 0 CA-C-N 119.95 1.25 . . . . 0.43 110.75 -179.534 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 8.6 t80 -61.21 -46.34 90.87 Favored 'General case' 0 CA--C 1.509 -0.599 0 CA-C-O 121.653 0.74 . . . . 2.46 110.187 178.852 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 8.1 tt0 -58.53 -30.95 67.48 Favored 'General case' 0 N--CA 1.441 -0.902 0 CA-C-N 114.482 -1.236 . . . . 1.81 110.126 -178.538 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -63.99 -68.74 0.32 Allowed 'General case' 0 N--CA 1.452 -0.349 0 C-N-CA 124.634 1.174 . . . . 1.02 108.753 -177.666 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 96' ' ' ILE . . . . . 0.447 HD12 ' H ' ' A' ' 96' ' ' ILE . 3.8 mp -49.86 -43.38 19.59 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.217 0 C-N-CA 123.457 0.703 . . . . 0.86 109.743 176.653 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 13.0 t30 -61.03 -35.42 76.83 Favored 'General case' 0 CA--C 1.531 0.241 0 O-C-N 121.961 -0.462 . . . . 1.37 111.94 -177.418 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 23.1 t70 -60.41 -44.57 95.6 Favored 'General case' 0 CA--C 1.516 -0.362 0 C-N-CA 123.499 0.719 . . . . 2.12 109.624 173.777 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 2.3 mp0 -81.35 77.99 8.17 Favored 'General case' 0 N--CA 1.444 -0.772 0 CA-C-O 121.622 0.725 . . . . 3.82 109.153 179.013 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 9.8 tp -47.86 133.72 4.94 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.339 0 C-N-CA 124.746 1.219 . . . . 4.01 109.753 179.869 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 1.4 tmtp? -64.08 96.56 0.15 Allowed 'General case' 0 N--CA 1.462 0.142 0 N-CA-C 109.219 -0.66 . . . . 11.39 109.219 -173.22 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 102' ' ' PHE . . . . . . . . . . . . . 1.0 OUTLIER -103.11 -29.24 11.46 Favored 'General case' 0 CA--C 1.529 0.168 0 C-N-CA 123.934 0.893 . . . . 7.05 111.028 -175.414 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 103' ' ' ILE . . . . . 0.582 HG21 HG22 ' A' ' 22' ' ' VAL . 0.0 OUTLIER -64.77 140.54 19.55 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.424 0 C-N-CA 123.512 0.725 . . . . 4.17 109.496 -179.34 . . . . . . . . 3 3 . 1 . 030 nuclear build full ' A' A ' 104' ' ' ILE . . . . . 0.514 ' N ' HD13 ' A' ' 103' ' ' ILE . 48.8 mt -103.22 -85.47 0.18 Allowed 'Isoleucine or valine' 0 CA--C 1.534 0.351 0 N-CA-C 107.798 -1.186 . . . . 5.81 107.798 -176.384 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 10.2 t30 72.25 101.88 0.07 Allowed 'General case' 0 N--CA 1.464 0.226 0 C-N-CA 127.236 2.215 . . . . 9.81 111.57 -177.329 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 15.0 p . . . . . 0 C--O 1.246 0.909 0 N-CA-C 107.139 -1.43 . . . . 9.56 107.139 -175.575 . . . . . . . . 0 0 . 1 . 031 nuclear build full ' A' A ' 1' ' ' GLY . . . . . 0.47 ' CA ' ' OE2' ' A' ' 65' ' ' GLU . . . . . . . . 0 N--CA 1.467 0.735 0 N-CA-C 110.227 -1.149 . . . . 15.11 110.227 . . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 22.5 m -153.37 -36.51 0.1 Allowed 'General case' 0 C--N 1.332 -0.172 0 CA-C-N 117.281 0.541 . . . . 17.21 111.742 -177.748 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -137.69 168.09 20.37 Favored 'General case' 0 N--CA 1.45 -0.45 0 N-CA-C 107.373 -1.343 . . . . 18.68 107.373 173.18 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 164.05 -173.37 40.07 Favored Glycine 0 N--CA 1.452 -0.282 0 N-CA-C 109.652 -1.379 . . . . 16.99 109.652 179.803 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 5' ' ' VAL . . . . . 0.56 HG23 HD11 ' A' ' 7' ' ' LEU . 3.1 m -79.09 -166.11 0.08 OUTLIER 'Isoleucine or valine' 0 N--CA 1.45 -0.442 0 N-CA-C 108.426 -0.953 . . . . 18.25 108.426 164.893 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 10.6 pt-20 -111.47 101.16 9.61 Favored 'General case' 0 N--CA 1.453 -0.314 0 CA-C-O 122.434 1.112 . . . . 13.67 111.068 -173.624 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 7' ' ' LEU . . . . . 0.56 HD11 HG23 ' A' ' 5' ' ' VAL . 0.1 OUTLIER -115.01 54.6 0.78 Allowed 'General case' 0 N--CA 1.448 -0.561 0 N-CA-C 106.543 -1.651 . . . . 11.99 106.543 -179.145 . . . . . . . . 3 3 . 1 . 031 nuclear build full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 25.5 mtp85 51.93 56.61 7.54 Favored 'General case' 0 C--O 1.224 -0.244 0 CA-C-N 114.969 -1.014 . . . . 6.3 111.391 -175.667 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 2.4 m120 -51.97 -31.25 28.33 Favored 'General case' 0 C--O 1.224 -0.275 0 O-C-N 120.805 -1.184 . . . . 6.0 112.564 177.207 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -66.56 -49.13 67.46 Favored 'General case' 0 N--CA 1.446 -0.673 0 O-C-N 121.289 -0.882 . . . . 3.19 112.783 178.446 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 43.9 m -84.34 -52.98 5.78 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-O 122.157 0.979 . . . . 2.18 108.888 -172.581 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 1.1 mp0 -89.64 -26.33 20.81 Favored 'General case' 0 C--N 1.325 -0.457 0 C-N-CA 124.255 1.022 . . . . 3.75 109.937 -173.881 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -78.96 -37.02 26.68 Favored Glycine 0 C--O 1.221 -0.668 0 N-CA-C 109.615 -1.394 . . . . 0.72 109.615 178.671 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 49.7 t80 -52.33 -61.04 2.53 Favored 'General case' 0 N--CA 1.463 0.204 0 CA-C-N 119.462 1.631 . . . . 4.12 110.685 172.723 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 15' ' ' ILE . . . . . 0.412 HD12 ' CE1' ' A' ' 75' ' ' HIS . 1.2 pt -63.05 -33.18 59.27 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.449 0 O-C-N 121.151 -0.968 . . . . 0.61 112.093 -178.488 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 2.6 t-160 -58.49 -49.27 77.98 Favored 'General case' 0 CA--C 1.532 0.268 0 N-CA-C 107.69 -1.226 . . . . 0.84 107.69 174.903 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 40.1 mt-10 -61.01 -36.56 79.82 Favored 'General case' 0 C--O 1.218 -0.554 0 C-N-CA 124.168 0.987 . . . . 2.73 109.752 -178.195 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 4.1 t80 -55.04 -50.23 69.61 Favored 'General case' 0 CA--C 1.522 -0.099 0 CA-C-N 119.354 0.979 . . . . 3.78 110.284 171.827 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -48.35 -50.23 23.98 Favored Glycine 0 CA--C 1.524 0.615 0 N-CA-C 111.454 -0.658 . . . . 0.58 111.454 172.768 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 20' ' ' HIS . . . . . 0.445 ' NE2' ' HB1' ' A' ' 64' ' ' ALA . 2.2 t-80 -63.89 -44.93 91.51 Favored 'General case' 0 N--CA 1.45 -0.443 0 O-C-N 121.846 -0.796 . . . . 1.97 111.408 -177.533 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -55.86 -34.1 65.14 Favored 'General case' 0 N--CA 1.448 -0.536 0 C-N-CA 123.575 0.75 . . . . 0.96 109.125 -178.318 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 98.5 t -68.37 -42.37 84.13 Favored 'Isoleucine or valine' 0 N--CA 1.457 -0.101 0 C-N-CA 119.782 -0.767 . . . . 1.05 111.986 174.474 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 23' ' ' ASP . . . . . 0.464 ' O ' HG12 ' A' ' 38' ' ' VAL . 3.7 t70 -59.0 -29.6 67.36 Favored 'General case' 0 N--CA 1.465 0.312 0 CA-C-O 122.284 1.04 . . . . 2.34 111.428 173.262 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -76.26 -47.41 23.91 Favored 'General case' 0 N--CA 1.446 -0.649 0 N-CA-C 107.883 -1.154 . . . . 4.14 107.883 -173.626 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 60.2 t80 -63.48 -56.59 14.93 Favored 'General case' 0 N--CA 1.451 -0.382 0 C-N-CA 123.047 0.539 . . . . 2.63 110.353 179.839 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 26' ' ' ALA . . . . . 0.72 ' HB3' HG11 ' A' ' 38' ' ' VAL . . . -55.58 -33.89 64.31 Favored 'General case' 0 N--CA 1.453 -0.304 0 CA-C-O 118.928 -0.558 . . . . 0.97 110.882 179.645 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -63.51 -56.13 21.38 Favored Glycine 0 C--O 1.225 -0.425 0 N-CA-C 110.503 -1.039 . . . . 1.09 110.503 174.515 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -52.04 -42.82 63.41 Favored 'General case' 0 N--CA 1.455 -0.225 0 C-N-CA 124.472 1.109 . . . . 2.53 111.252 -174.54 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -79.62 -33.06 41.78 Favored 'General case' 0 N--CA 1.446 -0.645 0 C-N-CA 124.21 1.004 . . . . 1.56 112.556 -179.097 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 5.3 mt -122.36 55.14 1.16 Allowed 'General case' 0 CA--C 1.53 0.203 0 CA-C-N 118.873 0.76 . . . . 1.91 109.263 -167.114 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 14.2 t70 -139.74 162.28 35.51 Favored 'General case' 0 CA--C 1.531 0.221 0 C-N-CA 124.712 1.205 . . . . 5.77 108.307 178.074 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 32' ' ' LYS . . . . . 0.523 ' HE3' ' O ' ' A' ' 32' ' ' LYS . 0.0 OUTLIER -133.37 45.78 2.66 Favored 'General case' 0 N--CA 1.454 -0.275 0 N-CA-C 107.871 -1.159 . . . . 8.54 107.871 176.979 . . . . . . . . 3 3 . 1 . 031 nuclear build full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 3.5 t-20 -146.82 -166.23 2.44 Favored 'General case' 0 CA--C 1.537 0.458 0 C-N-CA 124.961 1.304 . . . . 6.27 107.979 -177.854 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 18.8 mm-40 -132.02 22.76 4.53 Favored 'General case' 0 CA--C 1.534 0.33 0 C-N-CA 125.827 1.651 . . . . 10.98 107.913 167.75 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 1.2 t -159.88 51.0 0.32 Allowed 'General case' 0 N--CA 1.453 -0.307 0 O-C-N 121.231 -0.918 . . . . 7.23 109.79 -179.361 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 5.6 t0 -153.2 164.39 38.16 Favored 'General case' 0 CA--C 1.531 0.231 0 N-CA-C 108.906 -0.775 . . . . 7.41 108.906 172.517 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 7.1 mp -133.45 176.86 8.16 Favored 'General case' 0 CA--C 1.531 0.242 0 C-N-CA 125.122 1.369 . . . . 2.56 107.945 179.152 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 38' ' ' VAL . . . . . 0.72 HG11 ' HB3' ' A' ' 26' ' ' ALA . 6.0 p -64.62 -43.3 96.71 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.262 0 C-N-CA 119.244 -0.982 . . . . 2.35 109.319 178.795 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 26.2 p 50.05 -156.95 0.09 Allowed 'General case' 0 CA--C 1.536 0.431 0 CA-C-N 119.405 1.002 . . . . 3.86 110.828 -175.118 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 6.8 p-10 -68.22 -21.58 64.84 Favored 'General case' 0 CA--C 1.532 0.253 0 O-C-N 120.409 -1.432 . . . . 5.71 112.77 170.965 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 74.2 p 20.17 64.71 0.02 OUTLIER 'General case' 0 N--CA 1.469 0.49 0 C-N-CA 127.02 2.128 . . . . 3.58 114.237 -172.21 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -149.68 130.54 14.23 Favored 'General case' 0 CA--C 1.518 -0.267 0 N-CA-C 107.803 -1.184 . . . . 7.8 107.803 -177.331 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 4.1 tttt 27.17 61.84 0.09 Allowed 'General case' 0 N--CA 1.467 0.412 0 C-N-CA 128.141 2.576 . . . . 8.06 111.847 177.446 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 0.8 OUTLIER 40.14 72.17 0.16 Allowed 'General case' 0 CA--C 1.533 0.31 0 C-N-CA 125.103 1.361 . . . . 5.97 111.922 177.002 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . 0.264 28.0 pt 48.27 94.52 0.01 OUTLIER 'Isoleucine or valine' 0 C--O 1.222 -0.387 0 C-N-CA 126.402 1.881 . . . . 2.56 111.781 -173.435 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 45.9 t0 -120.74 -66.0 1.1 Allowed 'General case' 0 C--N 1.334 -0.105 0 C-N-CA 124.258 1.023 . . . . 2.48 108.817 -171.183 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 7.1 mm -50.2 -54.44 8.44 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.523 0 C-N-CA 125.32 1.448 . . . . 0.44 109.202 174.387 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 30.4 t80 -61.83 -26.5 68.16 Favored 'General case' 0 CA--C 1.531 0.245 0 O-C-N 120.927 -1.108 . . . . 0.38 113.232 179.578 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 49' ' ' LYS . . . . . 0.573 ' HA ' ' HE2' ' A' ' 49' ' ' LYS . 9.6 mmpt? -72.24 -45.01 62.01 Favored 'General case' 0 CA--C 1.516 -0.347 0 O-C-N 119.675 -1.891 . . . . 1.21 111.684 -175.513 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -86.72 -64.68 1.11 Allowed 'General case' 0 C--N 1.328 -0.349 0 N-CA-C 106.774 -1.565 . . . . 3.71 106.774 -177.701 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 15.0 mm-40 -65.09 -36.05 83.09 Favored 'General case' 0 N--CA 1.452 -0.367 0 CA-C-N 115.677 -0.692 . . . . 2.16 110.165 -170.925 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 52' ' ' GLY . . . . . 0.452 ' HA2' ' CD1' ' A' ' 66' ' ' PHE . . . -69.07 37.6 0.3 Allowed Glycine 0 CA--C 1.527 0.82 0 C-N-CA 125.582 1.563 . . . . 0.29 114.44 171.761 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 11.2 t -147.71 23.4 1.11 Allowed 'General case' 0 N--CA 1.451 -0.401 0 O-C-N 121.047 -1.267 . . . . 1.82 110.47 155.592 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 13.7 t30 -134.11 -23.13 1.75 Allowed 'General case' 0 C--N 1.342 0.28 0 N-CA-C 113.958 1.096 . . . . 1.78 113.958 -164.1 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 55' ' ' LEU . . . . . 0.563 HD22 HG22 ' A' ' 85' ' ' VAL . 14.6 mt -76.91 -37.02 56.21 Favored 'General case' 0 C--O 1.226 -0.144 0 O-C-N 121.891 -0.505 . . . . 0.45 110.571 176.124 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER 178.2 169.91 0.76 Allowed 'General case' 0 CA--C 1.532 0.273 0 C-N-CA 125.795 1.638 . . . . 0.61 107.096 -175.796 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 7.2 m -60.11 -33.88 72.72 Favored 'General case' 0 N--CA 1.454 -0.266 0 O-C-N 121.708 -0.62 . . . . 1.2 110.721 168.596 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -67.77 -9.11 41.27 Favored 'General case' 0 N--CA 1.467 0.41 0 N-CA-C 112.328 0.492 . . . . 1.47 112.328 174.498 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -87.83 -3.91 79.67 Favored Glycine 0 C--O 1.221 -0.683 0 CA-C-O 118.472 -1.182 . . . . 0.44 111.09 173.366 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 3.6 ttp85 -118.0 -7.97 10.8 Favored 'General case' 0 CA--C 1.53 0.183 0 CA-C-N 119.292 1.546 . . . . 3.53 112.253 -177.155 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 25.4 p -67.39 -148.13 0.01 OUTLIER 'General case' 0 CA--C 1.537 0.477 0 C-N-CA 124.958 1.303 . . . . 0.89 109.079 172.165 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 3.7 m120 -56.7 143.77 35.12 Favored 'General case' 0 N--CA 1.455 -0.176 0 O-C-N 119.753 -1.842 . . . . 2.53 109.176 176.049 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 15.6 tm-20 -57.04 -32.86 66.62 Favored 'General case' 0 C--O 1.223 -0.338 0 CA-C-O 121.538 0.685 . . . . 3.58 110.078 178.086 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 64' ' ' ALA . . . . . 0.445 ' HB1' ' NE2' ' A' ' 20' ' ' HIS . . . -56.62 -35.37 68.22 Favored 'General case' 0 N--CA 1.45 -0.466 0 O-C-N 121.357 -0.839 . . . . 0.63 112.676 176.332 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 65' ' ' GLU . . . . . 0.47 ' OE2' ' CA ' ' A' ' 1' ' ' GLY . 8.9 mt-10 -75.62 -42.18 52.38 Favored 'General case' 0 CA--C 1.512 -0.485 0 O-C-N 121.4 -0.812 . . . . 2.09 110.834 175.184 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 66' ' ' PHE . . . . . 0.452 ' CD1' ' HA2' ' A' ' 52' ' ' GLY . 37.4 t80 -49.47 -56.49 9.57 Favored 'General case' 0 N--CA 1.454 -0.275 0 C-N-CA 123.782 0.833 . . . . 0.36 110.818 175.104 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 90.5 t80 -62.14 -48.37 80.43 Favored 'General case' 0 N--CA 1.451 -0.424 0 C-N-CA 123.19 0.596 . . . . 0.46 110.686 179.697 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -59.02 -39.4 81.81 Favored 'General case' 0 CA--C 1.544 0.737 0 O-C-N 121.112 -0.992 . . . . 0.3 112.54 -178.113 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 37.4 mm-40 -64.37 -42.21 96.31 Favored 'General case' 0 CA--C 1.518 -0.288 0 C-N-CA 124.563 1.145 . . . . 4.58 109.901 172.314 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -53.69 -43.05 68.6 Favored 'General case' 0 N--CA 1.449 -0.477 0 CA-C-O 118.282 -0.866 . . . . 0.42 109.694 178.485 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 10.8 t80 -59.15 -49.48 77.7 Favored 'General case' 0 N--CA 1.463 0.211 0 CA-C-N 119.437 1.017 . . . . 2.2 111.898 173.13 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -50.27 -55.95 13.26 Favored 'General case' 0 CA--C 1.531 0.223 0 O-C-N 121.588 -0.695 . . . . 2.47 110.408 179.301 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 73' ' ' LEU . . . . . 0.722 HD12 HG23 ' A' ' 85' ' ' VAL . 0.2 OUTLIER -63.66 -30.56 71.65 Favored 'General case' 0 C--N 1.325 -0.495 0 C-N-CA 125.819 1.648 . . . . 0.42 110.846 -179.756 . . . . . . . . 3 3 . 1 . 031 nuclear build full ' A' A ' 74' ' ' MET . . . . . 0.452 ' HA ' ' CE2' ' A' ' 93' ' ' PHE . 1.1 tmt? -61.97 -39.92 93.82 Favored 'General case' 0 N--CA 1.451 -0.378 0 C-N-CA 123.281 0.632 . . . . 2.58 111.976 -177.364 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 75' ' ' HIS . . . . . 0.412 ' CE1' HD12 ' A' ' 15' ' ' ILE . 27.6 p80 -90.06 -45.97 8.8 Favored 'General case' 0 C--O 1.225 -0.225 0 CA-C-O 116.758 -1.592 . . . . 1.11 110.064 179.992 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 14.8 m 5.4 111.1 0.0 OUTLIER 'General case' 0 N--CA 1.469 0.492 0 C-N-CA 129.09 2.956 . . . . 1.06 114.719 -174.514 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 3.1 p -46.47 -44.58 17.63 Favored 'General case' 0 C--O 1.235 0.325 0 C-N-CA 125.38 1.472 . . . . 1.07 110.837 179.417 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 11.3 t0 -66.17 104.31 1.15 Allowed 'General case' 0 N--CA 1.449 -0.482 0 N-CA-C 108.673 -0.862 . . . . 2.18 108.673 167.279 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 41.4 m80 -55.86 -30.96 62.32 Favored 'General case' 0 N--CA 1.454 -0.26 0 CA-C-O 118.994 -0.527 . . . . 5.42 111.084 176.747 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -58.13 -50.95 71.69 Favored 'General case' 0 N--CA 1.446 -0.668 0 CA-C-O 117.937 -1.03 . . . . 0.6 109.767 176.708 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 1.9 mt-10 -46.89 -41.2 15.47 Favored 'General case' 0 N--CA 1.464 0.236 0 CA-C-N 119.583 1.083 . . . . 3.1 111.083 179.128 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -62.94 -51.66 66.06 Favored 'General case' 0 C--N 1.327 -0.383 0 N-CA-C 109.359 -0.608 . . . . 3.01 109.359 179.149 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 1.7 mm? -66.56 -18.97 65.66 Favored 'General case' 0 N--CA 1.453 -0.301 0 CA-C-O 118.11 -0.948 . . . . 0.47 113.261 176.922 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 2.0 mptm? -65.56 -48.51 72.14 Favored 'General case' 0 CA--C 1.518 -0.279 0 CA-C-N 120.629 1.559 . . . . 1.26 106.805 169.346 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 85' ' ' VAL . . . . . 0.722 HG23 HD12 ' A' ' 73' ' ' LEU . 45.6 t -63.9 -46.57 93.8 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.663 0 CA-C-O 117.482 -1.247 . . . . 0.45 111.809 177.955 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 30.3 mt-30 -60.9 -52.23 65.91 Favored 'General case' 0 N--CA 1.462 0.126 0 CA-C-N 122.114 2.233 . . . . 2.14 111.261 179.61 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -65.13 -40.46 94.5 Favored 'General case' 0 CA--C 1.532 0.254 0 O-C-N 121.654 -0.653 . . . . 2.39 110.463 -172.717 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 6.9 m-20 -75.32 -21.75 58.18 Favored 'General case' 0 C--O 1.226 -0.172 0 CA-C-O 118.772 -0.632 . . . . 0.9 110.771 177.948 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 89' ' ' ALA . . . . . 0.442 ' HB2' HD21 ' A' ' 55' ' ' LEU . . . -143.54 77.29 15.41 Favored Pre-proline 0 C--O 1.237 0.444 0 C-N-CA 124.15 0.98 . . . . 0.33 110.217 -173.238 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 94.2 Cg_endo -79.75 66.67 8.77 Favored 'Trans proline' 0 N--CA 1.453 -0.856 0 C-N-CA 124.024 3.15 . . . . 1.94 109.8 -173.27 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER 168.34 -53.07 0.01 OUTLIER 'General case' 0 C--O 1.224 -0.273 0 C-N-CA 126.923 2.089 . . . . 2.22 111.234 -171.718 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 4.3 m -55.38 -47.02 76.47 Favored 'General case' 0 N--CA 1.466 0.338 0 CA-C-N 120.19 1.359 . . . . 0.46 110.567 -177.525 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 93' ' ' PHE . . . . . 0.452 ' CE2' ' HA ' ' A' ' 74' ' ' MET . 8.2 t80 -59.92 -48.11 83.03 Favored 'General case' 0 CA--C 1.511 -0.528 0 CA-C-O 121.552 0.691 . . . . 1.87 110.163 178.278 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 8.3 tt0 -56.76 -31.31 64.47 Favored 'General case' 0 N--CA 1.441 -0.875 0 CA-C-N 114.602 -1.181 . . . . 1.91 110.163 -178.019 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 7.1 t80 -64.86 -56.25 14.54 Favored 'General case' 0 N--CA 1.453 -0.319 0 C-N-CA 124.02 0.928 . . . . 1.12 109.798 -176.362 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 2.9 mp -57.93 -44.62 87.04 Favored 'Isoleucine or valine' 0 N--CA 1.457 -0.119 0 N-CA-C 108.44 -0.948 . . . . 0.85 108.44 177.321 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 24.3 t30 -60.61 -31.8 70.95 Favored 'General case' 0 CA--C 1.532 0.273 0 C-N-CA 122.285 0.234 . . . . 1.45 111.544 -177.427 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -63.8 -46.29 85.83 Favored 'General case' 0 CA--C 1.521 -0.145 0 C-N-CA 124.552 1.141 . . . . 2.64 109.17 176.086 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 80.5 mm-40 -83.09 63.56 7.2 Favored 'General case' 0 N--CA 1.452 -0.342 0 CA-C-O 122.082 0.944 . . . . 3.1 110.168 178.309 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 8.5 tp -71.36 83.29 0.29 Allowed 'Isoleucine or valine' 0 CA--C 1.537 0.476 0 C-N-CA 124.302 1.041 . . . . 4.2 110.698 -177.324 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 4.3 mtpt -138.76 171.5 14.25 Favored 'General case' 0 C--N 1.334 -0.086 0 O-C-N 121.072 -1.017 . . . . 8.81 108.698 170.32 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 102' ' ' PHE . . . . . . . . . . . . . 34.4 p90 -128.87 166.9 18.19 Favored 'General case' 0 N--CA 1.45 -0.434 0 N-CA-C 106.872 -1.529 . . . . 7.55 106.872 172.091 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -136.91 111.22 9.65 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.532 0 N-CA-C 106.989 -1.485 . . . . 4.45 106.989 176.208 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 104' ' ' ILE . . . . . . . . . . . . . 49.0 mt 61.32 163.35 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.539 0.532 0 C-N-CA 124.595 1.158 . . . . 6.8 111.295 -174.257 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 19.4 t-20 -150.15 119.8 7.01 Favored 'General case' 0 N--CA 1.451 -0.419 0 N-CA-C 106.39 -1.707 . . . . 9.12 106.39 174.47 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 15.7 p . . . . . 0 C--O 1.254 1.314 0 CA-C-O 114.24 -2.79 . . . . 11.03 107.574 -170.855 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 1.8 t80 . . . . . 0 C--O 1.224 -0.271 0 N-CA-C 110.755 -0.091 . . . . 2.3199999999999998 110.755 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 1.8 pt -71.94 -29.91 35.0 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.299 0 N-CA-C 113.349 0.87 . . . . 0.57999999999999996 113.349 176.666 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 4.9 t60 -59.67 -57.65 12.02 Favored 'General case' 0 CA--C 1.533 0.297 0 N-CA-C 106.6 -1.63 . . . . 0.55000000000000004 106.6 174.662 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 28.1 mt-10 -48.1 -45.09 32.41 Favored 'General case' 0 C--O 1.223 -0.311 0 C-N-CA 126.631 1.972 . . . . 2.6499999999999999 110.368 174.55 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 1.4 t80 -59.23 -48.15 82.69 Favored 'General case' 0 CA--C 1.519 -0.239 0 C-N-CA 123.421 0.688 . . . . 2.0299999999999998 110.184 179.857 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -51.34 -45.18 52.93 Favored Glycine 0 CA--C 1.523 0.553 0 N-CA-C 110.476 -1.05 . . . . 0.44 110.476 171.835 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 20' ' ' HIS . . . . . 0.463 ' CE1' ' HB1' ' A' ' 64' ' ' ALA . 3.9 t60 -64.42 -34.05 77.29 Favored 'General case' 0 N--CA 1.45 -0.451 0 O-C-N 121.628 -0.925 . . . . 1.8999999999999999 111.826 179.689 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -71.29 -30.09 65.84 Favored 'General case' 0 N--CA 1.454 -0.267 0 O-C-N 121.505 -0.747 . . . . 0.56999999999999995 109.884 174.594 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 60.5 t -67.25 -39.94 83.98 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.299 0 O-C-N 120.951 -1.093 . . . . 0.76000000000000001 109.641 174.55 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 15.3 t0 . . . . . 0 C--N 1.327 -0.376 0 C-N-CA 123.669 0.788 . . . . 2.02 111.468 175.465 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 3.3 t0 . . . . . 0 N--CA 1.47 0.567 0 CA-C-O 121.696 0.76 . . . . 2.5099999999999998 110.518 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 3.9 mm -54.5 -47.43 71.17 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.301 0 C-N-CA 125.372 1.469 . . . . 0.45000000000000001 108.616 -172.099 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 26.0 t80 -65.98 -37.1 85.11 Favored 'General case' 0 N--CA 1.449 -0.511 0 O-C-N 121.7 -0.625 . . . . 0.42999999999999999 112.315 176.792 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . 0.488 ' CA ' ' HE2' ' A' ' 49' ' ' LYS . 0.0 OUTLIER -64.27 -45.74 86.75 Favored 'General case' 0 CA--C 1.514 -0.432 0 C-N-CA 118.007 -1.477 . . . . 1.3799999999999999 111.244 -172.735 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 5.4 tp10 -84.31 -66.22 0.92 Allowed 'General case' 0 N--CA 1.446 -0.626 0 N-CA-C 108.242 -1.022 . . . . 2.0499999999999998 108.242 -177.919 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 9.2 mm-40 -69.94 -32.13 70.24 Favored 'General case' 0 CA--C 1.533 0.29 0 O-C-N 121.439 -0.788 . . . . 2.04 110.555 -169.052 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -68.89 37.04 0.29 Allowed Glycine 0 CA--C 1.529 0.931 0 C-N-CA 125.992 1.758 . . . . 0.29999999999999999 114.546 172.154 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 76.7 p -140.03 17.71 2.46 Favored 'General case' 0 N--CA 1.448 -0.546 0 O-C-N 121.224 -1.162 . . . . 2.0899999999999999 111.401 160.093 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 30.4 t-20 -131.67 -39.3 1.12 Allowed 'General case' 0 C--N 1.339 0.146 0 N-CA-C 112.099 0.407 . . . . 1.5600000000000001 112.099 -162.533 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 24.6 mt -63.05 -35.87 81.68 Favored 'General case' 0 CA--C 1.533 0.299 0 O-C-N 121.745 -0.597 . . . . 0.37 110.972 -176.257 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 4.4 t 168.32 175.55 0.04 OUTLIER 'General case' 0 CA--C 1.534 0.351 0 C-N-CA 127.463 2.305 . . . . 0.91000000000000003 107.673 -179.052 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 6.9 m -59.69 -37.57 79.2 Favored 'General case' 0 N--CA 1.454 -0.249 0 C-N-CA 124.425 1.09 . . . . 0.91000000000000003 111.378 176.348 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -63.97 -28.41 69.8 Favored 'General case' 0 N--CA 1.463 0.204 0 C-N-CA 122.938 0.495 . . . . 1.04 111.258 173.233 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -68.01 -3.71 31.11 Favored Glycine 0 CA--C 1.523 0.592 0 O-C-N 121.39 -0.819 . . . . 0.40000000000000002 111.715 172.707 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 1.8 ttt180 -129.87 6.11 5.05 Favored 'General case' 0 N--CA 1.451 -0.402 0 CA-C-N 118.574 1.187 . . . . 2.1800000000000002 112.231 -174.994 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 58.2 p -75.05 -132.03 0.01 OUTLIER 'General case' 0 CA--C 1.536 0.41 0 N-CA-C 108.123 -1.066 . . . . 0.89000000000000001 108.123 169.59 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 1.5 m-20 -73.05 155.94 39.26 Favored 'General case' 0 CA--C 1.527 0.079 0 O-C-N 120.283 -1.511 . . . . 1.5800000000000001 108.447 176.238 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 35.8 tt0 -62.09 -33.48 74.51 Favored 'General case' 0 CA--C 1.534 0.345 0 C-N-CA 119.512 -0.875 . . . . 2.5600000000000001 110.463 178.531 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 64' ' ' ALA . . . . . 0.463 ' HB1' ' CE1' ' A' ' 20' ' ' HIS . . . -60.82 -21.08 62.79 Favored 'General case' 0 C--N 1.331 -0.236 0 O-C-N 121.117 -0.989 . . . . 0.64000000000000001 113.596 176.9 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 4.9 mt-10 -85.49 -49.57 7.97 Favored 'General case' 0 CA--C 1.509 -0.615 0 O-C-N 121.331 -0.856 . . . . 1.8999999999999999 110.919 171.254 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 49.8 t80 -41.11 -49.85 3.45 Favored 'General case' 0 CA--C 1.535 0.376 0 C-N-CA 123.874 0.87 . . . . 0.31 111.666 171.869 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 77.9 t80 -62.59 -47.54 83.36 Favored 'General case' 0 CA--C 1.533 0.3 0 C-N-CA 123.509 0.724 . . . . 0.38 111.314 175.674 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -59.93 -53.46 57.61 Favored 'General case' 0 CA--C 1.535 0.386 0 C-N-CA 124.15 0.98 . . . . 0.28000000000000003 112.264 -175.672 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 8.0 pt-20 -66.06 -31.07 71.73 Favored 'General case' 0 N--CA 1.451 -0.412 0 O-C-N 120.575 -1.328 . . . . 3.2400000000000002 112.079 173.527 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -59.33 -40.57 86.74 Favored 'General case' 0 N--CA 1.451 -0.391 0 CA-C-N 119.749 1.159 . . . . 0.34999999999999998 109.122 174.452 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 23.1 t80 -58.6 -51.4 70.08 Favored 'General case' 0 C--O 1.23 0.055 0 C-N-CA 124.546 1.138 . . . . 2.3100000000000001 110.92 175.002 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 26.0 ttt180 -46.39 -66.87 0.34 Allowed 'General case' 0 N--CA 1.464 0.247 0 C-N-CA 123.4 0.68 . . . . 1.8799999999999999 109.548 175.147 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 73' ' ' LEU . . . . . 0.515 ' HB3' HG21 ' A' ' 85' ' ' VAL . 0.1 OUTLIER -55.89 -35.77 66.9 Favored 'General case' 0 N--CA 1.45 -0.458 0 C-N-CA 126.19 1.796 . . . . 0.40999999999999998 109.491 -173.271 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 2.1 ttp -59.64 -37.96 80.09 Favored 'General case' 0 C--O 1.234 0.242 0 N-CA-C 112.283 0.475 . . . . 2.3999999999999999 112.283 -176.489 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 11.0 p80 -100.01 2.14 43.16 Favored 'General case' 0 CA--C 1.53 0.208 0 N-CA-C 114.459 1.281 . . . . 1.05 114.459 -177.566 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 70.3 m -49.51 128.51 17.56 Favored 'General case' 0 N--CA 1.448 -0.54 0 CA-C-N 120.43 1.468 . . . . 1.1100000000000001 112.797 -168.518 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 4.1 p -50.96 -45.51 60.79 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 112.97 -1.923 . . . . 0.97999999999999998 108.88 172.9 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 22.5 t0 -69.22 99.02 1.09 Allowed 'General case' 0 N--CA 1.449 -0.493 0 N-CA-C 107.241 -1.392 . . . . 2.2200000000000002 107.241 162.951 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 36.8 p-80 -62.86 -30.18 71.31 Favored 'General case' 0 N--CA 1.45 -0.444 0 CA-C-N 115.342 -0.845 . . . . 3.8100000000000001 112.241 -178.346 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -59.32 -39.42 83.04 Favored 'General case' 0 C--N 1.326 -0.453 0 O-C-N 121.83 -0.543 . . . . 0.68999999999999995 110.189 174.402 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 2.6 tt0 -52.91 -35.92 58.83 Favored 'General case' 0 N--CA 1.466 0.326 0 CA-C-O 121.643 0.735 . . . . 2.9900000000000002 110.483 176.817 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 18.6 mtp180 -67.57 -48.19 67.59 Favored 'General case' 0 CA--C 1.519 -0.248 0 N-CA-C 109.262 -0.644 . . . . 2.2799999999999998 109.262 179.561 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 1.5 mm? -62.89 -23.82 67.52 Favored 'General case' 0 N--CA 1.452 -0.338 0 CA-C-O 117.702 -1.142 . . . . 0.5 112.31 177.848 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 2.5 mptm? -62.09 -44.43 96.68 Favored 'General case' 0 C--O 1.225 -0.234 0 CA-C-N 120.822 1.646 . . . . 1.1899999999999999 108.349 170.282 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 85' ' ' VAL . . . . . 0.515 HG21 ' HB3' ' A' ' 73' ' ' LEU . 96.7 t -61.29 -57.94 9.84 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.486 0 CA-C-O 117.467 -1.254 . . . . 0.35999999999999999 110.962 176.107 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 57.0 mt-30 -55.51 -49.24 73.11 Favored 'General case' 0 N--CA 1.466 0.36 0 CA-C-N 121.603 2.001 . . . . 2.3700000000000001 111.7 -176.355 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 76.6 tttt -53.92 -49.69 68.08 Favored 'General case' 0 N--CA 1.446 -0.645 0 C-N-CA 123.74 0.816 . . . . 1.95 110.92 179.963 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 3.0 m-20 -83.54 -9.0 59.23 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 118.918 -0.563 . . . . 1.04 111.727 -175.327 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -160.87 73.95 2.7 Favored Pre-proline 0 C--O 1.238 0.466 0 C-N-CA 124.991 1.317 . . . . 0.31 109.669 -170.628 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 84.9 Cg_endo -77.08 22.48 0.56 Allowed 'Trans proline' 0 CA--C 1.537 0.647 0 C-N-CA 123.521 2.814 . . . . 1.4399999999999999 112.707 -173.41 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 4.7 ptmt -141.61 -43.15 0.36 Allowed 'General case' 0 N--CA 1.451 -0.423 0 C-N-CA 125.799 1.64 . . . . 2.5899999999999999 109.397 -175.829 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 4.4 m -57.61 -46.09 84.52 Favored 'General case' 0 CA--C 1.517 -0.306 0 CA-C-N 119.924 1.238 . . . . 0.33000000000000002 111.265 172.247 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 22.5 t80 -56.85 -49.25 76.04 Favored 'General case' 0 CA--C 1.505 -0.78 0 C-N-CA 119.835 -0.746 . . . . 1.79 109.55 177.432 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 55.3 tt0 -58.76 -28.59 66.05 Favored 'General case' 0 N--CA 1.439 -1.0 0 CA-C-N 114.9 -1.045 . . . . 1.3999999999999999 110.844 178.721 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 18.4 t80 -67.13 -53.31 31.81 Favored 'General case' 0 N--CA 1.454 -0.231 0 CA-C-N 119.367 0.985 . . . . 0.95999999999999996 109.615 -178.812 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 2.0 mp -63.99 -30.27 49.56 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.246 0 N-CA-C 108.315 -0.994 . . . . 0.80000000000000004 108.315 177.284 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -73.73 -25.17 60.06 Favored 'General case' 0 CA--C 1.538 0.509 0 O-C-N 121.735 -0.603 . . . . 1.52 111.196 179.642 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 34.2 t0 . . . . . 0 CA--C 1.507 -0.674 0 N-CA-C 106.335 -1.728 . . . . 2.7599999999999998 106.335 172.45 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--O 1.227 -0.127 0 CA-C-O 120.958 0.408 . . . . 3.46 110.297 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER -63.58 -36.01 74.79 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.488 0 N-CA-C 112.838 0.681 . . . . 0.5 112.838 177.664 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 2.5 t60 -57.23 -57.34 13.04 Favored 'General case' 0 C--N 1.341 0.235 0 N-CA-C 107.115 -1.439 . . . . 0.48999999999999999 107.115 177.659 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 38.7 mt-10 -59.67 -40.37 87.55 Favored 'General case' 0 N--CA 1.452 -0.362 0 C-N-CA 123.712 0.805 . . . . 2.1699999999999999 110.479 -178.248 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -53.15 -48.74 67.7 Favored 'General case' 0 CA--C 1.518 -0.26 0 CA-C-N 118.849 0.749 . . . . 3.3599999999999999 110.319 175.842 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -48.72 -47.09 30.89 Favored Glycine 0 CA--C 1.525 0.7 0 N-CA-C 110.715 -0.954 . . . . 0.51000000000000001 110.715 174.913 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 20' ' ' HIS . . . . . 0.53 ' CE1' ' HB1' ' A' ' 64' ' ' ALA . 2.3 t-160 -65.05 -44.5 88.84 Favored 'General case' 0 C--O 1.224 -0.282 0 O-C-N 122.149 -0.618 . . . . 1.8300000000000001 111.682 179.493 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -61.72 -32.76 73.0 Favored 'General case' 0 N--CA 1.453 -0.302 0 O-C-N 120.915 -1.116 . . . . 0.96999999999999997 109.933 -179.385 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 78.8 t -71.91 -36.35 57.59 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.306 0 O-C-N 121.519 -0.738 . . . . 1.3100000000000001 109.292 176.267 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 8.9 t0 . . . . . 0 N--CA 1.453 -0.288 0 C-N-CA 123.491 0.717 . . . . 2.0299999999999998 111.401 173.793 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 4.9 t0 . . . . . 0 CA--C 1.53 0.2 0 CA-C-O 121.72 0.771 . . . . 2.3900000000000001 109.935 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 7.6 mm -48.92 -57.83 1.47 Allowed 'Isoleucine or valine' 0 CA--C 1.531 0.216 0 C-N-CA 125.897 1.679 . . . . 0.42999999999999999 110.079 179.499 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 21.6 t80 -60.0 -29.76 68.69 Favored 'General case' 0 N--CA 1.451 -0.41 0 C-N-CA 124.038 0.935 . . . . 0.45000000000000001 111.962 179.82 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . 0.402 ' HA ' ' HE2' ' A' ' 49' ' ' LYS . 0.1 OUTLIER -69.14 -45.09 70.98 Favored 'General case' 0 N--CA 1.453 -0.315 0 O-C-N 120.289 -1.507 . . . . 1.22 110.956 -175.597 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 3.9 tp10 -86.84 -60.62 1.93 Allowed 'General case' 0 CA--C 1.532 0.266 0 CA-C-O 122.253 1.025 . . . . 2.3999999999999999 109.349 -178.088 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 22.1 mm-40 -72.6 -28.79 62.99 Favored 'General case' 0 C--O 1.235 0.313 0 O-C-N 121.519 -0.738 . . . . 2.5499999999999998 110.358 -171.348 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -70.89 39.92 0.53 Allowed Glycine 0 CA--C 1.534 1.234 0 C-N-CA 124.838 1.209 . . . . 0.37 113.743 169.829 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 24.3 m -151.82 36.47 0.56 Allowed 'General case' 0 CA--C 1.529 0.161 0 C-N-CA 125.638 1.575 . . . . 1.8899999999999999 108.746 159.779 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 1.3 m-80 -141.65 -47.25 0.37 Allowed 'General case' 0 CA--C 1.515 -0.381 0 O-C-N 122.052 -0.405 . . . . 1.8600000000000001 112.074 -172.893 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . 0.544 HD22 HG22 ' A' ' 85' ' ' VAL . 23.7 mt -63.81 -34.04 77.03 Favored 'General case' 0 C--N 1.332 -0.156 0 C-N-CA 120.294 -0.562 . . . . 0.52000000000000002 111.227 -172.201 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER 177.82 169.43 0.7 Allowed 'General case' 0 C--N 1.331 -0.208 0 C-N-CA 124.937 1.295 . . . . 0.81000000000000005 107.775 -173.575 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 39.4 m -61.56 -36.8 81.66 Favored 'General case' 0 N--CA 1.456 -0.146 0 O-C-N 121.81 -0.556 . . . . 0.90000000000000002 110.677 168.767 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 4.7 m-85 -67.36 -7.58 25.98 Favored 'General case' 0 N--CA 1.465 0.316 0 CA-C-N 118.359 0.527 . . . . 1.6100000000000001 112.164 172.87 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -82.59 -8.82 85.59 Favored Glycine 0 N--CA 1.441 -1.024 0 CA-C-O 118.024 -1.431 . . . . 0.42999999999999999 110.934 173.569 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 4.8 ttt-85 -116.39 -9.15 11.54 Favored 'General case' 0 CA--C 1.529 0.166 0 CA-C-N 119.897 1.849 . . . . 2.8300000000000001 112.283 -177.3 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 22.3 p -72.35 -136.51 0.01 OUTLIER 'General case' 0 CA--C 1.536 0.437 0 C-N-CA 123.366 0.666 . . . . 0.92000000000000004 109.376 177.601 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -65.87 146.47 54.7 Favored 'General case' 0 N--CA 1.454 -0.264 0 O-C-N 119.784 -1.822 . . . . 1.6000000000000001 108.187 178.182 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 61.6 tt0 -55.7 -34.28 64.94 Favored 'General case' 0 CA--C 1.533 0.301 0 CA-C-O 121.651 0.739 . . . . 2.9199999999999999 110.564 178.21 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 64' ' ' ALA . . . . . 0.53 ' HB1' ' CE1' ' A' ' 20' ' ' HIS . . . -59.44 -36.76 76.53 Favored 'General case' 0 N--CA 1.452 -0.36 0 C-N-CA 123.334 0.654 . . . . 0.42999999999999999 112.523 176.45 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 9.1 mt-10 -72.27 -43.53 64.16 Favored 'General case' 0 N--CA 1.455 -0.224 0 O-C-N 121.402 -0.811 . . . . 2.4500000000000002 109.989 177.461 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 43.6 t80 -50.58 -50.91 52.5 Favored 'General case' 0 N--CA 1.454 -0.257 0 C-N-CA 124.089 0.955 . . . . 0.29999999999999999 111.086 173.543 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 63.2 t80 -61.56 -46.78 88.43 Favored 'General case' 0 N--CA 1.454 -0.249 0 C-N-CA 123.308 0.643 . . . . 0.52000000000000002 110.521 178.3 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -59.42 -48.45 81.61 Favored 'General case' 0 CA--C 1.536 0.418 0 O-C-N 121.615 -0.678 . . . . 0.28999999999999998 111.36 -176.646 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 5.6 mm-40 -58.23 -45.35 87.85 Favored 'General case' 0 CA--C 1.52 -0.191 0 C-N-CA 123.324 0.65 . . . . 4.0300000000000002 110.406 172.737 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -56.21 -39.66 72.83 Favored 'General case' 0 N--CA 1.453 -0.281 0 CA-C-N 118.927 0.785 . . . . 0.42999999999999999 109.97 -179.555 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 1.4 t80 -60.58 -48.79 80.22 Favored 'General case' 0 CA--C 1.531 0.246 0 C-N-CA 124.475 1.11 . . . . 2.79 110.716 174.187 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 3.3 tmm_? -51.98 -54.51 28.87 Favored 'General case' 0 CA--C 1.535 0.388 0 C-N-CA 124.669 1.188 . . . . 2.3999999999999999 110.595 178.042 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 73' ' ' LEU . . . . . 0.663 HD12 HG23 ' A' ' 85' ' ' VAL . 0.1 OUTLIER -62.77 -33.83 75.99 Favored 'General case' 0 C--N 1.326 -0.431 0 C-N-CA 126.463 1.905 . . . . 0.47999999999999998 110.665 179.659 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -53.37 -45.94 69.43 Favored 'General case' 0 C--N 1.331 -0.217 0 C-N-CA 123.556 0.742 . . . . 2.4500000000000002 111.888 -175.671 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 14.8 p80 -96.97 -19.03 19.07 Favored 'General case' 0 C--O 1.225 -0.201 0 CA-C-O 116.341 -1.79 . . . . 1.95 114.481 -179.778 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 10.0 m -18.9 117.42 0.02 OUTLIER 'General case' 0 C--N 1.345 0.376 0 C-N-CA 126.962 2.105 . . . . 1.1699999999999999 113.237 -176.856 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 1.8 p -45.46 -44.32 12.19 Favored 'General case' 0 N--CA 1.45 -0.467 0 C-N-CA 126.097 1.759 . . . . 1.3200000000000001 110.06 -178.808 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 59.1 t0 -75.68 107.46 7.86 Favored 'General case' 0 N--CA 1.451 -0.376 0 C-N-CA 118.097 -1.441 . . . . 1.9099999999999999 109.161 169.182 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 3.4 p-80 -41.31 -36.97 0.89 Allowed 'General case' 0 CA--C 1.531 0.244 0 C-N-CA 124.202 1.001 . . . . 4.4699999999999998 112.821 170.493 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -58.24 -45.88 86.95 Favored 'General case' 0 N--CA 1.45 -0.468 0 C-N-CA 122.841 0.456 . . . . 0.64000000000000001 110.985 -178.822 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 9.2 mt-10 -59.49 -35.28 73.83 Favored 'General case' 0 N--CA 1.455 -0.219 0 CA-C-N 118.396 0.544 . . . . 2.52 110.921 -179.532 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 5.6 mtp180 -64.57 -50.52 66.94 Favored 'General case' 0 C--N 1.328 -0.346 0 N-CA-C 108.651 -0.87 . . . . 2.8100000000000001 108.651 178.575 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . 0.408 HD13 ' HA ' ' A' ' 83' ' ' LEU . 1.4 mm? -62.05 -25.11 67.49 Favored 'General case' 0 N--CA 1.449 -0.485 0 CA-C-O 118.113 -0.946 . . . . 0.54000000000000004 111.836 174.715 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 21.5 mmtp -68.26 -39.44 82.21 Favored 'General case' 0 CA--C 1.514 -0.416 0 CA-C-N 121.071 1.759 . . . . 2.7999999999999998 109.221 176.528 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 85' ' ' VAL . . . . . 0.663 HG23 HD12 ' A' ' 73' ' ' LEU . 72.0 t -61.41 -65.97 0.45 Allowed 'Isoleucine or valine' 0 C--O 1.218 -0.57 0 CA-C-O 117.39 -1.29 . . . . 0.53000000000000003 109.656 168.616 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 2.0 mt-30 -48.03 -45.64 32.31 Favored 'General case' 0 N--CA 1.469 0.494 0 CA-C-N 121.281 1.855 . . . . 2.1499999999999999 112.531 -173.906 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 11.4 tttt -60.67 -59.58 5.17 Favored 'General case' 0 N--CA 1.45 -0.459 0 C-N-CA 125.111 1.365 . . . . 3.3900000000000001 110.428 177.812 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 64.8 m-20 -84.85 14.56 4.68 Favored 'General case' 0 CA--C 1.532 0.287 0 CA-C-O 118.791 -0.623 . . . . 1.25 110.951 -175.559 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 89' ' ' ALA . . . . . 0.474 ' HB2' HD21 ' A' ' 55' ' ' LEU . . . -170.1 71.45 0.62 Allowed Pre-proline 0 N--CA 1.448 -0.552 0 C-N-CA 126.011 1.725 . . . . 0.34000000000000002 109.024 -178.473 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 94.2 Cg_endo -81.56 52.51 4.29 Favored 'Trans proline' 0 N--CA 1.459 -0.541 0 C-N-CA 124.001 3.134 . . . . 1.8200000000000001 110.721 -175.756 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -170.47 -44.81 0.02 OUTLIER 'General case' 0 CA--C 1.534 0.365 0 C-N-CA 126.55 1.94 . . . . 3.2000000000000002 109.376 174.646 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 5.6 m -52.17 -47.91 65.26 Favored 'General case' 0 N--CA 1.467 0.406 0 CA-C-N 119.082 0.856 . . . . 0.38 111.862 177.951 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 13.0 t80 -57.69 -47.6 81.89 Favored 'General case' 0 CA--C 1.513 -0.462 0 O-C-N 121.684 -0.635 . . . . 1.8899999999999999 110.643 177.451 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 2.3 tt0 -57.55 -29.01 64.05 Favored 'General case' 0 N--CA 1.443 -0.794 0 CA-C-N 114.874 -1.057 . . . . 1.49 110.6 -178.512 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 1.9 t80 -60.83 -60.81 3.21 Favored 'General case' 0 N--CA 1.456 -0.14 0 C-N-CA 124.558 1.143 . . . . 1.0800000000000001 110.078 -178.562 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 3.6 mp -58.88 -42.19 85.06 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.227 0 N-CA-C 108.501 -0.926 . . . . 0.93999999999999995 108.501 178.07 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 1.1 m-20 -56.54 -40.02 74.39 Favored 'General case' 0 CA--C 1.534 0.35 0 CA-C-N 117.812 0.278 . . . . 1.6799999999999999 111.577 -179.833 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.231 0.099 0 C-N-CA 125.416 1.486 . . . . 2.6499999999999999 108.796 -178.5 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 17.3 t80 . . . . . 0 N--CA 1.455 -0.187 0 CA-C-O 121.548 0.689 . . . . 3.0099999999999998 109.779 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 1.7 pt -67.86 -32.19 55.4 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.208 0 O-C-N 121.269 -0.894 . . . . 0.60999999999999999 112.833 175.624 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER -57.18 -54.36 47.65 Favored 'General case' 0 C--N 1.341 0.206 0 N-CA-C 106.693 -1.595 . . . . 0.55000000000000004 106.693 175.752 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 33.3 mt-10 -52.2 -47.64 65.48 Favored 'General case' 0 N--CA 1.454 -0.27 0 C-N-CA 125.278 1.431 . . . . 2.6000000000000001 109.766 -179.555 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -52.8 -50.84 62.8 Favored 'General case' 0 C--O 1.227 -0.107 0 C-N-CA 123.344 0.658 . . . . 3.29 111.558 174.824 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -49.13 -46.17 33.9 Favored Glycine 0 CA--C 1.526 0.732 0 N-CA-C 110.632 -0.987 . . . . 0.42999999999999999 110.632 176.676 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 2.0 t-160 -62.59 -46.47 88.13 Favored 'General case' 0 N--CA 1.45 -0.45 0 O-C-N 122.061 -0.67 . . . . 1.8300000000000001 111.028 178.316 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -61.25 -28.97 69.55 Favored 'General case' 0 N--CA 1.455 -0.224 0 C-N-CA 123.376 0.67 . . . . 0.66000000000000003 110.856 -178.636 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 80.4 t -65.92 -41.26 89.57 Favored 'Isoleucine or valine' 0 C--O 1.234 0.264 0 O-C-N 121.037 -1.039 . . . . 0.73999999999999999 110.069 176.61 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 N--CA 1.453 -0.302 0 CA-C-N 116.715 -0.221 . . . . 2.4700000000000002 111.591 178.232 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 26.6 t70 . . . . . 0 N--CA 1.468 0.456 0 CA-C-O 121.073 0.463 . . . . 2.6299999999999999 112.047 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 8.1 mm -48.34 -53.17 6.67 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.392 0 C-N-CA 126.732 2.013 . . . . 0.84999999999999998 109.421 175.179 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 32.3 t80 -64.42 -34.24 77.74 Favored 'General case' 0 C--O 1.224 -0.256 0 O-C-N 121.93 -0.481 . . . . 0.45000000000000001 112.15 176.069 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . 0.457 ' HA ' ' HE2' ' A' ' 49' ' ' LYS . 10.3 mmpt? -63.11 -46.45 87.26 Favored 'General case' 0 N--CA 1.453 -0.288 0 O-C-N 120.94 -1.1 . . . . 1.04 110.784 -176.285 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 1.2 mm-40 -81.07 -67.12 0.81 Allowed 'General case' 0 N--CA 1.451 -0.378 0 CA-C-O 122.379 1.085 . . . . 2.8999999999999999 109.717 179.012 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . 0.428 ' OE2' ' HE3' ' A' ' 91' ' ' LYS . 45.1 mm-40 -75.98 -22.79 55.51 Favored 'General case' 0 N--CA 1.451 -0.389 0 CA-C-N 115.589 -0.732 . . . . 3.3900000000000001 110.952 -165.442 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . 0.407 ' HA2' ' CD1' ' A' ' 66' ' ' PHE . . . -71.99 35.45 0.63 Allowed Glycine 0 CA--C 1.531 1.065 0 C-N-CA 123.784 0.707 . . . . 0.42999999999999999 113.284 168.008 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 30.0 t -152.1 36.27 0.54 Allowed 'General case' 0 N--CA 1.448 -0.551 0 O-C-N 120.899 -1.354 . . . . 2.1499999999999999 108.269 156.794 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 4.6 t-20 -134.88 -50.52 0.77 Allowed 'General case' 0 CA--C 1.519 -0.217 0 C-N-CA 122.67 0.388 . . . . 1.76 110.837 -168.545 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . 0.431 HD22 HG22 ' A' ' 85' ' ' VAL . 16.0 mt -64.21 -35.03 79.46 Favored 'General case' 0 C--N 1.334 -0.091 0 CA-C-O 120.798 0.332 . . . . 0.51000000000000001 111.266 -174.3 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER 178.2 165.94 0.76 Allowed 'General case' 0 CA--C 1.531 0.238 0 C-N-CA 124.845 1.258 . . . . 0.70999999999999996 108.067 -174.81 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 9.0 m -59.11 -36.51 75.3 Favored 'General case' 0 N--CA 1.455 -0.204 0 C-N-CA 123.803 0.841 . . . . 0.92000000000000004 110.881 170.557 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -59.78 -34.05 72.5 Favored 'General case' 0 C--O 1.223 -0.314 0 C-N-CA 123.825 0.85 . . . . 1.4299999999999999 109.575 172.367 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -63.18 -11.55 39.81 Favored Glycine 0 C--O 1.223 -0.551 0 O-C-N 121.482 -0.761 . . . . 0.42999999999999999 112.384 176.663 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 3.1 tmt_? -111.7 -3.79 14.9 Favored 'General case' 0 N--CA 1.452 -0.37 0 CA-C-N 118.515 1.158 . . . . 3.27 112.48 -176.857 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 56.3 p -72.27 -137.75 0.01 OUTLIER 'General case' 0 CA--C 1.538 0.481 0 N-CA-C 108.596 -0.89 . . . . 1.1299999999999999 108.596 175.944 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 98.5 m-20 -69.76 149.84 47.55 Favored 'General case' 0 CA--C 1.528 0.119 0 O-C-N 119.717 -1.864 . . . . 1.5800000000000001 108.73 178.199 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 45.0 tt0 -58.6 -27.76 64.96 Favored 'General case' 0 CA--C 1.538 0.516 0 CA-C-O 121.682 0.754 . . . . 3.1000000000000001 111.222 -179.55 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -62.96 -36.61 84.02 Favored 'General case' 0 N--CA 1.452 -0.339 0 C-N-CA 124.163 0.985 . . . . 0.71999999999999997 112.826 174.562 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 4.2 mt-10 -75.81 -48.47 21.51 Favored 'General case' 0 CA--C 1.511 -0.55 0 O-C-N 121.322 -0.861 . . . . 1.9199999999999999 109.175 177.766 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 66' ' ' PHE . . . . . 0.407 ' CD1' ' HA2' ' A' ' 52' ' ' GLY . 41.2 t80 -40.23 -51.73 2.68 Favored 'General case' 0 CA--C 1.535 0.403 0 C-N-CA 123.969 0.908 . . . . 0.29999999999999999 111.694 171.609 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 59.5 t80 -60.98 -42.99 99.42 Favored 'General case' 0 CA--C 1.538 0.483 0 C-N-CA 122.95 0.5 . . . . 0.47999999999999998 111.828 175.989 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -60.76 -49.33 77.92 Favored 'General case' 0 CA--C 1.538 0.486 0 O-C-N 120.999 -1.063 . . . . 0.40000000000000002 111.836 -178.993 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 2.9 mp0 -58.28 -40.69 82.57 Favored 'General case' 0 CA--C 1.519 -0.219 0 O-C-N 121.437 -0.789 . . . . 4.5099999999999998 110.644 171.863 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -56.01 -42.29 76.22 Favored 'General case' 0 N--CA 1.449 -0.485 0 C-N-CA 120.294 -0.563 . . . . 0.65000000000000002 109.594 177.934 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -60.09 -51.47 69.5 Favored 'General case' 0 CA--C 1.528 0.114 0 CA-C-N 119.187 0.903 . . . . 3.6000000000000001 112.09 174.88 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 20.9 ttt180 -45.85 -67.46 0.28 Allowed 'General case' 0 N--CA 1.467 0.387 0 CA-C-N 118.555 0.616 . . . . 1.8500000000000001 109.569 175.489 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 73' ' ' LEU . . . . . 0.661 HD12 HG23 ' A' ' 85' ' ' VAL . 0.2 OUTLIER -59.12 -35.25 73.13 Favored 'General case' 0 CA--C 1.509 -0.605 0 C-N-CA 125.603 1.561 . . . . 0.60999999999999999 111.314 -173.054 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 1.8 tmt? -59.06 -38.55 79.64 Favored 'General case' 0 N--CA 1.445 -0.683 0 CA-C-O 119.783 -0.151 . . . . 2.8700000000000001 111.164 -177.256 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 23.1 p80 -91.13 -35.95 14.27 Favored 'General case' 0 N--CA 1.454 -0.237 0 CA-C-O 116.467 -1.73 . . . . 1.1200000000000001 111.915 179.353 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 20.4 m -10.36 117.46 0.01 OUTLIER 'General case' 0 C--N 1.344 0.328 0 C-N-CA 128.532 2.733 . . . . 1.23 115.251 -169.359 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 6.9 p -46.66 -44.01 18.12 Favored 'General case' 0 N--CA 1.452 -0.347 0 C-N-CA 125.814 1.645 . . . . 1.0900000000000001 110.346 176.585 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 10.5 t0 -68.33 102.68 1.44 Allowed 'General case' 0 N--CA 1.448 -0.558 0 CA-C-O 121.669 0.747 . . . . 2.21 109.243 166.04 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 34.4 p-80 -50.23 -35.54 27.22 Favored 'General case' 0 N--CA 1.455 -0.21 0 CA-C-N 115.832 -0.622 . . . . 4.3499999999999996 111.986 175.145 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -59.47 -48.28 82.24 Favored 'General case' 0 N--CA 1.448 -0.538 0 CA-C-O 118.278 -0.868 . . . . 0.79000000000000004 110.399 179.757 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 1.4 tt0 -46.69 -42.6 16.78 Favored 'General case' 0 N--CA 1.465 0.298 0 CA-C-N 119.066 0.848 . . . . 3.3700000000000001 110.161 177.1 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -63.18 -51.88 64.6 Favored 'General case' 0 CA--C 1.516 -0.351 0 N-CA-C 109.504 -0.554 . . . . 3.0800000000000001 109.504 -179.982 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 1.4 mm? -65.72 -18.38 65.29 Favored 'General case' 0 N--CA 1.45 -0.431 0 CA-C-O 117.628 -1.177 . . . . 0.57999999999999996 113.059 178.166 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -67.04 -50.58 61.47 Favored 'General case' 0 CA--C 1.519 -0.218 0 CA-C-N 121.387 1.903 . . . . 1.55 107.141 168.092 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 85' ' ' VAL . . . . . 0.661 HG23 HD12 ' A' ' 73' ' ' LEU . 69.0 t -58.03 -43.53 85.25 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.671 0 CA-C-O 117.471 -1.252 . . . . 0.45000000000000001 112.008 177.79 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 9.9 mt-30 -68.1 -47.79 67.25 Favored 'General case' 0 C--O 1.225 -0.225 0 CA-C-N 122.305 2.321 . . . . 1.71 111.853 177.972 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 72.4 tttt -57.12 -49.18 76.71 Favored 'General case' 0 N--CA 1.449 -0.506 0 O-C-N 121.568 -0.707 . . . . 2.27 110.602 -173.942 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 25.0 m120 -68.83 -48.76 62.73 Favored 'General case' 0 N--CA 1.453 -0.291 0 N-CA-C 109.622 -0.511 . . . . 1.8200000000000001 109.622 175.738 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -122.81 77.62 48.88 Favored Pre-proline 0 C--O 1.236 0.393 0 C-N-CA 125.652 1.581 . . . . 0.59999999999999998 111.656 -170.34 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 57.9 Cg_endo -69.78 4.18 2.35 Favored 'Trans proline' 0 CA--C 1.537 0.632 0 C-N-CA 122.907 2.404 . . . . 1.5700000000000001 113.187 -176.815 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 91' ' ' LYS . . . . . 0.428 ' HE3' ' OE2' ' A' ' 51' ' ' GLU . 0.5 OUTLIER -122.49 -44.14 2.25 Favored 'General case' 0 N--CA 1.45 -0.448 0 C-N-CA 126.26 1.824 . . . . 3.3199999999999998 110.143 -171.702 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 5.9 m -58.25 -45.52 87.64 Favored 'General case' 0 N--CA 1.464 0.237 0 O-C-N 120.946 -1.097 . . . . 0.52000000000000002 111.214 175.668 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 10.9 t80 -58.15 -46.08 86.3 Favored 'General case' 0 CA--C 1.511 -0.556 0 CA-C-O 121.771 0.796 . . . . 2.21 110.83 178.136 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 26.8 tt0 -56.09 -34.75 66.31 Favored 'General case' 0 N--CA 1.44 -0.931 0 CA-C-N 114.284 -1.325 . . . . 2.4399999999999999 109.834 179.851 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 4.0 t80 -62.7 -57.19 11.85 Favored 'General case' 0 N--CA 1.455 -0.207 0 C-N-CA 124.338 1.055 . . . . 0.97999999999999998 110.305 -178.083 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 37.3 mm -53.91 -44.62 61.7 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.114 0 N-CA-C 109.591 -0.522 . . . . 1.3300000000000001 109.591 177.368 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 9.3 t30 -62.56 -30.78 71.57 Favored 'General case' 0 CA--C 1.534 0.335 0 N-CA-C 111.957 0.354 . . . . 1.55 111.957 -179.329 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 7.7 t70 . . . . . 0 N--CA 1.462 0.156 0 C-N-CA 124.587 1.155 . . . . 2.46 110.003 175.118 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 C--O 1.227 -0.106 0 CA-C-O 121.055 0.455 . . . . 2.8799999999999999 110.741 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -63.87 -34.33 67.56 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.559 0 N-CA-C 112.747 0.647 . . . . 0.47999999999999998 112.747 178.891 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 2.1 t-160 -59.79 -54.65 43.82 Favored 'General case' 0 N--CA 1.462 0.128 0 N-CA-C 106.762 -1.57 . . . . 0.46000000000000002 106.762 176.4 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 41.0 mt-10 -57.28 -39.32 75.45 Favored 'General case' 0 C--O 1.222 -0.349 0 CA-C-O 118.209 -0.901 . . . . 2.46 111.075 179.723 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -51.1 -54.72 22.5 Favored 'General case' 0 CA--C 1.52 -0.203 0 CA-C-N 119.368 0.985 . . . . 3.1099999999999999 110.45 173.452 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -47.94 -46.26 25.93 Favored Glycine 0 CA--C 1.527 0.792 0 N-CA-C 110.999 -0.84 . . . . 0.44 110.999 176.5 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 20' ' ' HIS . . . . . 0.573 ' CE1' ' HB1' ' A' ' 64' ' ' ALA . 2.1 t-160 -63.62 -46.73 84.42 Favored 'General case' 0 N--CA 1.45 -0.462 0 O-C-N 121.98 -0.718 . . . . 1.8300000000000001 111.794 -179.367 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -59.23 -32.72 70.22 Favored 'General case' 0 N--CA 1.452 -0.342 0 CA-C-N 118.603 0.638 . . . . 0.56999999999999995 109.352 -179.25 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 45.0 t -68.39 -41.57 83.53 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.267 0 C-N-CA 119.923 -0.711 . . . . 0.80000000000000004 110.201 177.092 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 2.0 t70 . . . . . 0 C--O 1.23 0.07 0 CA-C-O 121.284 0.564 . . . . 2.1600000000000001 110.974 173.86 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 6.6 t70 . . . . . 0 N--CA 1.465 0.292 0 N-CA-C 107.374 -1.343 . . . . 2.75 107.374 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 4.3 mm -54.28 -55.79 12.98 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.396 0 C-N-CA 126.038 1.735 . . . . 0.48999999999999999 109.689 -179.894 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 30.4 t80 -62.28 -26.02 68.17 Favored 'General case' 0 C--O 1.225 -0.219 0 O-C-N 120.498 -1.376 . . . . 0.38 112.181 175.664 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . 0.486 ' HA ' ' HE2' ' A' ' 49' ' ' LYS . 10.9 mmpt? -70.15 -47.21 62.66 Favored 'General case' 0 N--CA 1.45 -0.433 0 O-C-N 120.164 -1.585 . . . . 0.98999999999999999 110.877 -178.066 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 16.4 tp10 -89.25 -60.61 1.9 Allowed 'General case' 0 C--N 1.332 -0.179 0 CA-C-O 121.519 0.676 . . . . 2.48 109.449 -176.504 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . 0.443 ' OE2' ' HE2' ' A' ' 91' ' ' LYS . 29.3 mp0 -71.32 -26.99 63.08 Favored 'General case' 0 C--O 1.235 0.324 0 O-C-N 121.185 -0.947 . . . . 2.6099999999999999 110.699 -174.534 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . 0.443 ' HA2' ' CD1' ' A' ' 66' ' ' PHE . . . -72.45 42.59 0.84 Allowed Glycine 0 CA--C 1.53 1.016 0 C-N-CA 124.152 0.882 . . . . 0.35999999999999999 114.562 171.619 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 28.2 t -151.51 34.24 0.56 Allowed 'General case' 0 N--CA 1.451 -0.409 0 O-C-N 121.109 -1.23 . . . . 2.0499999999999998 109.087 151.432 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 1.5 m-20 -132.25 -47.68 0.92 Allowed 'General case' 0 CA--C 1.519 -0.237 0 N-CA-C 112.246 0.462 . . . . 1.78 112.246 -172.238 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 25.0 mt -59.42 -36.89 76.72 Favored 'General case' 0 N--CA 1.464 0.26 0 CA-C-O 121.033 0.444 . . . . 0.41999999999999998 111.411 -172.294 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -177.56 171.76 1.87 Allowed 'General case' 0 C--N 1.33 -0.245 0 N-CA-C 107.126 -1.435 . . . . 0.64000000000000001 107.126 -175.871 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 31.2 m -63.15 -33.7 76.03 Favored 'General case' 0 CA--C 1.53 0.179 0 O-C-N 121.693 -0.629 . . . . 1.0 110.834 169.101 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 1.8 m-85 -65.63 -19.2 65.82 Favored 'General case' 0 N--CA 1.466 0.361 0 CA-C-N 119.191 0.905 . . . . 1.21 111.502 171.041 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -69.21 -9.81 61.28 Favored Glycine 0 N--CA 1.443 -0.845 0 CA-C-O 118.656 -1.08 . . . . 0.41999999999999998 111.31 173.607 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 58.3 ttt180 -116.35 -11.5 11.21 Favored 'General case' 0 N--CA 1.454 -0.232 0 CA-C-N 119.211 1.506 . . . . 3.6800000000000002 112.657 -174.33 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 32.4 p -72.85 -123.61 0.0 OUTLIER 'General case' 0 CA--C 1.533 0.317 0 C-N-CA 123.227 0.611 . . . . 1.1200000000000001 109.724 -178.378 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 14.3 t30 -76.3 149.19 37.11 Favored 'General case' 0 N--CA 1.451 -0.405 0 O-C-N 120.215 -1.553 . . . . 1.98 107.537 177.219 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -57.12 -33.32 67.24 Favored 'General case' 0 CA--C 1.534 0.336 0 CA-C-O 121.79 0.805 . . . . 2.8599999999999999 110.321 178.832 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 64' ' ' ALA . . . . . 0.573 ' HB1' ' CE1' ' A' ' 20' ' ' HIS . . . -60.14 -34.81 74.05 Favored 'General case' 0 N--CA 1.45 -0.445 0 O-C-N 121.684 -0.635 . . . . 0.41999999999999998 112.592 177.656 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 7.0 mt-10 -76.25 -42.29 46.22 Favored 'General case' 0 CA--C 1.516 -0.34 0 O-C-N 121.694 -0.628 . . . . 2.1400000000000001 110.174 178.491 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 66' ' ' PHE . . . . . 0.443 ' CD1' ' HA2' ' A' ' 52' ' ' GLY . 36.8 t80 -48.94 -53.84 18.01 Favored 'General case' 0 N--CA 1.453 -0.289 0 C-N-CA 123.786 0.834 . . . . 0.34000000000000002 111.183 171.626 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 72.3 t80 -61.79 -45.92 91.79 Favored 'General case' 0 CA--C 1.534 0.347 0 C-N-CA 123.028 0.531 . . . . 0.51000000000000001 110.483 -179.988 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -60.54 -48.22 82.74 Favored 'General case' 0 CA--C 1.538 0.517 0 O-C-N 121.378 -0.826 . . . . 0.28999999999999998 112.186 -177.226 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 5.7 mm-40 -57.47 -41.53 80.79 Favored 'General case' 0 N--CA 1.458 -0.067 0 C-N-CA 123.74 0.816 . . . . 4.1500000000000004 110.095 172.256 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -57.48 -45.16 85.15 Favored 'General case' 0 N--CA 1.451 -0.401 0 CA-C-O 118.664 -0.684 . . . . 0.32000000000000001 109.801 -179.92 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 50.1 t80 -55.99 -49.87 72.43 Favored 'General case' 0 N--CA 1.465 0.287 0 CA-C-N 119.167 0.894 . . . . 2.2400000000000002 112.004 174.607 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 11.6 ttt180 -47.46 -61.35 1.96 Allowed 'General case' 0 CA--C 1.533 0.327 0 N-CA-C 109.107 -0.701 . . . . 2.1000000000000001 109.107 175.405 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 73' ' ' LEU . . . . . 0.607 ' CB ' HG21 ' A' ' 85' ' ' VAL . 0.1 OUTLIER -65.36 -23.37 66.97 Favored 'General case' 0 C--N 1.328 -0.362 0 C-N-CA 124.414 1.086 . . . . 0.55000000000000004 111.607 -173.411 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -65.05 -40.8 95.28 Favored 'General case' 0 C--N 1.326 -0.425 0 C-N-CA 122.933 0.493 . . . . 2.8399999999999999 110.719 179.109 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 13.8 p80 -95.41 -18.68 20.53 Favored 'General case' 0 C--O 1.227 -0.083 0 CA-C-O 116.936 -1.506 . . . . 0.90000000000000002 113.478 -178.603 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 7.6 m -25.67 118.04 0.06 Allowed 'General case' 0 CA--C 1.516 -0.342 0 C-N-CA 126.419 1.888 . . . . 1.05 113.59 -171.603 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 6.2 p -46.08 -44.19 15.3 Favored 'General case' 0 N--CA 1.451 -0.424 0 C-N-CA 125.746 1.619 . . . . 1.0900000000000001 109.985 177.607 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 13.4 t0 -70.03 103.81 2.38 Favored 'General case' 0 N--CA 1.451 -0.408 0 CA-C-O 122.034 0.921 . . . . 1.9199999999999999 109.738 166.274 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 1.4 p80 -45.49 -37.32 5.19 Favored 'General case' 0 CA--C 1.531 0.239 0 CA-C-N 115.569 -0.741 . . . . 4.6500000000000004 112.746 172.017 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -65.22 -42.07 93.82 Favored 'General case' 0 N--CA 1.449 -0.477 0 CA-C-O 118.68 -0.676 . . . . 0.58999999999999997 110.879 -178.699 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 1.2 tt0 -48.83 -41.41 32.84 Favored 'General case' 0 N--CA 1.463 0.188 0 CA-C-N 118.896 0.771 . . . . 2.9900000000000002 109.794 174.377 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 14.9 mtp180 -65.01 -52.53 55.55 Favored 'General case' 0 CA--C 1.517 -0.317 0 N-CA-C 109.332 -0.618 . . . . 2.3100000000000001 109.332 -179.714 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 1.4 mm? -62.5 -21.79 65.77 Favored 'General case' 0 C--O 1.222 -0.345 0 CA-C-O 118.315 -0.85 . . . . 0.5 112.838 177.752 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 30.4 mttt -67.45 -42.91 82.31 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 120.907 1.685 . . . . 1.75 108.424 174.467 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 85' ' ' VAL . . . . . 0.607 HG21 ' CB ' ' A' ' 73' ' ' LEU . 84.0 t -60.69 -64.9 0.53 Allowed 'Isoleucine or valine' 0 C--O 1.219 -0.503 0 CA-C-O 118.032 -0.985 . . . . 0.62 109.815 170.639 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -48.72 -42.67 35.9 Favored 'General case' 0 CA--C 1.533 0.309 0 CA-C-N 120.309 1.413 . . . . 2.1000000000000001 112.31 -174.622 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 35.6 tttm -62.52 -49.35 75.69 Favored 'General case' 0 N--CA 1.448 -0.56 0 C-N-CA 123.933 0.893 . . . . 2.21 111.891 178.793 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 70.6 m-80 -84.79 -4.96 59.3 Favored 'General case' 0 CA--C 1.531 0.219 0 CA-C-N 118.332 0.515 . . . . 1.8999999999999999 111.973 -179.465 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -162.02 62.78 1.44 Allowed Pre-proline 0 N--CA 1.448 -0.539 0 C-N-CA 124.274 1.029 . . . . 0.45000000000000001 110.005 -166.343 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 30.2 Cg_endo -60.08 -35.07 93.95 Favored 'Trans proline' 0 N--CA 1.454 -0.836 0 C-N-CA 122.516 2.144 . . . . 2.4300000000000002 110.446 -174.754 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 91' ' ' LYS . . . . . 0.443 ' HE2' ' OE2' ' A' ' 51' ' ' GLU . 0.2 OUTLIER -81.65 -39.55 24.23 Favored 'General case' 0 N--CA 1.451 -0.379 0 C-N-CA 124.813 1.245 . . . . 2.6299999999999999 112.639 -177.525 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 3.5 m -60.96 -45.99 92.52 Favored 'General case' 0 N--CA 1.464 0.262 0 CA-C-N 120.303 1.411 . . . . 0.39000000000000001 110.342 179.04 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 5.1 t80 -58.84 -47.96 83.01 Favored 'General case' 0 CA--C 1.51 -0.571 0 CA-C-O 121.068 0.461 . . . . 1.97 110.835 176.835 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 44.9 tt0 -56.22 -31.22 63.3 Favored 'General case' 0 N--CA 1.441 -0.887 0 CA-C-N 115.327 -0.851 . . . . 1.48 110.767 177.841 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 3.6 t80 -61.12 -58.78 6.96 Favored 'General case' 0 N--CA 1.455 -0.205 0 CA-C-N 118.702 0.683 . . . . 0.93000000000000005 110.417 -176.07 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 3.3 mp -57.15 -41.58 78.1 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.206 0 N-CA-C 108.625 -0.88 . . . . 0.79000000000000004 108.625 176.237 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 7.7 t-20 -59.65 -35.14 73.82 Favored 'General case' 0 CA--C 1.542 0.662 0 N-CA-C 112.342 0.497 . . . . 1.8600000000000001 112.342 -177.726 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 21.0 t70 . . . . . 0 CA--C 1.516 -0.356 0 C-N-CA 125.214 1.406 . . . . 2.4700000000000002 109.66 176.423 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 84.3 t80 . . . . . 0 CA--C 1.517 -0.319 0 N-CA-C 110.197 -0.298 . . . . 3.1899999999999999 110.197 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -62.99 -33.72 62.26 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.407 0 O-C-N 121.755 -0.59 . . . . 0.51000000000000001 112.194 -179.906 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 1.9 t60 -58.99 -57.51 12.75 Favored 'General case' 0 C--N 1.342 0.259 0 N-CA-C 107.303 -1.369 . . . . 0.60999999999999999 107.303 175.954 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 44.0 mt-10 -55.64 -35.44 65.92 Favored 'General case' 0 C--O 1.222 -0.389 0 C-N-CA 124.262 1.025 . . . . 2.5600000000000001 110.72 -179.805 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 6.2 t80 -58.64 -49.66 76.71 Favored 'General case' 0 N--CA 1.453 -0.292 0 C-N-CA 124.097 0.959 . . . . 2.7799999999999998 109.8 177.521 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -48.52 -46.93 29.73 Favored Glycine 0 CA--C 1.527 0.837 0 N-CA-C 110.959 -0.856 . . . . 0.44 110.959 171.128 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 20' ' ' HIS . . . . . 0.539 ' CE1' ' HB1' ' A' ' 64' ' ' ALA . 1.9 t-160 -62.5 -44.99 95.03 Favored 'General case' 0 N--CA 1.453 -0.299 0 O-C-N 121.516 -0.991 . . . . 1.8799999999999999 111.742 -179.526 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -62.59 -29.56 70.69 Favored 'General case' 0 N--CA 1.451 -0.377 0 O-C-N 121.483 -0.761 . . . . 0.57999999999999996 109.806 -179.695 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 90.1 t -66.29 -40.07 85.87 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.147 0 O-C-N 121.36 -0.838 . . . . 0.79000000000000004 110.697 175.432 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 18.8 t0 . . . . . 0 C--N 1.332 -0.195 0 CA-C-O 121.785 0.802 . . . . 2.0 110.863 173.936 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 6.3 t70 . . . . . 0 N--CA 1.47 0.533 0 CA-C-O 121.775 0.798 . . . . 2.5099999999999998 110.068 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 4.5 mm -54.8 -50.02 64.4 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.385 0 C-N-CA 124.901 1.28 . . . . 0.48999999999999999 108.643 -176.418 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 36.1 t80 -66.92 -26.99 67.12 Favored 'General case' 0 N--CA 1.453 -0.314 0 O-C-N 121.617 -0.677 . . . . 0.67000000000000004 112.724 177.067 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . 0.488 ' HA ' ' HE2' ' A' ' 49' ' ' LYS . 0.2 OUTLIER -68.44 -48.59 64.18 Favored 'General case' 0 N--CA 1.452 -0.367 0 O-C-N 120.591 -1.318 . . . . 1.3100000000000001 111.047 -175.994 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 7.6 mm-40 -86.77 -62.17 1.57 Allowed 'General case' 0 C--N 1.33 -0.258 0 N-CA-C 109.059 -0.719 . . . . 2.6499999999999999 109.059 179.155 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 4.2 mm-40 -69.9 -33.58 72.38 Favored 'General case' 0 CA--C 1.535 0.373 0 O-C-N 121.643 -0.661 . . . . 2.0499999999999998 109.546 -167.719 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -68.92 34.97 0.29 Allowed Glycine 0 CA--C 1.53 0.997 0 C-N-CA 125.926 1.727 . . . . 0.38 114.213 169.041 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 23.0 t -146.9 35.94 0.93 Allowed 'General case' 0 N--CA 1.447 -0.601 0 O-C-N 120.917 -1.343 . . . . 1.79 108.845 157.433 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 1.1 t-20 -141.25 -43.58 0.37 Allowed 'General case' 0 CA--C 1.52 -0.204 0 N-CA-C 112.817 0.673 . . . . 1.79 112.817 -173.985 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . 0.524 HD21 ' HB2' ' A' ' 89' ' ' ALA . 17.0 mt -60.58 -37.04 80.04 Favored 'General case' 0 N--CA 1.461 0.124 0 CA-C-O 120.876 0.369 . . . . 0.34999999999999998 111.385 -174.56 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER 178.93 168.86 0.93 Allowed 'General case' 0 C--N 1.33 -0.25 0 C-N-CA 125.386 1.474 . . . . 0.44 107.319 -178.21 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 18.7 m -60.43 -36.42 78.13 Favored 'General case' 0 N--CA 1.454 -0.24 0 O-C-N 121.742 -0.599 . . . . 1.1100000000000001 110.569 168.701 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -67.81 -8.34 35.18 Favored 'General case' 0 N--CA 1.465 0.308 0 C-N-CA 122.806 0.443 . . . . 1.1699999999999999 112.066 174.209 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -92.47 -0.39 70.03 Favored Glycine 0 N--CA 1.443 -0.846 0 CA-C-O 118.787 -1.007 . . . . 0.46999999999999997 110.825 175.2 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 1.2 ttt180 -123.11 -2.93 8.57 Favored 'General case' 0 C--O 1.227 -0.087 0 CA-C-N 119.003 1.401 . . . . 2.2799999999999998 112.175 -178.746 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 12.1 p -68.63 -106.72 0.0 OUTLIER 'General case' 0 N--CA 1.453 -0.275 0 C-N-CA 125.038 1.335 . . . . 1.51 109.644 175.877 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 2.2 t-20 -93.25 151.22 19.94 Favored 'General case' 0 N--CA 1.447 -0.599 0 N-CA-C 108.312 -0.995 . . . . 2.4500000000000002 108.312 177.071 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 22.7 tt0 -61.23 -29.49 69.86 Favored 'General case' 0 CA--C 1.535 0.401 0 CA-C-N 118.769 0.713 . . . . 3.1499999999999999 109.974 176.914 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 64' ' ' ALA . . . . . 0.539 ' HB1' ' CE1' ' A' ' 20' ' ' HIS . . . -64.91 -36.43 84.33 Favored 'General case' 0 N--CA 1.452 -0.357 0 N-CA-C 112.797 0.666 . . . . 0.52000000000000002 112.797 174.959 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 11.3 mt-10 -75.47 -37.75 60.07 Favored 'General case' 0 CA--C 1.511 -0.531 0 O-C-N 121.367 -0.833 . . . . 2.2799999999999998 110.178 178.473 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 48.8 t80 -53.2 -51.54 61.79 Favored 'General case' 0 N--CA 1.447 -0.607 0 C-N-CA 123.604 0.762 . . . . 0.33000000000000002 110.472 173.685 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 84.8 t80 -60.59 -46.71 89.22 Favored 'General case' 0 CA--C 1.534 0.35 0 CA-C-O 121.204 0.526 . . . . 0.46999999999999997 111.121 177.512 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -60.81 -50.96 71.33 Favored 'General case' 0 CA--C 1.541 0.606 0 O-C-N 121.4 -0.813 . . . . 0.29999999999999999 112.342 -176.553 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 24.8 mm-40 -54.01 -43.71 70.32 Favored 'General case' 0 CA--C 1.52 -0.192 0 C-N-CA 124.425 1.09 . . . . 4.3499999999999996 110.487 169.6 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -56.36 -42.25 77.49 Favored 'General case' 0 N--CA 1.451 -0.413 0 CA-C-O 118.414 -0.803 . . . . 0.33000000000000002 109.768 -178.649 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 22.9 t80 -58.09 -52.21 66.51 Favored 'General case' 0 N--CA 1.465 0.323 0 CA-C-N 119.233 0.924 . . . . 2.9900000000000002 111.578 173.055 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 28.1 ttt180 -46.8 -51.2 16.95 Favored 'General case' 0 CA--C 1.533 0.303 0 C-N-CA 122.738 0.415 . . . . 2.21 110.148 177.584 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 73' ' ' LEU . . . . . 0.634 HD12 HG23 ' A' ' 85' ' ' VAL . 0.1 OUTLIER -72.51 -30.19 64.27 Favored 'General case' 0 C--N 1.327 -0.377 0 C-N-CA 124.698 1.199 . . . . 0.44 111.035 -176.132 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 4.0 tmm? -62.78 -37.91 88.52 Favored 'General case' 0 C--N 1.33 -0.245 0 C-N-CA 123.784 0.834 . . . . 2.6299999999999999 111.015 -179.374 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 23.4 p80 -87.57 -47.59 8.59 Favored 'General case' 0 C--O 1.224 -0.278 0 CA-C-O 116.832 -1.556 . . . . 1.0700000000000001 109.826 179.201 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 5.2 m -0.09 104.75 0.01 OUTLIER 'General case' 0 N--CA 1.47 0.557 0 C-N-CA 128.297 2.639 . . . . 1.05 113.624 -173.454 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 2.1 p -45.7 -41.62 10.71 Favored 'General case' 0 N--CA 1.452 -0.372 0 C-N-CA 125.685 1.594 . . . . 0.96999999999999997 111.621 -177.086 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 59.4 t0 -69.48 103.5 2.06 Favored 'General case' 0 N--CA 1.455 -0.223 0 C-N-CA 118.589 -1.244 . . . . 2.1099999999999999 109.129 167.381 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 1.7 p80 -42.03 -36.57 1.16 Allowed 'General case' 0 CA--C 1.53 0.177 0 C-N-CA 124.462 1.105 . . . . 4.4199999999999999 112.63 172.581 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -58.1 -48.84 78.97 Favored 'General case' 0 N--CA 1.451 -0.38 0 C-N-CA 122.644 0.378 . . . . 0.65000000000000002 111.011 178.91 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -53.62 -38.55 64.13 Favored 'General case' 0 C--O 1.232 0.181 0 C-N-CA 123.407 0.683 . . . . 3.8500000000000001 110.964 179.073 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 3.3 mtp-105 -65.4 -51.4 60.65 Favored 'General case' 0 C--N 1.328 -0.334 0 C-N-CA 120.167 -0.613 . . . . 3.1099999999999999 109.702 178.383 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . 0.415 HD13 ' HA ' ' A' ' 83' ' ' LEU . 0.8 OUTLIER -60.53 -26.7 67.07 Favored 'General case' 0 N--CA 1.452 -0.344 0 CA-C-O 118.656 -0.688 . . . . 0.51000000000000001 112.695 177.752 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 37.6 mttt -65.14 -42.39 93.86 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 119.691 1.132 . . . . 1.6000000000000001 108.489 175.814 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 85' ' ' VAL . . . . . 0.634 HG23 HD12 ' A' ' 73' ' ' LEU . 78.5 t -62.77 -60.34 2.91 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.485 0 CA-C-O 117.4 -1.286 . . . . 0.40000000000000002 111.612 171.138 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 11.9 mt-30 -49.11 -46.55 45.01 Favored 'General case' 0 N--CA 1.468 0.446 0 CA-C-N 121.19 1.814 . . . . 1.9399999999999999 111.619 -175.86 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 18.5 tttt -60.25 -52.33 65.73 Favored 'General case' 0 N--CA 1.449 -0.494 0 C-N-CA 123.737 0.815 . . . . 2.3599999999999999 110.57 178.803 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 19.3 m-20 -84.25 5.38 26.86 Favored 'General case' 0 CA--C 1.533 0.293 0 C-N-CA 123.296 0.638 . . . . 1.0700000000000001 111.516 -174.629 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 89' ' ' ALA . . . . . 0.524 ' HB2' HD21 ' A' ' 55' ' ' LEU . . . -164.47 77.93 1.47 Allowed Pre-proline 0 N--CA 1.448 -0.553 0 C-N-CA 125.324 1.45 . . . . 0.38 108.894 -177.696 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 96.8 Cg_endo -80.65 47.42 2.55 Favored 'Trans proline' 0 CA--C 1.539 0.76 0 C-N-CA 124.211 3.274 . . . . 1.8100000000000001 111.624 -175.101 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 4.0 ptmt -169.06 -51.14 0.02 OUTLIER 'General case' 0 C--O 1.225 -0.233 0 C-N-CA 126.436 1.894 . . . . 2.4399999999999999 109.643 -176.889 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 3.2 m -53.19 -45.61 68.66 Favored 'General case' 0 N--CA 1.464 0.231 0 CA-C-N 119.09 0.859 . . . . 0.32000000000000001 111.817 179.913 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 9.1 t80 -60.2 -47.27 86.69 Favored 'General case' 0 CA--C 1.514 -0.408 0 CA-C-O 121.572 0.701 . . . . 2.4900000000000002 110.039 178.527 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 2.0 tt0 -57.89 -30.14 65.62 Favored 'General case' 0 N--CA 1.442 -0.834 0 CA-C-N 114.746 -1.115 . . . . 1.9299999999999999 110.471 179.253 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 3.9 t80 -64.49 -57.41 9.3 Favored 'General case' 0 N--CA 1.455 -0.196 0 C-N-CA 124.715 1.206 . . . . 0.95999999999999996 109.917 -175.723 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 3.2 mp -58.79 -41.99 84.18 Favored 'Isoleucine or valine' 0 C--O 1.226 -0.136 0 N-CA-C 108.326 -0.99 . . . . 0.78000000000000003 108.326 176.108 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 7.7 t30 -59.66 -31.34 69.45 Favored 'General case' 0 CA--C 1.536 0.44 0 N-CA-C 111.617 0.228 . . . . 1.4199999999999999 111.617 -179.496 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 2.4 t0 . . . . . 0 C--N 1.338 0.095 0 C-N-CA 126.132 1.773 . . . . 2.3100000000000001 108.829 175.672 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 39.8 t80 . . . . . 0 C--O 1.225 -0.197 0 N-CA-C 110.206 -0.294 . . . . 3.6899999999999999 110.206 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 15' ' ' ILE . . . . . 0.419 HD12 ' CE1' ' A' ' 75' ' ' HIS . 0.7 OUTLIER -65.72 -31.93 55.92 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.21 0 O-C-N 121.761 -0.587 . . . . 0.38 112.111 -177.778 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 9.1 t60 -60.78 -54.74 41.46 Favored 'General case' 0 CA--C 1.532 0.254 0 N-CA-C 107.388 -1.338 . . . . 0.5 107.388 177.647 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 22.4 mt-10 -53.2 -39.37 63.65 Favored 'General case' 0 C--O 1.222 -0.353 0 C-N-CA 123.773 0.829 . . . . 2.1400000000000001 110.639 174.977 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 5.1 t80 -58.05 -47.67 82.43 Favored 'General case' 0 CA--C 1.52 -0.182 0 C-N-CA 123.757 0.823 . . . . 2.8399999999999999 110.259 -178.407 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -49.07 -48.73 31.29 Favored Glycine 0 CA--C 1.524 0.621 0 N-CA-C 110.508 -1.037 . . . . 0.42999999999999999 110.508 171.068 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 20' ' ' HIS . . . . . 0.505 ' CE1' ' HB1' ' A' ' 64' ' ' ALA . 2.0 t60 -60.69 -45.53 93.84 Favored 'General case' 0 N--CA 1.451 -0.384 0 O-C-N 122.002 -0.705 . . . . 1.8400000000000001 112.0 -178.4 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -66.32 -27.24 67.76 Favored 'General case' 0 N--CA 1.452 -0.354 0 O-C-N 121.606 -0.684 . . . . 0.62 110.032 -179.599 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 55.8 t -73.44 -37.83 51.7 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.185 0 C-N-CA 119.406 -0.918 . . . . 0.79000000000000004 110.187 174.586 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 7.0 t0 . . . . . 0 N--CA 1.453 -0.319 0 C-N-CA 122.718 0.407 . . . . 1.8899999999999999 110.954 174.464 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 10.2 t70 . . . . . 0 N--CA 1.466 0.373 0 CA-C-O 122.031 0.92 . . . . 2.5600000000000001 110.451 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 2.9 mm -51.42 -48.16 34.55 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.226 0 C-N-CA 126.911 2.084 . . . . 0.44 109.526 176.78 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 48' ' ' PHE . . . . . 0.407 ' O ' ' HA3' ' A' ' 52' ' ' GLY . 20.0 t80 -63.42 -31.92 73.21 Favored 'General case' 0 N--CA 1.45 -0.436 0 O-C-N 121.039 -1.038 . . . . 0.51000000000000001 112.229 177.917 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . 0.51 ' HA ' ' HE2' ' A' ' 49' ' ' LYS . 10.8 mmpt? -69.97 -45.52 67.18 Favored 'General case' 0 C--N 1.33 -0.265 0 O-C-N 119.662 -1.899 . . . . 1.1100000000000001 110.543 -177.954 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 7.2 mm-40 -79.95 -65.76 0.96 Allowed 'General case' 0 N--CA 1.452 -0.344 0 CA-C-O 121.901 0.858 . . . . 2.3199999999999998 109.526 -176.906 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 14.0 mp0 -73.53 -28.32 61.82 Favored 'General case' 0 CA--C 1.533 0.314 0 O-C-N 121.492 -0.755 . . . . 2.6499999999999999 110.64 -172.33 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . 0.407 ' HA3' ' O ' ' A' ' 48' ' ' PHE . . . -68.99 33.5 0.29 Allowed Glycine 0 CA--C 1.533 1.158 0 C-N-CA 124.944 1.259 . . . . 0.34000000000000002 114.498 168.285 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 32.6 t -149.61 44.16 0.93 Allowed 'General case' 0 N--CA 1.447 -0.58 0 O-C-N 120.79 -1.418 . . . . 1.5800000000000001 107.56 158.84 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -148.48 -42.41 0.16 Allowed 'General case' 0 CA--C 1.516 -0.334 0 N-CA-C 114.003 1.112 . . . . 2.1000000000000001 114.003 -176.078 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 19.0 mt -61.89 -38.69 89.27 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-O 120.954 0.407 . . . . 0.40999999999999998 110.778 -176.737 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 1.2 t 178.63 172.76 0.73 Allowed 'General case' 0 CA--C 1.531 0.236 0 C-N-CA 125.41 1.484 . . . . 0.47999999999999998 107.678 -176.325 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 10.7 m -60.86 -34.66 74.94 Favored 'General case' 0 N--CA 1.453 -0.303 0 O-C-N 121.671 -0.643 . . . . 0.95999999999999996 110.408 168.45 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 1.6 m-85 -67.5 -10.82 55.25 Favored 'General case' 0 N--CA 1.464 0.242 0 N-CA-C 112.332 0.493 . . . . 1.45 112.332 173.831 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -83.1 -9.37 84.25 Favored Glycine 0 N--CA 1.443 -0.879 0 N-CA-C 110.825 -0.91 . . . . 0.39000000000000001 110.825 173.775 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 3.4 tmt_? -120.96 -6.39 9.54 Favored 'General case' 0 CA--C 1.526 0.03 0 CA-C-N 118.994 1.397 . . . . 2.5499999999999998 112.767 -173.81 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 19.5 p -67.56 -145.32 0.01 OUTLIER 'General case' 0 CA--C 1.54 0.575 0 C-N-CA 124.689 1.196 . . . . 0.75 108.947 169.277 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 32.5 m-80 -62.36 148.75 44.27 Favored 'General case' 0 N--CA 1.456 -0.158 0 O-C-N 119.318 -2.114 . . . . 2.21 109.261 178.269 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 58.2 tt0 -60.37 -27.86 67.74 Favored 'General case' 0 CA--C 1.537 0.449 0 CA-C-O 121.819 0.819 . . . . 2.7799999999999998 111.065 -179.565 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 64' ' ' ALA . . . . . 0.505 ' HB1' ' CE1' ' A' ' 20' ' ' HIS . . . -59.32 -40.92 87.79 Favored 'General case' 0 N--CA 1.452 -0.362 0 C-N-CA 124.643 1.177 . . . . 0.5 112.507 171.564 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 10.4 mt-10 -70.41 -47.09 62.42 Favored 'General case' 0 N--CA 1.446 -0.631 0 CA-C-O 118.211 -0.899 . . . . 2.04 109.828 176.927 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 48.7 t80 -45.86 -51.92 12.21 Favored 'General case' 0 N--CA 1.454 -0.249 0 C-N-CA 124.042 0.937 . . . . 0.34000000000000002 111.576 175.23 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 60.1 t80 -65.11 -43.81 90.81 Favored 'General case' 0 CA--C 1.538 0.5 0 O-C-N 121.426 -0.796 . . . . 0.38 110.98 178.27 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -62.73 -53.89 47.47 Favored 'General case' 0 CA--C 1.541 0.611 0 O-C-N 121.023 -1.048 . . . . 0.28000000000000003 113.156 -176.23 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -57.78 -40.15 79.14 Favored 'General case' 0 C--N 1.332 -0.154 0 O-C-N 120.435 -1.416 . . . . 3.8300000000000001 110.738 171.388 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -56.76 -39.41 73.95 Favored 'General case' 0 N--CA 1.451 -0.378 0 CA-C-O 118.282 -0.866 . . . . 0.46000000000000002 110.951 176.899 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 58.6 t80 -57.61 -49.82 75.18 Favored 'General case' 0 N--CA 1.465 0.299 0 CA-C-N 120.195 1.361 . . . . 3.8500000000000001 111.05 172.375 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 38.0 ttp85 -49.5 -57.7 6.55 Favored 'General case' 0 C--N 1.341 0.218 0 N-CA-C 109.235 -0.654 . . . . 3.27 109.235 178.256 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 73' ' ' LEU . . . . . 0.592 ' HB3' HG21 ' A' ' 85' ' ' VAL . 0.1 OUTLIER -64.09 -29.6 70.72 Favored 'General case' 0 N--CA 1.451 -0.409 0 C-N-CA 124.34 1.056 . . . . 0.5 110.834 -174.704 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 1.4 ttp -60.7 -41.44 95.19 Favored 'General case' 0 C--O 1.234 0.271 0 C-N-CA 123.042 0.537 . . . . 2.3999999999999999 110.116 -179.582 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 75' ' ' HIS . . . . . 0.419 ' CE1' HD12 ' A' ' 15' ' ' ILE . 5.8 p80 -97.48 -9.79 26.53 Favored 'General case' 0 N--CA 1.454 -0.266 0 CA-C-O 116.238 -1.839 . . . . 0.88 113.97 -177.598 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 8.0 m -36.19 123.78 0.75 Allowed 'General case' 0 CA--C 1.516 -0.363 0 CA-C-N 120.363 1.438 . . . . 1.0800000000000001 111.505 -169.026 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 2.1 p -48.95 -42.82 38.75 Favored 'General case' 0 N--CA 1.45 -0.467 0 CA-C-N 113.318 -1.765 . . . . 1.0700000000000001 109.068 -179.791 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 14.9 t0 -70.52 104.19 2.7 Favored 'General case' 0 N--CA 1.445 -0.705 0 CA-C-O 122.439 1.114 . . . . 1.78 109.764 165.879 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 18.1 p-80 -45.39 -38.84 6.29 Favored 'General case' 0 N--CA 1.453 -0.284 0 CA-C-N 115.064 -0.971 . . . . 4.3399999999999999 112.763 170.909 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -63.35 -44.64 94.26 Favored 'General case' 0 N--CA 1.451 -0.391 0 O-C-N 121.537 -0.727 . . . . 0.70999999999999996 110.179 -177.82 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 1.8 tt0 -47.61 -43.16 25.54 Favored 'General case' 0 C--O 1.231 0.127 0 C-N-CA 123.948 0.899 . . . . 2.7599999999999998 110.389 175.185 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 4.5 mtp180 -62.79 -51.0 68.78 Favored 'General case' 0 CA--C 1.516 -0.359 0 N-CA-C 108.774 -0.824 . . . . 2.7000000000000002 108.774 -179.405 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 1.6 mm? -63.68 -18.62 64.17 Favored 'General case' 0 N--CA 1.455 -0.211 0 CA-C-O 118.194 -0.907 . . . . 0.45000000000000001 113.355 176.664 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 1.9 mptm? -65.93 -47.46 74.65 Favored 'General case' 0 CA--C 1.521 -0.164 0 CA-C-N 120.856 1.662 . . . . 1.8 107.998 169.234 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 85' ' ' VAL . . . . . 0.592 HG21 ' HB3' ' A' ' 73' ' ' LEU . 84.8 t -60.58 -59.07 4.74 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.6 0 CA-C-O 118.401 -0.809 . . . . 0.45000000000000001 110.206 175.19 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -52.69 -48.62 66.42 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 120.075 1.307 . . . . 2.3199999999999998 111.959 -175.803 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 18.5 pttt -65.19 -41.07 94.91 Favored 'General case' 0 CA--C 1.533 0.32 0 O-C-N 120.931 -1.106 . . . . 2.6600000000000001 110.676 -177.975 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 37.8 m-20 -74.81 -20.68 59.67 Favored 'General case' 0 CA--C 1.534 0.335 0 C-N-CA 122.712 0.405 . . . . 0.91000000000000003 111.013 -179.208 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -157.43 67.11 3.88 Favored Pre-proline 0 N--CA 1.45 -0.459 0 C-N-CA 125.932 1.693 . . . . 0.5 108.959 -163.549 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 25.4 Cg_endo -60.33 -28.84 87.6 Favored 'Trans proline' 0 N--CA 1.455 -0.786 0 C-N-CA 122.255 1.97 . . . . 2.5600000000000001 110.919 -173.486 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -89.31 -43.8 10.69 Favored 'General case' 0 N--CA 1.451 -0.387 0 C-N-CA 126.215 1.806 . . . . 2.25 111.941 -174.561 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 4.9 m -56.86 -44.52 82.26 Favored 'General case' 0 N--CA 1.465 0.28 0 CA-C-N 120.168 1.349 . . . . 0.39000000000000001 110.909 178.791 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 13.5 t80 -55.39 -49.42 72.39 Favored 'General case' 0 CA--C 1.512 -0.498 0 C-N-CA 120.123 -0.631 . . . . 1.8400000000000001 110.631 176.008 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 9.8 tt0 -59.22 -30.09 67.98 Favored 'General case' 0 N--CA 1.445 -0.693 0 CA-C-N 115.594 -0.73 . . . . 2.23 110.894 -179.508 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 4.6 t80 -61.46 -57.86 10.47 Favored 'General case' 0 C--O 1.231 0.12 0 C-N-CA 123.781 0.833 . . . . 1.1599999999999999 109.047 -176.687 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 3.4 mp -58.45 -42.48 84.39 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.254 0 N-CA-C 108.681 -0.859 . . . . 0.88 108.681 175.983 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -57.44 -35.69 70.44 Favored 'General case' 0 CA--C 1.532 0.266 0 CA-C-N 118.445 0.566 . . . . 1.97 111.515 -177.73 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 CA--C 1.532 0.253 0 C-N-CA 123.509 0.724 . . . . 2.0899999999999999 109.416 179.263 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 N--CA 1.454 -0.271 0 CA-C-O 120.874 0.368 . . . . 3.0299999999999998 110.312 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 15' ' ' ILE . . . . . 0.456 HD12 ' CE1' ' A' ' 75' ' ' HIS . 0.4 OUTLIER -66.91 -31.59 54.14 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.336 0 O-C-N 121.265 -0.897 . . . . 0.67000000000000004 111.849 -176.933 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 2.5 t-160 -63.32 -57.64 9.74 Favored 'General case' 0 N--CA 1.45 -0.46 0 N-CA-C 106.878 -1.527 . . . . 0.77000000000000002 106.878 -179.411 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 42.4 mt-10 -57.88 -32.51 67.77 Favored 'General case' 0 N--CA 1.446 -0.641 0 C-N-CA 124.573 1.149 . . . . 2.96 110.552 177.408 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 4.3 t80 -55.95 -49.75 72.67 Favored 'General case' 0 C--N 1.332 -0.161 0 CA-C-N 120.388 1.449 . . . . 3.21 110.02 174.481 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -51.95 -47.11 54.74 Favored Glycine 0 CA--C 1.526 0.749 0 N-CA-C 111.308 -0.717 . . . . 0.76000000000000001 111.308 173.499 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 20' ' ' HIS . . . . . 0.597 ' CE1' ' HB1' ' A' ' 64' ' ' ALA . 2.4 t-160 -65.89 -50.66 63.68 Favored 'General case' 0 N--CA 1.452 -0.348 0 O-C-N 121.608 -0.936 . . . . 1.96 111.69 -174.374 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -57.54 -31.2 65.86 Favored 'General case' 0 N--CA 1.446 -0.647 0 C-N-CA 124.672 1.189 . . . . 0.68000000000000005 109.624 -179.184 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 71.4 t -67.69 -45.84 83.9 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.238 0 C-N-CA 118.663 -1.215 . . . . 1.05 110.944 173.439 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 2.2 t70 . . . . . 0 C--N 1.329 -0.315 0 CA-C-O 121.136 0.494 . . . . 2.1800000000000002 111.57 175.217 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 19.7 t70 . . . . . 0 N--CA 1.464 0.26 0 N-CA-C 110.367 -0.235 . . . . 2.1400000000000001 110.367 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 2.3 mm -45.52 -49.04 4.0 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.546 0 CA-C-O 122.749 1.262 . . . . 0.62 109.671 169.277 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 28.7 t80 -65.76 -28.36 68.97 Favored 'General case' 0 N--CA 1.452 -0.356 0 O-C-N 120.397 -1.439 . . . . 0.45000000000000001 112.386 -179.754 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . 0.458 ' HA ' ' HE2' ' A' ' 49' ' ' LYS . 0.6 OUTLIER -65.04 -55.29 19.78 Favored 'General case' 0 N--CA 1.454 -0.263 0 O-C-N 120.049 -1.657 . . . . 0.92000000000000004 109.801 174.764 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 6.4 mm-40 -74.0 -70.74 0.37 Allowed 'General case' 0 N--CA 1.451 -0.421 0 N-CA-C 108.687 -0.857 . . . . 2.2400000000000002 108.687 -173.337 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . 0.546 ' OE2' ' HE2' ' A' ' 91' ' ' LYS . 18.5 mp0 -70.21 -31.36 68.75 Favored 'General case' 0 C--O 1.235 0.32 0 O-C-N 121.544 -0.722 . . . . 2.5600000000000001 110.693 -171.577 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . 0.451 ' HA2' ' CD1' ' A' ' 66' ' ' PHE . . . -69.92 35.96 0.39 Allowed Glycine 0 CA--C 1.53 1.0 0 C-N-CA 124.59 1.09 . . . . 0.29999999999999999 114.155 170.341 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 33.2 p -142.39 20.14 2.05 Favored 'General case' 0 N--CA 1.449 -0.517 0 O-C-N 120.81 -1.406 . . . . 2.0099999999999998 111.535 157.915 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -134.04 -35.16 0.96 Allowed 'General case' 0 C--N 1.342 0.24 0 N-CA-C 112.871 0.693 . . . . 2.5800000000000001 112.871 -171.629 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 29.4 mt -61.89 -39.18 91.06 Favored 'General case' 0 N--CA 1.465 0.293 0 CA-C-N 119.302 0.955 . . . . 0.40999999999999998 110.927 -175.817 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 1.2 t 178.2 173.65 0.62 Allowed 'General case' 0 CA--C 1.531 0.233 0 C-N-CA 125.463 1.505 . . . . 0.5 107.564 -179.146 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 14.7 m -58.64 -36.39 74.02 Favored 'General case' 0 N--CA 1.453 -0.306 0 O-C-N 121.712 -0.617 . . . . 0.92000000000000004 110.819 168.526 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -68.54 -12.43 61.26 Favored 'General case' 0 N--CA 1.467 0.381 0 CA-C-N 118.401 0.546 . . . . 1.02 112.191 175.001 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -86.45 -4.98 82.82 Favored Glycine 0 N--CA 1.444 -0.783 0 CA-C-O 118.596 -1.113 . . . . 0.35999999999999999 110.927 173.047 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -120.4 1.95 10.74 Favored 'General case' 0 CA--C 1.529 0.169 0 CA-C-N 119.402 1.601 . . . . 3.1600000000000001 112.129 -178.447 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 14.9 p -76.18 -145.99 0.03 OUTLIER 'General case' 0 CA--C 1.539 0.543 0 N-CA-C 108.605 -0.887 . . . . 0.79000000000000004 108.605 170.759 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 1.6 m120 -58.16 149.57 23.53 Favored 'General case' 0 C--N 1.34 0.19 0 CA-C-N 120.532 1.515 . . . . 1.75 109.087 177.224 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -58.55 -34.42 71.0 Favored 'General case' 0 CA--C 1.533 0.317 0 CA-C-O 121.739 0.78 . . . . 2.8900000000000001 110.366 178.479 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 64' ' ' ALA . . . . . 0.597 ' HB1' ' CE1' ' A' ' 20' ' ' HIS . . . -59.31 -34.0 71.78 Favored 'General case' 0 N--CA 1.451 -0.42 0 O-C-N 121.536 -0.728 . . . . 0.52000000000000002 112.922 175.277 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 12.5 mt-10 -74.19 -42.62 59.54 Favored 'General case' 0 N--CA 1.45 -0.427 0 O-C-N 121.278 -0.889 . . . . 1.8500000000000001 110.408 174.932 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 66' ' ' PHE . . . . . 0.451 ' CD1' ' HA2' ' A' ' 52' ' ' GLY . 57.9 t80 -49.91 -50.45 46.1 Favored 'General case' 0 N--CA 1.455 -0.206 0 C-N-CA 123.173 0.589 . . . . 0.46999999999999997 111.115 173.709 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 76.3 t80 -63.42 -42.44 98.72 Favored 'General case' 0 CA--C 1.537 0.448 0 O-C-N 121.589 -0.694 . . . . 0.59999999999999998 111.28 178.291 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -70.97 -39.55 72.47 Favored 'General case' 0 CA--C 1.535 0.396 0 O-C-N 121.095 -1.003 . . . . 0.41999999999999998 111.802 -172.616 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -76.71 -31.72 57.37 Favored 'General case' 0 N--CA 1.449 -0.484 0 O-C-N 121.281 -0.887 . . . . 3.27 109.232 179.121 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -55.02 -47.28 74.92 Favored 'General case' 0 C--O 1.222 -0.355 0 O-C-N 121.684 -0.635 . . . . 0.5 109.394 167.944 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -50.47 -47.41 57.03 Favored 'General case' 0 N--CA 1.468 0.442 0 CA-C-N 119.289 0.95 . . . . 3.54 112.212 172.098 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 49.5 ttp85 -53.35 -52.17 60.1 Favored 'General case' 0 CA--C 1.534 0.345 0 CA-C-N 118.71 0.687 . . . . 3.0299999999999998 109.95 176.659 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 73' ' ' LEU . . . . . 0.576 ' CB ' HG21 ' A' ' 85' ' ' VAL . 0.2 OUTLIER -71.44 -25.36 62.28 Favored 'General case' 0 C--N 1.327 -0.372 0 C-N-CA 123.88 0.872 . . . . 0.58999999999999997 111.717 -173.888 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 38.9 mmm -62.16 -39.74 93.67 Favored 'General case' 0 C--O 1.234 0.265 0 C-N-CA 124.751 1.22 . . . . 3.0899999999999999 110.537 178.829 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 75' ' ' HIS . . . . . 0.456 ' CE1' HD12 ' A' ' 15' ' ' ILE . 8.7 p80 -96.87 -8.56 30.58 Favored 'General case' 0 N--CA 1.455 -0.185 0 CA-C-O 116.24 -1.838 . . . . 1.1399999999999999 113.151 -177.857 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 3.2 m -33.71 119.74 0.39 Allowed 'General case' 0 C--N 1.344 0.343 0 C-N-CA 124.763 1.225 . . . . 1.1899999999999999 111.089 -170.476 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 1.3 p -51.02 -42.26 60.32 Favored 'General case' 0 N--CA 1.45 -0.43 0 CA-C-N 113.481 -1.691 . . . . 1.21 108.863 -177.938 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 78' ' ' ASP . . . . . 0.483 ' OD2' ' HB3' ' A' ' 80' ' ' ALA . 12.6 t0 -71.4 110.06 5.78 Favored 'General case' 0 N--CA 1.447 -0.613 0 CA-C-O 121.998 0.904 . . . . 1.9099999999999999 109.344 164.578 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 6.9 p80 -50.41 -37.43 37.76 Favored 'General case' 0 N--CA 1.452 -0.347 0 CA-C-N 115.867 -0.606 . . . . 4.5499999999999998 111.866 172.719 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 80' ' ' ALA . . . . . 0.483 ' HB3' ' OD2' ' A' ' 78' ' ' ASP . . . -60.17 -47.73 84.69 Favored 'General case' 0 N--CA 1.454 -0.255 0 CA-C-N 118.413 0.551 . . . . 0.82999999999999996 110.224 -177.327 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 13.6 mt-10 -47.95 -41.29 24.59 Favored 'General case' 0 N--CA 1.453 -0.278 0 C-N-CA 124.057 0.943 . . . . 2.8700000000000001 111.212 175.748 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 4.2 mtp180 -63.4 -48.16 79.01 Favored 'General case' 0 C--N 1.329 -0.317 0 N-CA-C 108.968 -0.753 . . . . 2.6200000000000001 108.968 178.623 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 1.5 mm? -62.37 -23.71 66.96 Favored 'General case' 0 N--CA 1.452 -0.334 0 CA-C-O 117.513 -1.232 . . . . 0.67000000000000004 112.932 175.88 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -63.42 -43.19 98.17 Favored 'General case' 0 N--CA 1.462 0.156 0 CA-C-N 121.678 2.035 . . . . 1.51 108.122 171.407 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 85' ' ' VAL . . . . . 0.576 HG21 ' CB ' ' A' ' 73' ' ' LEU . 86.5 t -62.22 -62.29 1.22 Allowed 'Isoleucine or valine' 0 C--O 1.218 -0.579 0 CA-C-O 117.405 -1.283 . . . . 0.58999999999999997 110.629 173.696 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 1.9 mt-30 -48.86 -49.78 37.87 Favored 'General case' 0 N--CA 1.464 0.264 0 CA-C-N 120.946 1.703 . . . . 1.95 111.464 -175.628 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 51.9 tttt -55.41 -51.78 65.74 Favored 'General case' 0 N--CA 1.445 -0.707 0 C-N-CA 123.422 0.689 . . . . 2.1400000000000001 111.138 178.769 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 85.7 m-20 -80.39 -5.79 57.01 Favored 'General case' 0 CA--C 1.531 0.239 0 CA-C-O 119.481 -0.295 . . . . 1.1299999999999999 111.703 -176.722 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -163.92 68.0 1.57 Allowed Pre-proline 0 N--CA 1.448 -0.545 0 C-N-CA 124.223 1.009 . . . . 0.38 110.418 -167.364 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 59.5 Cg_endo -70.57 0.33 6.41 Favored 'Trans proline' 0 N--CA 1.457 -0.648 0 C-N-CA 123.057 2.504 . . . . 1.7 112.76 -174.629 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 91' ' ' LYS . . . . . 0.546 ' HE2' ' OE2' ' A' ' 51' ' ' GLU . 0.4 OUTLIER -115.81 -41.97 3.15 Favored 'General case' 0 N--CA 1.453 -0.315 0 C-N-CA 125.248 1.419 . . . . 2.9500000000000002 110.15 -178.812 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 2.5 m -57.6 -44.77 85.66 Favored 'General case' 0 C--O 1.226 -0.14 0 CA-C-N 119.591 1.087 . . . . 0.48999999999999999 110.74 174.66 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 9.0 t80 -60.64 -48.33 82.28 Favored 'General case' 0 CA--C 1.511 -0.556 0 CA-C-O 121.75 0.786 . . . . 1.96 110.655 179.526 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 30.3 tt0 -54.93 -34.52 63.28 Favored 'General case' 0 N--CA 1.44 -0.936 0 CA-C-N 114.762 -1.108 . . . . 1.5700000000000001 110.369 177.313 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 5.5 t80 -59.82 -59.65 5.1 Favored 'General case' 0 N--CA 1.454 -0.235 0 C-N-CA 124.363 1.065 . . . . 1.0 110.573 -174.157 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 3.7 mp -60.81 -38.54 79.21 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.231 0 N-CA-C 109.04 -0.726 . . . . 0.91000000000000003 109.04 176.653 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 4.3 t30 -60.46 -28.67 68.5 Favored 'General case' 0 CA--C 1.533 0.291 0 O-C-N 121.781 -0.575 . . . . 1.4099999999999999 111.66 -178.965 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.456 -0.146 0 C-N-CA 124.725 1.21 . . . . 2.21 109.076 174.976 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.457 -0.097 0 CA-C-O 121.79 0.805 . . . . 3.3799999999999999 109.081 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER -67.71 -27.69 39.0 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.25 0 O-C-N 121.656 -0.652 . . . . 0.48999999999999999 111.588 179.316 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 6.6 t60 -60.79 -47.9 84.24 Favored 'General case' 0 CA--C 1.534 0.351 0 N-CA-C 107.369 -1.345 . . . . 0.68000000000000005 107.369 175.36 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 32.7 mt-10 -59.42 -40.7 87.55 Favored 'General case' 0 CA--C 1.528 0.111 0 O-C-N 121.254 -0.904 . . . . 2.0299999999999998 111.186 177.439 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 2.4 m-85 -50.73 -47.33 59.31 Favored 'General case' 0 CA--C 1.519 -0.229 0 CA-C-N 118.938 0.79 . . . . 3.4399999999999999 110.764 173.478 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -48.81 -43.68 30.35 Favored Glycine 0 CA--C 1.533 1.192 0 CA-C-N 118.352 0.524 . . . . 0.79000000000000004 111.88 176.71 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 58.0 m-70 -62.12 -49.52 75.56 Favored 'General case' 0 C--O 1.226 -0.169 0 O-C-N 121.435 -1.038 . . . . 3.5600000000000001 111.768 174.481 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -59.17 -27.39 65.64 Favored 'General case' 0 CA--C 1.533 0.319 0 O-C-N 122.043 -0.41 . . . . 0.57999999999999996 111.214 -178.758 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 71.4 t -68.07 -42.96 85.57 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.19 0 O-C-N 121.029 -1.044 . . . . 1.0600000000000001 110.477 175.311 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 4.3 m-20 . . . . . 0 N--CA 1.462 0.17 0 N-CA-C 111.747 0.277 . . . . 1.96 111.747 173.489 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 28.8 t0 . . . . . 0 N--CA 1.464 0.249 0 N-CA-C 109.057 -0.719 . . . . 2.29 109.057 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 8.2 mm -52.13 -54.17 15.3 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.413 0 C-N-CA 125.404 1.482 . . . . 0.56000000000000005 109.5 177.966 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 36.5 t80 -64.0 -24.8 67.85 Favored 'General case' 0 N--CA 1.453 -0.305 0 O-C-N 121.346 -0.847 . . . . 0.51000000000000001 113.206 178.372 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . 0.47 ' CA ' ' HE2' ' A' ' 49' ' ' LYS . 1.0 OUTLIER -66.77 -53.66 30.78 Favored 'General case' 0 N--CA 1.456 -0.168 0 C-N-CA 118.186 -1.406 . . . . 1.0800000000000001 109.304 -178.85 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -84.49 -59.78 2.27 Favored 'General case' 0 N--CA 1.451 -0.385 0 N-CA-C 108.734 -0.839 . . . . 2.4500000000000002 108.734 -172.812 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . 0.462 ' OE2' ' HE2' ' A' ' 91' ' ' LYS . 18.1 mm-40 -71.15 -31.24 67.45 Favored 'General case' 0 C--O 1.235 0.306 0 O-C-N 122.058 -0.401 . . . . 2.3100000000000001 110.268 -170.44 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . 0.436 ' HA2' ' CD1' ' A' ' 66' ' ' PHE . . . -68.08 40.52 0.26 Allowed Glycine 0 CA--C 1.528 0.864 0 C-N-CA 126.644 2.069 . . . . 0.35999999999999999 114.464 171.318 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 9.3 p -156.61 34.83 0.31 Allowed 'General case' 0 N--CA 1.449 -0.504 0 O-C-N 120.806 -1.409 . . . . 1.5 109.901 155.725 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 35.9 t-20 -135.6 -46.83 0.68 Allowed 'General case' 0 CA--C 1.521 -0.147 0 O-C-N 122.174 -0.329 . . . . 1.6499999999999999 111.722 -169.74 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . 0.525 HD21 ' HB2' ' A' ' 89' ' ' ALA . 17.8 mt -55.85 -40.47 72.91 Favored 'General case' 0 CA--C 1.53 0.18 0 CA-C-O 120.825 0.345 . . . . 0.46999999999999997 111.196 -178.873 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 2.8 t 178.07 173.76 0.6 Allowed 'General case' 0 CA--C 1.533 0.301 0 C-N-CA 125.67 1.588 . . . . 0.56999999999999995 107.766 -174.483 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 9.6 p -61.75 -36.29 80.59 Favored 'General case' 0 N--CA 1.456 -0.173 0 C-N-CA 123.499 0.72 . . . . 2.5699999999999998 109.959 170.307 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -62.16 -14.4 36.94 Favored 'General case' 0 CA--C 1.537 0.446 0 N-CA-C 112.332 0.493 . . . . 1.1299999999999999 112.332 174.342 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -87.12 -13.25 66.52 Favored Glycine 0 N--CA 1.446 -0.693 0 CA-C-O 118.802 -0.999 . . . . 0.39000000000000001 111.603 177.649 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 71.5 ttt-85 -101.94 -17.7 16.01 Favored 'General case' 0 N--CA 1.461 0.077 0 CA-C-N 119.23 1.515 . . . . 2.29 112.252 176.985 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 1.4 p -60.01 -170.01 0.01 OUTLIER 'General case' 0 CA--C 1.538 0.489 0 C-N-CA 123.064 0.546 . . . . 0.89000000000000001 110.529 168.736 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 83.6 m-20 -48.89 148.28 2.32 Favored 'General case' 0 N--CA 1.464 0.227 0 O-C-N 121.428 -0.795 . . . . 2.2200000000000002 110.529 -174.751 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -60.34 -31.23 70.11 Favored 'General case' 0 C--O 1.224 -0.273 0 C-N-CA 120.526 -0.47 . . . . 2.9300000000000002 110.7 -174.056 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -54.64 -38.35 66.76 Favored 'General case' 0 N--CA 1.453 -0.297 0 N-CA-C 113.013 0.745 . . . . 0.45000000000000001 113.013 173.675 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 1.6 mt-10 -74.56 -44.79 49.3 Favored 'General case' 0 CA--C 1.505 -0.784 0 CA-C-O 118.622 -0.704 . . . . 2.2200000000000002 110.148 178.569 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 66' ' ' PHE . . . . . 0.436 ' CD1' ' HA2' ' A' ' 52' ' ' GLY . 49.1 t80 -50.22 -47.33 54.93 Favored 'General case' 0 N--CA 1.45 -0.457 0 O-C-N 123.896 0.748 . . . . 0.34000000000000002 111.594 174.397 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 67' ' ' PHE . . . . . 0.427 ' O ' ' HB3' ' A' ' 70' ' ' ALA . 76.8 t80 -64.75 -45.01 88.21 Favored 'General case' 0 N--CA 1.452 -0.327 0 O-C-N 121.421 -0.799 . . . . 0.38 110.355 175.605 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -64.83 -54.44 31.0 Favored 'General case' 0 CA--C 1.537 0.456 0 O-C-N 121.446 -0.784 . . . . 0.35999999999999999 112.619 -172.023 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -55.1 -36.62 65.88 Favored 'General case' 0 N--CA 1.456 -0.126 0 C-N-CA 124.207 1.003 . . . . 3.5899999999999999 111.071 169.534 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 70' ' ' ALA . . . . . 0.427 ' HB3' ' O ' ' A' ' 67' ' ' PHE . . . -53.18 -52.12 59.87 Favored 'General case' 0 C--O 1.22 -0.496 0 CA-C-N 118.913 0.779 . . . . 0.46000000000000002 109.644 170.635 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 4.7 t80 -51.71 -49.81 61.73 Favored 'General case' 0 C--O 1.233 0.209 0 CA-C-N 119.764 1.165 . . . . 2.5299999999999998 111.682 179.981 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 25.1 ttt180 -46.89 -58.66 3.71 Favored 'General case' 0 CA--C 1.536 0.434 0 CA-C-N 118.005 0.366 . . . . 1.8799999999999999 110.341 172.389 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 73' ' ' LEU . . . . . 0.589 HD12 ' CG2' ' A' ' 85' ' ' VAL . 0.1 OUTLIER -67.31 -33.24 74.85 Favored 'General case' 0 C--N 1.329 -0.293 0 C-N-CA 123.607 0.763 . . . . 0.46000000000000002 110.565 -170.317 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 74' ' ' MET . . . . . 0.558 ' CE ' HG11 ' A' ' 85' ' ' VAL . 0.0 OUTLIER -61.5 -39.74 92.08 Favored 'General case' 0 CA--C 1.52 -0.199 0 C-N-CA 124.853 1.261 . . . . 6.3399999999999999 109.939 -178.865 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 14.1 p80 -88.45 -33.29 17.9 Favored 'General case' 0 N--CA 1.453 -0.294 0 CA-C-O 116.702 -1.618 . . . . 1.05 110.991 -177.458 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 17.5 m -14.45 116.62 0.02 OUTLIER 'General case' 0 C--N 1.345 0.403 0 C-N-CA 128.561 2.744 . . . . 1.1299999999999999 113.537 -167.204 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 7.7 p -45.29 -44.37 11.38 Favored 'General case' 0 N--CA 1.452 -0.365 0 C-N-CA 126.172 1.789 . . . . 1.21 110.017 -179.657 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 11.0 t0 -70.68 108.2 4.29 Favored 'General case' 0 N--CA 1.447 -0.624 0 CA-C-O 121.822 0.82 . . . . 2.0299999999999998 109.614 168.054 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 57.8 m80 -52.27 -32.68 38.35 Favored 'General case' 0 N--CA 1.456 -0.155 0 CA-C-N 115.936 -0.574 . . . . 5.8600000000000003 111.519 174.676 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -61.64 -51.19 69.49 Favored 'General case' 0 N--CA 1.449 -0.478 0 CA-C-O 118.325 -0.845 . . . . 0.81000000000000005 110.37 177.935 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 1.9 mt-10 -47.26 -40.92 17.63 Favored 'General case' 0 N--CA 1.464 0.264 0 CA-C-N 119.331 0.969 . . . . 3.0299999999999998 110.419 178.049 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -62.91 -52.57 62.53 Favored 'General case' 0 CA--C 1.515 -0.386 0 C-N-CA 120.108 -0.637 . . . . 3.1299999999999999 110.145 178.581 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -61.98 -24.59 67.11 Favored 'General case' 0 N--CA 1.453 -0.319 0 CA-C-O 117.49 -1.243 . . . . 0.5 112.677 177.491 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 1.1 mptm? -61.29 -42.46 98.69 Favored 'General case' 0 C--O 1.225 -0.232 0 CA-C-N 121.166 1.803 . . . . 1.27 107.567 172.517 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 85' ' ' VAL . . . . . 0.589 ' CG2' HD12 ' A' ' 73' ' ' LEU . 93.0 t -69.26 -55.36 15.62 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.473 0 CA-C-O 118.21 -0.9 . . . . 0.42999999999999999 112.308 176.19 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -50.8 -41.38 57.16 Favored 'General case' 0 CA--C 1.531 0.243 0 CA-C-N 120.676 1.58 . . . . 2.1600000000000001 111.237 -178.013 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 34.9 tttt -62.88 -60.62 3.22 Favored 'General case' 0 N--CA 1.448 -0.54 0 C-N-CA 124.747 1.219 . . . . 1.9399999999999999 110.919 175.67 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 3.0 m120 -76.7 0.34 20.78 Favored 'General case' 0 CA--C 1.53 0.187 0 C-N-CA 123.539 0.735 . . . . 1.21 112.075 -174.069 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 89' ' ' ALA . . . . . 0.525 ' HB2' HD21 ' A' ' 55' ' ' LEU . . . -158.33 68.58 3.68 Favored Pre-proline 0 N--CA 1.448 -0.53 0 C-N-CA 124.443 1.097 . . . . 0.53000000000000003 108.7 -171.434 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 89.2 Cg_endo -80.3 56.64 6.15 Favored 'Trans proline' 0 CA--C 1.536 0.58 0 C-N-CA 124.378 3.386 . . . . 2.0 110.568 -173.3 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 91' ' ' LYS . . . . . 0.462 ' HE2' ' OE2' ' A' ' 51' ' ' GLU . 0.0 OUTLIER 176.18 -53.76 0.01 OUTLIER 'General case' 0 C--O 1.227 -0.127 0 C-N-CA 126.681 1.992 . . . . 2.6000000000000001 109.669 -168.626 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 2.7 m -55.19 -46.51 75.84 Favored 'General case' 0 CA--C 1.518 -0.272 0 CA-C-N 118.855 0.752 . . . . 0.39000000000000001 110.486 179.138 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 3.0 t80 -57.76 -49.02 77.97 Favored 'General case' 0 CA--C 1.506 -0.72 0 N-CA-C 109.677 -0.49 . . . . 2.27 109.677 178.246 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 3.8 tt0 -53.92 -33.78 57.67 Favored 'General case' 0 N--CA 1.443 -0.789 0 O-C-N 124.072 0.857 . . . . 2.25 110.694 -177.631 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 4.6 t80 -60.56 -56.25 23.56 Favored 'General case' 0 CA--C 1.529 0.173 0 C-N-CA 123.355 0.662 . . . . 0.92000000000000004 109.945 -175.865 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 2.3 mp -61.67 -41.28 89.79 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.293 0 N-CA-C 108.853 -0.795 . . . . 0.91000000000000003 108.853 176.817 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 11.7 t30 -58.7 -36.34 74.08 Favored 'General case' 0 CA--C 1.533 0.304 0 C-N-CA 123.143 0.577 . . . . 1.6899999999999999 110.953 -175.896 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 CA--C 1.529 0.171 0 C-N-CA 126.588 1.955 . . . . 2.73 109.128 175.865 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 CA--C 1.528 0.124 0 CA-C-O 121.42 0.629 . . . . 3.5600000000000001 110.82 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 1.1 pt -70.67 -27.14 29.85 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.283 0 O-C-N 121.613 -0.679 . . . . 0.81000000000000005 112.479 -178.322 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 1.1 t-160 -58.31 -57.76 11.48 Favored 'General case' 0 CA--C 1.529 0.163 0 N-CA-C 105.894 -1.891 . . . . 0.62 105.894 174.015 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 43.5 mt-10 -55.4 -43.35 75.14 Favored 'General case' 0 N--CA 1.456 -0.158 0 C-N-CA 123.967 0.907 . . . . 2.4700000000000002 110.663 -178.859 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 16.1 t80 -53.53 -51.49 62.67 Favored 'General case' 0 N--CA 1.455 -0.176 0 C-N-CA 123.493 0.717 . . . . 2.23 110.533 177.273 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -48.64 -43.56 29.02 Favored Glycine 0 CA--C 1.525 0.676 0 N-CA-C 111.347 -0.701 . . . . 0.72999999999999998 111.347 174.889 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 20' ' ' HIS . . . . . 0.544 ' CE1' ' HB1' ' A' ' 64' ' ' ALA . 2.3 t-160 -61.18 -48.94 79.22 Favored 'General case' 0 N--CA 1.45 -0.466 0 O-C-N 121.967 -0.726 . . . . 1.8600000000000001 111.047 178.299 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -58.63 -32.41 69.01 Favored 'General case' 0 N--CA 1.454 -0.232 0 CA-C-N 118.279 0.49 . . . . 1.1899999999999999 110.346 177.802 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 41.4 t -67.6 -33.83 64.46 Favored 'Isoleucine or valine' 0 N--CA 1.46 0.059 0 O-C-N 121.256 -0.902 . . . . 1.21 111.537 179.13 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 12.1 t0 . . . . . 0 CA--C 1.533 0.295 0 CA-C-O 122.082 0.944 . . . . 1.96 110.688 174.309 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 19.8 t70 . . . . . 0 N--CA 1.465 0.319 0 CA-C-O 120.72 0.295 . . . . 2.1099999999999999 110.784 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 5.9 mm -56.53 -46.49 82.45 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.315 0 CA-C-O 122.943 1.354 . . . . 0.68999999999999995 109.102 175.873 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 24.7 t80 -63.62 -23.14 67.26 Favored 'General case' 0 N--CA 1.451 -0.401 0 O-C-N 120.561 -1.337 . . . . 0.58999999999999997 112.187 177.085 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . 0.485 ' HA ' ' CE ' ' A' ' 49' ' ' LYS . 0.9 OUTLIER -71.85 -48.96 42.38 Favored 'General case' 0 N--CA 1.448 -0.549 0 O-C-N 120.053 -1.655 . . . . 1.4299999999999999 110.343 -179.653 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 21.8 tp10 -90.31 -55.82 3.45 Favored 'General case' 0 C--N 1.331 -0.208 0 O-C-N 123.541 0.526 . . . . 2.48 109.619 -173.04 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 33.0 mp0 -75.67 -28.43 58.7 Favored 'General case' 0 C--O 1.236 0.359 0 O-C-N 121.25 -0.906 . . . . 2.6000000000000001 110.904 -176.261 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . 0.475 ' HA2' ' CD1' ' A' ' 66' ' ' PHE . . . -70.92 45.72 0.71 Allowed Glycine 0 CA--C 1.531 1.055 0 C-N-CA 125.805 1.669 . . . . 0.38 114.843 169.935 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 46.8 t -162.66 46.13 0.14 Allowed 'General case' 0 N--CA 1.449 -0.476 0 N-CA-C 107.182 -1.414 . . . . 2.0699999999999998 107.182 157.636 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 4.8 t-20 -147.45 -50.85 0.19 Allowed 'General case' 0 CA--C 1.519 -0.243 0 N-CA-C 111.746 0.276 . . . . 1.49 111.746 -170.116 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 28.0 mt -59.97 -37.07 78.55 Favored 'General case' 0 N--CA 1.462 0.14 0 CA-C-O 120.885 0.374 . . . . 0.46000000000000002 111.048 -176.907 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -178.0 170.52 1.85 Allowed 'General case' 0 C--N 1.33 -0.277 0 N-CA-C 107.81 -1.181 . . . . 0.42999999999999999 107.81 -175.982 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 11.6 t -63.02 -35.23 79.52 Favored 'General case' 0 CA--C 1.533 0.312 0 C-N-CA 123.195 0.598 . . . . 1.99 109.713 170.184 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -67.1 -9.52 40.43 Favored 'General case' 0 N--CA 1.466 0.342 0 O-C-N 121.737 -0.602 . . . . 1.23 112.237 172.811 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -85.58 -5.08 84.94 Favored Glycine 0 C--O 1.22 -0.745 0 CA-C-O 118.797 -1.002 . . . . 0.51000000000000001 111.287 173.195 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -114.11 -16.66 12.07 Favored 'General case' 0 C--N 1.334 -0.07 0 CA-C-N 119.291 1.546 . . . . 2.71 112.239 -175.583 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 24.1 p -64.45 -149.72 0.01 OUTLIER 'General case' 0 CA--C 1.54 0.565 0 C-N-CA 125.629 1.571 . . . . 0.93000000000000005 109.881 176.299 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 15.9 m120 -58.3 143.8 43.48 Favored 'General case' 0 N--CA 1.455 -0.184 0 O-C-N 119.298 -2.126 . . . . 2.96 109.212 177.307 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 66.3 tt0 -56.55 -29.03 61.5 Favored 'General case' 0 CA--C 1.534 0.335 0 CA-C-O 121.785 0.802 . . . . 3.1099999999999999 111.466 -178.52 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 64' ' ' ALA . . . . . 0.544 ' HB1' ' CE1' ' A' ' 20' ' ' HIS . . . -60.23 -39.82 88.03 Favored 'General case' 0 N--CA 1.449 -0.49 0 C-N-CA 123.349 0.659 . . . . 0.71999999999999997 112.224 175.126 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 9.6 mt-10 -70.91 -42.0 70.52 Favored 'General case' 0 N--CA 1.451 -0.384 0 O-C-N 121.365 -0.834 . . . . 2.3700000000000001 110.757 176.443 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 66' ' ' PHE . . . . . 0.475 ' CD1' ' HA2' ' A' ' 52' ' ' GLY . 49.8 t80 -49.98 -52.5 33.32 Favored 'General case' 0 N--CA 1.454 -0.23 0 C-N-CA 122.858 0.463 . . . . 0.53000000000000003 110.861 174.753 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 75.9 t80 -60.92 -41.81 96.88 Favored 'General case' 0 CA--C 1.534 0.346 0 C-N-CA 122.508 0.323 . . . . 0.77000000000000002 110.827 177.716 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -63.95 -45.67 88.14 Favored 'General case' 0 CA--C 1.54 0.577 0 O-C-N 121.209 -0.932 . . . . 0.48999999999999999 111.838 -176.109 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 18.8 mm-40 -58.42 -43.9 88.84 Favored 'General case' 0 CA--C 1.521 -0.143 0 C-N-CA 124.447 1.099 . . . . 4.2800000000000002 110.187 171.38 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -52.07 -54.5 29.54 Favored 'General case' 0 N--CA 1.454 -0.257 0 N-CA-C 108.359 -0.978 . . . . 0.41999999999999998 108.359 178.021 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 39.4 t80 -50.45 -51.13 49.58 Favored 'General case' 0 N--CA 1.456 -0.173 0 C-N-CA 123.551 0.74 . . . . 2.1499999999999999 111.986 179.616 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 13.6 ttt180 -47.55 -57.93 4.84 Favored 'General case' 0 CA--C 1.534 0.354 0 CA-C-N 118.62 0.646 . . . . 2.0499999999999998 110.094 176.154 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 73' ' ' LEU . . . . . 0.626 HD12 HG23 ' A' ' 85' ' ' VAL . 0.1 OUTLIER -67.4 -24.47 65.67 Favored 'General case' 0 C--O 1.222 -0.355 0 C-N-CA 125.132 1.373 . . . . 0.60999999999999999 110.984 -172.505 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 74' ' ' MET . . . . . 0.442 ' HG3' HG21 ' A' ' 96' ' ' ILE . 33.4 mmt -57.0 -45.72 82.8 Favored 'General case' 0 N--CA 1.468 0.437 0 CA-C-N 119.041 0.837 . . . . 5.5899999999999999 111.486 178.409 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 6.6 p80 -95.94 -29.36 14.21 Favored 'General case' 0 C--N 1.334 -0.102 0 CA-C-O 116.388 -1.768 . . . . 2.6800000000000002 113.556 -175.589 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 81.3 p -13.18 117.08 0.02 OUTLIER 'General case' 0 C--N 1.344 0.337 0 C-N-CA 127.87 2.468 . . . . 2.1800000000000002 113.672 -173.047 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 1.9 p -44.93 -42.39 8.07 Favored 'General case' 0 C--N 1.33 -0.276 0 C-N-CA 125.173 1.389 . . . . 1.1399999999999999 110.87 176.994 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 11.1 t0 -66.98 103.03 1.06 Allowed 'General case' 0 N--CA 1.452 -0.374 0 N-CA-C 108.857 -0.794 . . . . 2.3199999999999998 108.857 166.206 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 4.6 t-80 -59.87 -23.05 63.11 Favored 'General case' 0 CA--C 1.531 0.237 0 O-C-N 121.522 -0.736 . . . . 5.71 111.679 179.896 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -66.09 -46.17 78.63 Favored 'General case' 0 N--CA 1.451 -0.41 0 CA-C-O 118.525 -0.75 . . . . 0.78000000000000003 110.918 176.493 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 1.1 mt-10 -47.77 -38.85 16.46 Favored 'General case' 0 N--CA 1.465 0.306 0 CA-C-N 119.025 0.829 . . . . 3.25 109.908 177.655 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 11.3 mtp180 -62.19 -54.54 39.52 Favored 'General case' 0 CA--C 1.517 -0.32 0 N-CA-C 108.822 -0.807 . . . . 2.6499999999999999 108.822 -178.439 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 1.5 mm? -65.36 -19.08 65.79 Favored 'General case' 0 N--CA 1.451 -0.409 0 CA-C-O 118.095 -0.955 . . . . 0.60999999999999999 112.726 178.2 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 24.3 mttt -68.73 -43.6 75.59 Favored 'General case' 0 CA--C 1.517 -0.302 0 CA-C-N 120.885 1.675 . . . . 1.5700000000000001 108.317 172.351 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 85' ' ' VAL . . . . . 0.626 HG23 HD12 ' A' ' 73' ' ' LEU . 92.8 t -61.23 -62.34 1.16 Allowed 'Isoleucine or valine' 0 C--O 1.217 -0.633 0 CA-C-O 118.413 -0.803 . . . . 0.37 109.893 171.584 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -50.09 -46.13 53.27 Favored 'General case' 0 C--O 1.224 -0.249 0 CA-C-N 120.213 1.37 . . . . 2.3399999999999999 112.082 -175.084 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 41.7 tttt -58.91 -53.37 59.18 Favored 'General case' 0 N--CA 1.448 -0.529 0 O-C-N 121.459 -0.776 . . . . 2.1299999999999999 110.879 177.299 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 64.4 m-20 -79.82 -7.15 58.52 Favored 'General case' 0 C--N 1.33 -0.258 0 C-N-CA 122.386 0.274 . . . . 0.91000000000000003 111.486 -174.449 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -164.88 62.94 0.96 Allowed Pre-proline 0 N--CA 1.447 -0.576 0 C-N-CA 124.558 1.143 . . . . 0.52000000000000002 109.624 -163.709 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 20.8 Cg_endo -57.6 -41.13 74.4 Favored 'Trans proline' 0 N--CA 1.454 -0.813 0 C-N-CA 122.54 2.16 . . . . 2.5800000000000001 109.884 -173.123 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 1.2 ptpt -74.29 -43.13 58.11 Favored 'General case' 0 N--CA 1.453 -0.325 0 C-N-CA 126.584 1.954 . . . . 2.3199999999999998 113.222 -178.789 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 3.7 m -59.04 -45.74 89.99 Favored 'General case' 0 CA--C 1.517 -0.296 0 CA-C-N 119.924 1.238 . . . . 0.40000000000000002 110.048 179.967 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 2.5 t80 -59.27 -46.39 88.65 Favored 'General case' 0 CA--C 1.512 -0.502 0 C-N-CA 120.123 -0.631 . . . . 1.9199999999999999 110.162 175.577 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 2.8 tt0 -52.36 -32.72 39.75 Favored 'General case' 0 N--CA 1.448 -0.552 0 CA-C-N 115.532 -0.758 . . . . 1.6000000000000001 111.066 179.942 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 2.3 t80 -58.15 -62.56 1.74 Allowed 'General case' 0 N--CA 1.456 -0.166 0 C-N-CA 124.091 0.956 . . . . 1.21 110.191 -178.269 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 96' ' ' ILE . . . . . 0.442 HG21 ' HG3' ' A' ' 74' ' ' MET . 3.5 mp -63.05 -36.08 74.35 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.286 0 N-CA-C 109.218 -0.66 . . . . 1.1100000000000001 109.218 -179.762 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 7.3 t-20 -57.96 -39.0 77.05 Favored 'General case' 0 CA--C 1.536 0.426 0 CA-C-N 117.953 0.342 . . . . 2.1099999999999999 110.743 -179.486 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 6.9 t0 . . . . . 0 N--CA 1.463 0.197 0 C-N-CA 125.225 1.41 . . . . 2.1899999999999999 110.141 177.327 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 2.9 t80 . . . . . 0 N--CA 1.454 -0.273 0 CA-C-O 121.078 0.466 . . . . 2.8500000000000001 110.699 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 0.7 OUTLIER -67.26 -36.31 76.36 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.499 0 O-C-N 121.229 -0.919 . . . . 0.60999999999999999 112.184 -178.859 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 3.0 t60 -57.34 -53.7 55.1 Favored 'General case' 0 CA--C 1.531 0.213 0 N-CA-C 107.228 -1.397 . . . . 0.87 107.228 176.383 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 45.8 mt-10 -64.99 -32.21 73.82 Favored 'General case' 0 N--CA 1.449 -0.487 0 C-N-CA 125.105 1.362 . . . . 2.3599999999999999 111.131 -175.333 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 1.1 m-85 -54.39 -53.84 48.66 Favored 'General case' 0 CA--C 1.517 -0.318 0 CA-C-N 119.56 1.073 . . . . 2.9100000000000001 110.129 167.762 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -49.76 -47.91 37.65 Favored Glycine 0 CA--C 1.526 0.742 0 N-CA-C 110.825 -0.91 . . . . 0.68999999999999995 110.825 176.857 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 20' ' ' HIS . . . . . 0.601 ' CE1' ' HB1' ' A' ' 64' ' ' ALA . 2.5 t60 -62.28 -43.7 98.21 Favored 'General case' 0 N--CA 1.447 -0.592 0 O-C-N 122.058 -0.672 . . . . 1.99 112.017 -178.661 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -61.84 -32.28 72.6 Favored 'General case' 0 N--CA 1.451 -0.394 0 N-CA-C 109.224 -0.658 . . . . 0.91000000000000003 109.224 -178.863 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 84.8 t -71.46 -40.83 72.75 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.164 0 C-N-CA 119.314 -0.954 . . . . 1.0 111.086 176.967 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 15.1 t0 . . . . . 0 C--N 1.328 -0.338 0 CA-C-O 121.807 0.813 . . . . 1.97 110.981 172.182 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 30.3 t70 . . . . . 0 N--CA 1.465 0.289 0 CA-C-O 122.057 0.932 . . . . 2.3799999999999999 110.232 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 3.4 mm -52.06 -51.2 31.62 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.19 0 C-N-CA 124.739 1.216 . . . . 0.64000000000000001 109.932 175.948 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 25.7 t80 -61.29 -32.74 72.58 Favored 'General case' 0 C--O 1.224 -0.268 0 O-C-N 121.781 -0.575 . . . . 0.89000000000000001 111.895 175.88 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . 0.461 ' HA ' ' HE2' ' A' ' 49' ' ' LYS . 7.6 mmpt? -67.74 -44.05 78.48 Favored 'General case' 0 N--CA 1.451 -0.403 0 O-C-N 120.544 -1.347 . . . . 1.3899999999999999 110.728 -176.668 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 18.5 mm-40 -82.31 -64.67 1.13 Allowed 'General case' 0 CA--C 1.532 0.274 0 CA-C-O 122.294 1.045 . . . . 3.0899999999999999 109.749 -179.738 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 21.1 mm-40 -74.18 -28.28 61.21 Favored 'General case' 0 C--O 1.235 0.338 0 C-N-CA 123.281 0.632 . . . . 2.2200000000000002 110.829 -169.084 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . 0.403 ' HA2' ' CD1' ' A' ' 66' ' ' PHE . . . -71.46 38.21 0.58 Allowed Glycine 0 CA--C 1.533 1.165 0 C-N-CA 124.295 0.95 . . . . 0.39000000000000001 113.287 170.184 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -148.61 33.16 0.78 Allowed 'General case' 0 N--CA 1.451 -0.414 0 C-N-CA 124.518 1.127 . . . . 2.5299999999999998 108.75 163.195 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 11.3 t-20 -144.37 -43.27 0.25 Allowed 'General case' 0 C--N 1.339 0.14 0 N-CA-C 112.331 0.493 . . . . 1.6499999999999999 112.331 -169.402 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 18.6 mt -62.64 -36.5 83.0 Favored 'General case' 0 N--CA 1.462 0.133 0 O-C-N 121.753 -0.592 . . . . 0.46000000000000002 111.239 -176.347 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER 175.06 169.84 0.29 Allowed 'General case' 0 CA--C 1.531 0.23 0 C-N-CA 125.989 1.716 . . . . 0.67000000000000004 107.48 -177.338 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 14.5 m -61.13 -36.46 79.81 Favored 'General case' 0 N--CA 1.455 -0.2 0 C-N-CA 123.092 0.557 . . . . 1.22 110.557 169.497 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 1.6 m-85 -68.08 -9.23 44.57 Favored 'General case' 0 N--CA 1.466 0.34 0 O-C-N 121.927 -0.483 . . . . 2.23 112.182 173.473 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -90.25 2.41 81.15 Favored Glycine 0 N--CA 1.443 -0.845 0 CA-C-O 118.828 -0.985 . . . . 0.44 111.06 173.54 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 3.2 tmt_? -125.91 -13.79 6.26 Favored 'General case' 0 C--O 1.226 -0.136 0 CA-C-N 119.157 1.479 . . . . 2.52 112.925 -176.888 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 3.6 p -59.67 -104.09 0.0 OUTLIER 'General case' 0 C--N 1.333 -0.148 0 C-N-CA 126.656 1.982 . . . . 1.47 110.583 177.175 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 4.5 t30 -93.53 152.23 19.19 Favored 'General case' 0 N--CA 1.45 -0.462 0 N-CA-C 107.681 -1.229 . . . . 2.0800000000000001 107.681 175.594 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 1.6 tm-20 -58.58 -35.72 72.85 Favored 'General case' 0 CA--C 1.532 0.271 0 CA-C-O 121.422 0.629 . . . . 3.48 109.737 176.205 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 64' ' ' ALA . . . . . 0.601 ' HB1' ' CE1' ' A' ' 20' ' ' HIS . . . -61.43 -31.64 71.58 Favored 'General case' 0 N--CA 1.453 -0.298 0 N-CA-C 113.785 1.032 . . . . 0.68000000000000005 113.785 176.315 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 10.0 mt-10 -76.47 -41.16 48.19 Favored 'General case' 0 CA--C 1.513 -0.446 0 O-C-N 121.546 -0.721 . . . . 2.25 109.534 176.548 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 66' ' ' PHE . . . . . 0.403 ' CD1' ' HA2' ' A' ' 52' ' ' GLY . 49.4 t80 -53.34 -51.63 61.82 Favored 'General case' 0 N--CA 1.451 -0.394 0 C-N-CA 123.027 0.531 . . . . 0.41999999999999998 111.251 173.804 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 71.2 t80 -64.94 -49.8 68.95 Favored 'General case' 0 N--CA 1.45 -0.468 0 C-N-CA 122.768 0.427 . . . . 0.46000000000000002 110.425 -178.283 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -60.11 -47.52 85.54 Favored 'General case' 0 CA--C 1.54 0.581 0 O-C-N 121.607 -0.683 . . . . 0.39000000000000001 112.274 -177.347 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 6.2 mm-40 -59.68 -41.54 90.9 Favored 'General case' 0 C--N 1.332 -0.167 0 C-N-CA 124.425 1.09 . . . . 4.4299999999999997 110.468 172.823 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -58.28 -41.84 85.23 Favored 'General case' 0 N--CA 1.453 -0.301 0 O-C-N 121.413 -0.804 . . . . 0.39000000000000001 109.373 179.67 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -54.59 -52.37 62.35 Favored 'General case' 0 C--O 1.232 0.149 0 C-N-CA 124.678 1.191 . . . . 3.21 111.488 172.016 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 7.6 ttt180 -48.58 -61.35 2.07 Favored 'General case' 0 CA--C 1.529 0.173 0 N-CA-C 109.432 -0.581 . . . . 2.3199999999999998 109.432 177.151 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 73' ' ' LEU . . . . . 0.564 ' CB ' HG21 ' A' ' 85' ' ' VAL . 0.1 OUTLIER -61.06 -28.04 68.78 Favored 'General case' 0 C--N 1.327 -0.411 0 C-N-CA 125.127 1.371 . . . . 0.53000000000000003 111.233 -176.18 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER -62.64 -40.71 97.87 Favored 'General case' 0 C--O 1.234 0.255 0 CA-C-N 118.745 0.702 . . . . 2.5099999999999998 110.744 -179.273 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 15.4 p80 -95.96 -20.48 18.7 Favored 'General case' 0 C--O 1.228 -0.067 0 CA-C-O 116.628 -1.653 . . . . 1.01 113.259 -179.109 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 33.2 m -31.92 115.22 0.16 Allowed 'General case' 0 C--O 1.221 -0.425 0 C-N-CA 125.776 1.63 . . . . 1.1699999999999999 111.823 -172.085 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 1.2 p -45.83 -39.58 8.66 Favored 'General case' 0 C--N 1.329 -0.291 0 C-N-CA 125.908 1.683 . . . . 1.1499999999999999 110.994 -177.367 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 12.6 t0 -63.48 104.87 0.68 Allowed 'General case' 0 N--CA 1.449 -0.514 0 CA-C-O 121.912 0.863 . . . . 2.48 109.872 167.402 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 9.1 m-70 -52.07 -33.87 41.06 Favored 'General case' 0 N--CA 1.457 -0.118 0 CA-C-O 118.596 -0.716 . . . . 4.6699999999999999 111.613 175.438 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -59.06 -54.11 50.72 Favored 'General case' 0 N--CA 1.448 -0.534 0 CA-C-O 118.04 -0.981 . . . . 1.05 109.957 178.988 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 4.4 mt-10 -42.73 -46.31 5.07 Favored 'General case' 0 CA--C 1.516 -0.352 0 C-N-CA 124.593 1.157 . . . . 2.71 111.055 178.561 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 12.4 mtp-105 -64.24 -51.2 64.79 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.162 -0.927 . . . . 3.27 109.423 -176.532 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 1.2 mm? -66.39 -18.88 65.62 Favored 'General case' 0 N--CA 1.451 -0.39 0 CA-C-O 117.674 -1.155 . . . . 0.52000000000000002 113.054 176.708 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -67.37 -44.19 79.56 Favored 'General case' 0 C--O 1.221 -0.445 0 CA-C-N 121.377 1.899 . . . . 1.8600000000000001 107.106 168.893 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 85' ' ' VAL . . . . . 0.564 HG21 ' CB ' ' A' ' 73' ' ' LEU . 93.8 t -63.95 -46.08 95.05 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.564 0 CA-C-O 117.559 -1.21 . . . . 0.46999999999999997 111.556 177.069 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 7.2 mt-30 -63.03 -49.62 73.9 Favored 'General case' 0 N--CA 1.463 0.217 0 CA-C-N 121.864 2.12 . . . . 1.72 111.737 178.636 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 44.9 tttt -57.83 -52.26 66.19 Favored 'General case' 0 N--CA 1.449 -0.497 0 O-C-N 121.769 -0.582 . . . . 2.1499999999999999 110.325 -176.523 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 8.0 m-20 -67.22 -33.3 75.07 Favored 'General case' 0 N--CA 1.453 -0.315 0 C-N-CA 123.704 0.802 . . . . 1.04 110.394 -179.147 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -136.04 84.24 31.54 Favored Pre-proline 0 C--O 1.236 0.373 0 C-N-CA 125.984 1.714 . . . . 0.42999999999999999 110.233 -173.728 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 97.4 Cg_endo -81.48 48.78 2.98 Favored 'Trans proline' 0 CA--C 1.538 0.683 0 C-N-CA 123.567 2.845 . . . . 1.6399999999999999 111.333 -175.791 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 2.3 ptmt -168.5 -53.55 0.02 OUTLIER 'General case' 0 N--CA 1.454 -0.231 0 C-N-CA 125.813 1.645 . . . . 2.3500000000000001 110.173 -174.025 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 6.6 m -51.21 -46.6 62.27 Favored 'General case' 0 N--CA 1.464 0.274 0 CA-C-N 118.874 0.761 . . . . 0.44 111.674 179.404 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 7.6 t80 -57.47 -47.07 82.85 Favored 'General case' 0 CA--C 1.511 -0.544 0 CA-C-O 121.486 0.66 . . . . 1.9099999999999999 111.149 178.678 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 12.6 tt0 -61.06 -31.1 70.77 Favored 'General case' 0 N--CA 1.441 -0.889 0 CA-C-N 115.052 -0.976 . . . . 1.8500000000000001 110.185 -179.41 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -60.69 -60.21 4.16 Favored 'General case' 0 N--CA 1.46 0.047 0 C-N-CA 123.663 0.785 . . . . 1.05 109.09 -176.64 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 3.0 mp -53.81 -44.21 59.09 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.302 0 N-CA-C 108.783 -0.821 . . . . 0.79000000000000004 108.783 175.964 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 52.6 t30 -60.34 -37.58 81.07 Favored 'General case' 0 CA--C 1.535 0.401 0 C-N-CA 120.336 -0.546 . . . . 1.6399999999999999 112.137 -177.306 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 . . . . . 0 CA--C 1.533 0.317 0 C-N-CA 126.878 2.071 . . . . 3.1499999999999999 108.946 -179.999 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.451 -0.407 0 CA-C-O 122.266 1.031 . . . . 3.7000000000000002 108.441 . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 0.6 OUTLIER -69.41 -24.88 28.01 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.306 0 CA-C-N 115.815 -0.63 . . . . 0.64000000000000001 112.317 179.631 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 1.0 OUTLIER -59.41 -54.14 50.13 Favored 'General case' 0 N--CA 1.455 -0.215 0 N-CA-C 106.753 -1.573 . . . . 0.47999999999999998 106.753 175.28 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 2.6 mt-10 -59.45 -35.56 74.27 Favored 'General case' 0 CA--C 1.516 -0.348 0 CA-C-O 118.254 -0.879 . . . . 3.5800000000000001 111.189 179.22 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 10.0 t80 -52.43 -47.47 66.35 Favored 'General case' 0 C--N 1.333 -0.146 0 CA-C-N 119.001 0.819 . . . . 3.1699999999999999 110.815 173.984 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -49.75 -48.8 36.03 Favored Glycine 0 CA--C 1.525 0.658 0 N-CA-C 111.478 -0.649 . . . . 0.42999999999999999 111.478 172.148 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 20' ' ' HIS . . . . . 0.513 ' CE1' ' HB1' ' A' ' 64' ' ' ALA . 1.8 t-160 -63.01 -41.74 99.64 Favored 'General case' 0 N--CA 1.454 -0.274 0 O-C-N 121.66 -0.906 . . . . 1.9399999999999999 111.663 -178.504 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -62.14 -32.98 73.64 Favored 'General case' 0 N--CA 1.449 -0.482 0 N-CA-C 109.684 -0.487 . . . . 0.71999999999999997 109.684 178.817 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 93.9 t -67.44 -40.35 84.38 Favored 'Isoleucine or valine' 0 C--O 1.233 0.209 0 C-N-CA 119.611 -0.836 . . . . 0.77000000000000002 110.121 175.112 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 CA--C 1.527 0.088 0 CA-C-O 119.46 -0.305 . . . . 2.2000000000000002 111.292 176.145 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 10.0 t0 . . . . . 0 N--CA 1.465 0.278 0 CA-C-O 121.951 0.881 . . . . 2.1899999999999999 109.608 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 9.4 mm -51.4 -51.8 22.82 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.481 0 C-N-CA 125.711 1.604 . . . . 0.45000000000000001 108.651 173.79 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 32.5 t80 -62.5 -32.4 73.3 Favored 'General case' 0 N--CA 1.45 -0.448 0 O-C-N 120.422 -1.424 . . . . 0.40999999999999998 113.357 175.728 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -63.42 -50.93 67.85 Favored 'General case' 0 N--CA 1.455 -0.186 0 C-N-CA 118.209 -1.396 . . . . 1.4199999999999999 110.116 -176.135 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 31.3 mt-10 -79.94 -66.59 0.86 Allowed 'General case' 0 N--CA 1.454 -0.275 0 N-CA-C 108.669 -0.863 . . . . 3.71 108.669 -178.699 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 17.1 mp0 -71.83 -28.44 63.57 Favored 'General case' 0 C--O 1.236 0.384 0 O-C-N 121.865 -0.522 . . . . 2.6299999999999999 110.589 -165.808 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . 0.401 ' HA2' ' CD1' ' A' ' 66' ' ' PHE . . . -70.6 38.74 0.48 Allowed Glycine 0 CA--C 1.529 0.91 0 C-N-CA 124.874 1.226 . . . . 0.34999999999999998 113.686 169.603 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 36.1 p -148.88 29.94 0.81 Allowed 'General case' 0 N--CA 1.446 -0.645 0 O-C-N 120.832 -1.393 . . . . 1.79 109.983 158.328 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 2.7 t-20 -141.04 -42.1 0.39 Allowed 'General case' 0 CA--C 1.52 -0.199 0 N-CA-C 113.005 0.743 . . . . 1.95 113.005 -170.946 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 31.1 mt -59.18 -38.05 78.89 Favored 'General case' 0 N--CA 1.463 0.199 0 CA-C-O 120.874 0.369 . . . . 0.65000000000000002 111.2 -175.66 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -179.12 171.1 1.38 Allowed 'General case' 0 CA--C 1.533 0.312 0 C-N-CA 125.356 1.462 . . . . 0.78000000000000003 107.35 -179.585 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 13.3 m -61.63 -36.41 80.69 Favored 'General case' 0 CA--C 1.53 0.209 0 O-C-N 121.648 -0.657 . . . . 0.96999999999999997 110.506 169.413 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -69.13 -4.31 16.87 Favored 'General case' 0 CA--C 1.533 0.321 0 N-CA-C 112.346 0.499 . . . . 1.3200000000000001 112.346 172.82 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -91.87 -7.88 64.02 Favored Glycine 0 N--CA 1.444 -0.817 0 CA-C-O 118.66 -1.078 . . . . 0.52000000000000002 111.071 173.632 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 4.1 tmt_? -111.8 -12.86 13.77 Favored 'General case' 0 C--N 1.338 0.082 0 CA-C-N 119.095 1.447 . . . . 2.9199999999999999 112.162 -178.656 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 17.6 p -64.57 -161.09 0.01 OUTLIER 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 124.372 1.069 . . . . 0.83999999999999997 109.542 168.439 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 85.8 m-20 -51.87 147.51 6.88 Favored 'General case' 0 C--N 1.34 0.165 0 O-C-N 120.699 -1.251 . . . . 1.5900000000000001 111.162 -176.651 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 28.6 tt0 -60.74 -25.0 66.15 Favored 'General case' 0 CA--C 1.536 0.415 0 CA-C-O 121.775 0.798 . . . . 3.3199999999999998 111.094 -175.829 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 64' ' ' ALA . . . . . 0.513 ' HB1' ' CE1' ' A' ' 20' ' ' HIS . . . -58.39 -47.16 84.77 Favored 'General case' 0 N--CA 1.452 -0.374 0 C-N-CA 124.823 1.249 . . . . 0.47999999999999998 112.829 169.86 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 12.3 mt-10 -69.48 -42.52 74.7 Favored 'General case' 0 CA--C 1.514 -0.409 0 O-C-N 121.466 -0.771 . . . . 2.0800000000000001 110.258 179.148 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 66' ' ' PHE . . . . . 0.401 ' CD1' ' HA2' ' A' ' 52' ' ' GLY . 53.9 t80 -49.34 -52.54 27.37 Favored 'General case' 0 N--CA 1.453 -0.297 0 C-N-CA 123.288 0.635 . . . . 0.37 110.814 174.462 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 75.8 t80 -59.78 -43.65 94.3 Favored 'General case' 0 N--CA 1.451 -0.415 0 C-N-CA 122.581 0.352 . . . . 0.39000000000000001 110.842 177.55 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -62.27 -45.62 92.46 Favored 'General case' 0 CA--C 1.54 0.572 0 O-C-N 121.404 -0.81 . . . . 0.28999999999999998 111.762 -176.404 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 15.2 mm-40 -59.93 -43.43 94.95 Favored 'General case' 0 CA--C 1.521 -0.141 0 C-N-CA 123.505 0.722 . . . . 4.1299999999999999 109.651 173.318 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -55.77 -43.51 76.81 Favored 'General case' 0 N--CA 1.451 -0.412 0 N-CA-C 109.791 -0.448 . . . . 0.52000000000000002 109.791 -179.705 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 7.2 t80 -61.28 -50.4 73.16 Favored 'General case' 0 CA--C 1.531 0.232 0 C-N-CA 123.065 0.546 . . . . 2.6099999999999999 111.578 178.332 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 17.2 ttt180 -46.76 -59.36 3.1 Favored 'General case' 0 N--CA 1.468 0.426 0 C-N-CA 124.225 1.01 . . . . 2.2200000000000002 109.789 175.251 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 73' ' ' LEU . . . . . 0.665 HD12 HG23 ' A' ' 85' ' ' VAL . 0.2 OUTLIER -65.16 -27.78 68.95 Favored 'General case' 0 N--CA 1.451 -0.412 0 C-N-CA 124.729 1.212 . . . . 0.57999999999999996 110.748 -175.351 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 2.0 ttp -58.43 -39.93 81.12 Favored 'General case' 0 C--O 1.234 0.272 0 CA-C-O 121.306 0.574 . . . . 2.5899999999999999 111.552 -178.052 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 15.1 p80 -94.46 -42.96 8.58 Favored 'General case' 0 C--O 1.223 -0.31 0 CA-C-O 116.063 -1.923 . . . . 2.1499999999999999 112.561 178.283 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 53.6 p 3.56 112.58 0.0 OUTLIER 'General case' 0 N--CA 1.472 0.643 0 C-N-CA 128.617 2.767 . . . . 2.2200000000000002 114.602 -171.288 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 2.3 p -41.05 -44.43 2.43 Favored 'General case' 0 N--CA 1.455 -0.209 0 C-N-CA 125.703 1.601 . . . . 1.1899999999999999 111.678 178.677 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 57.1 t0 -76.56 106.31 8.13 Favored 'General case' 0 N--CA 1.452 -0.349 0 C-N-CA 117.072 -1.851 . . . . 2.1099999999999999 108.649 166.886 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 5.3 p-80 -42.44 -35.63 1.09 Allowed 'General case' 0 N--CA 1.454 -0.258 0 C-N-CA 124.474 1.11 . . . . 4.3799999999999999 112.758 171.415 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -56.61 -47.88 78.67 Favored 'General case' 0 N--CA 1.449 -0.485 0 C-N-CA 123.149 0.58 . . . . 0.96999999999999997 110.415 -178.955 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -54.37 -34.36 61.02 Favored 'General case' 0 CA--C 1.515 -0.374 0 C-N-CA 122.489 0.316 . . . . 3.75 111.343 -179.286 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 3.5 mtp-105 -63.28 -51.97 63.96 Favored 'General case' 0 N--CA 1.447 -0.588 0 N-CA-C 108.642 -0.873 . . . . 3.4300000000000002 108.642 177.937 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . 0.403 HD13 ' HA ' ' A' ' 83' ' ' LEU . 2.4 mm? -61.42 -25.81 67.45 Favored 'General case' 0 N--CA 1.453 -0.315 0 CA-C-O 118.092 -0.956 . . . . 0.67000000000000004 112.276 177.908 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 2.4 mptm? -62.53 -46.0 90.42 Favored 'General case' 0 CA--C 1.52 -0.19 0 CA-C-N 120.37 1.441 . . . . 1.4099999999999999 108.504 173.681 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 85' ' ' VAL . . . . . 0.665 HG23 HD12 ' A' ' 73' ' ' LEU . 86.3 t -62.66 -63.75 0.77 Allowed 'Isoleucine or valine' 0 C--O 1.217 -0.652 0 CA-C-O 118.356 -0.831 . . . . 0.56000000000000005 109.795 174.712 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -47.82 -51.01 24.28 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 119.53 1.059 . . . . 1.8500000000000001 111.514 -171.869 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 13.5 pttp -66.06 -40.08 90.63 Favored 'General case' 0 CA--C 1.532 0.276 0 O-C-N 121.991 -0.443 . . . . 3.6499999999999999 110.722 -177.24 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 55.1 m-20 -82.07 -7.43 59.61 Favored 'General case' 0 CA--C 1.534 0.351 0 CA-C-N 118.178 0.445 . . . . 0.94999999999999996 111.244 -179.776 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -158.57 74.51 3.65 Favored Pre-proline 0 N--CA 1.448 -0.553 0 C-N-CA 125.477 1.511 . . . . 0.34999999999999998 108.907 -170.326 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 67.8 Cg_endo -81.6 44.17 1.68 Allowed 'Trans proline' 0 CA--C 1.537 0.641 0 C-N-CA 124.234 3.289 . . . . 1.5900000000000001 111.254 -174.947 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -160.95 -56.31 0.05 Allowed 'General case' 0 N--CA 1.451 -0.382 0 C-N-CA 125.636 1.574 . . . . 2.5699999999999998 108.66 -176.1 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 2.5 m -49.22 -48.6 45.35 Favored 'General case' 0 N--CA 1.464 0.256 0 C-N-CA 123.822 0.849 . . . . 0.34000000000000002 111.359 176.603 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 6.5 t80 -59.55 -51.19 70.89 Favored 'General case' 0 CA--C 1.509 -0.61 0 CA-C-O 121.348 0.594 . . . . 2.0699999999999998 110.561 -179.301 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 32.2 tt0 -59.93 -28.19 67.41 Favored 'General case' 0 N--CA 1.442 -0.847 0 CA-C-N 114.928 -1.033 . . . . 1.8300000000000001 110.207 -178.315 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 8.4 t80 -65.35 -56.93 9.87 Favored 'General case' 0 N--CA 1.452 -0.333 0 C-N-CA 124.068 0.947 . . . . 1.6000000000000001 109.423 -175.136 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 3.4 mp -59.06 -41.51 83.65 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.161 0 N-CA-C 108.924 -0.769 . . . . 0.89000000000000001 108.924 174.832 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -60.13 -30.44 69.29 Favored 'General case' 0 CA--C 1.536 0.419 0 CA-C-N 118.03 0.377 . . . . 1.6899999999999999 111.208 -178.85 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 10.3 t70 . . . . . 0 CA--C 1.522 -0.102 0 C-N-CA 123.771 0.828 . . . . 2.3399999999999999 109.302 177.104 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 C--O 1.224 -0.277 0 N-CA-C 110.464 -0.198 . . . . 3.71 110.464 . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 0.5 OUTLIER -61.92 -34.67 64.03 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.348 0 O-C-N 121.709 -0.619 . . . . 0.38 111.948 -176.505 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 6.6 t60 -60.05 -55.52 32.92 Favored 'General case' 0 CA--C 1.532 0.269 0 N-CA-C 107.207 -1.405 . . . . 0.55000000000000004 107.207 178.051 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 31.7 mt-10 -56.87 -38.29 72.53 Favored 'General case' 0 N--CA 1.453 -0.301 0 C-N-CA 124.152 0.981 . . . . 1.9399999999999999 111.832 178.654 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 1.7 m-85 -54.94 -49.17 72.01 Favored 'General case' 0 CA--C 1.517 -0.295 0 CA-C-N 119.42 1.009 . . . . 3.0800000000000001 109.661 176.165 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -50.01 -45.87 41.75 Favored Glycine 0 CA--C 1.525 0.694 0 N-CA-C 110.804 -0.918 . . . . 0.41999999999999998 110.804 174.866 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 20' ' ' HIS . . . . . 0.518 ' CE1' ' HB1' ' A' ' 64' ' ' ALA . 1.8 t60 -62.16 -45.6 92.69 Favored 'General case' 0 N--CA 1.451 -0.398 0 O-C-N 121.896 -0.767 . . . . 1.79 111.783 179.458 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -64.61 -28.0 69.33 Favored 'General case' 0 N--CA 1.454 -0.271 0 O-C-N 121.199 -0.938 . . . . 0.60999999999999999 110.228 179.619 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 92.7 t -71.67 -37.45 63.04 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.168 0 O-C-N 120.921 -1.112 . . . . 0.71999999999999997 109.682 176.242 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 8.6 t70 . . . . . 0 C--N 1.334 -0.101 0 CA-C-O 121.179 0.514 . . . . 2.23 111.136 172.895 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 6.8 m-20 . . . . . 0 N--CA 1.463 0.177 0 CA-C-O 121.077 0.465 . . . . 3.6099999999999999 111.271 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 3.2 mm -53.13 -50.96 43.35 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.232 0 C-N-CA 124.268 1.027 . . . . 0.46999999999999997 109.416 -176.259 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 24.6 t80 -64.07 -36.76 85.07 Favored 'General case' 0 N--CA 1.451 -0.378 0 O-C-N 121.614 -0.679 . . . . 0.38 111.396 177.15 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . 0.514 ' HA ' ' HE2' ' A' ' 49' ' ' LYS . 0.3 OUTLIER -60.3 -47.2 87.04 Favored 'General case' 0 C--N 1.33 -0.246 0 C-N-CA 118.791 -1.164 . . . . 1.0900000000000001 111.615 -177.292 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 3.5 tp10 -86.42 -59.64 2.22 Favored 'General case' 0 CA--C 1.532 0.268 0 CA-C-O 121.871 0.843 . . . . 2.8900000000000001 109.598 -176.27 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 19.2 mm-40 -73.57 -28.84 62.06 Favored 'General case' 0 CA--C 1.535 0.402 0 O-C-N 121.654 -0.654 . . . . 2.1899999999999999 110.621 -170.131 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -68.06 40.57 0.26 Allowed Glycine 0 CA--C 1.531 1.05 0 C-N-CA 126.509 2.004 . . . . 0.33000000000000002 114.715 172.332 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 20.9 t -146.45 22.59 1.31 Allowed 'General case' 0 N--CA 1.45 -0.432 0 O-C-N 120.778 -1.425 . . . . 1.8999999999999999 110.019 156.679 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -135.53 -23.3 1.44 Allowed 'General case' 0 C--N 1.342 0.282 0 N-CA-C 113.712 1.005 . . . . 2.2200000000000002 113.712 -167.539 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 22.0 mt -71.48 -41.65 69.09 Favored 'General case' 0 C--N 1.331 -0.233 0 O-C-N 121.404 -0.81 . . . . 0.41999999999999998 109.919 175.99 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 1.7 t 179.13 175.16 0.67 Allowed 'General case' 0 CA--C 1.533 0.305 0 C-N-CA 125.408 1.483 . . . . 0.52000000000000002 107.939 -174.741 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 39.4 t -60.88 -36.02 78.13 Favored 'General case' 0 CA--C 1.532 0.288 0 O-C-N 121.688 -0.632 . . . . 2.1699999999999999 109.781 168.888 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -65.59 -11.64 46.05 Favored 'General case' 0 N--CA 1.465 0.285 0 N-CA-C 112.468 0.544 . . . . 1.01 112.468 174.581 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -88.61 -7.17 72.2 Favored Glycine 0 C--O 1.221 -0.688 0 CA-C-O 119.124 -0.82 . . . . 0.39000000000000001 111.117 176.31 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 64.1 ttt180 -113.52 -14.1 12.72 Favored 'General case' 0 N--CA 1.458 -0.07 0 CA-C-N 118.875 1.337 . . . . 3.48 112.036 -178.672 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 19.9 p -64.48 -159.03 0.01 OUTLIER 'General case' 0 CA--C 1.539 0.536 0 C-N-CA 123.408 0.683 . . . . 0.78000000000000003 109.432 168.582 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 3.8 t-20 -53.05 145.85 12.35 Favored 'General case' 0 CA--C 1.53 0.196 0 O-C-N 120.403 -1.436 . . . . 1.75 110.271 -176.305 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -59.56 -31.87 69.83 Favored 'General case' 0 CA--C 1.535 0.368 0 CA-C-O 121.461 0.648 . . . . 3.3599999999999999 110.663 -176.278 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 64' ' ' ALA . . . . . 0.518 ' HB1' ' CE1' ' A' ' 20' ' ' HIS . . . -58.59 -36.19 73.6 Favored 'General case' 0 N--CA 1.453 -0.311 0 N-CA-C 112.968 0.729 . . . . 0.40999999999999998 112.968 174.531 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 8.1 mt-10 -70.93 -48.57 52.79 Favored 'General case' 0 CA--C 1.511 -0.533 0 CA-C-O 118.301 -0.857 . . . . 2.2200000000000002 110.261 174.599 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 30.6 t80 -46.49 -47.05 19.42 Favored 'General case' 0 CA--C 1.533 0.305 0 C-N-CA 124.385 1.074 . . . . 0.28000000000000003 111.448 175.145 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 78.9 t80 -65.33 -44.38 87.96 Favored 'General case' 0 CA--C 1.537 0.447 0 O-C-N 121.172 -0.955 . . . . 0.45000000000000001 111.12 177.29 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -66.16 -51.34 58.77 Favored 'General case' 0 CA--C 1.539 0.554 0 C-N-CA 123.959 0.904 . . . . 0.28000000000000003 112.668 -174.331 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -60.72 -40.06 90.92 Favored 'General case' 0 C--N 1.332 -0.186 0 O-C-N 120.858 -1.151 . . . . 3.5899999999999999 110.618 172.451 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -56.18 -40.68 74.31 Favored 'General case' 0 C--O 1.222 -0.362 0 CA-C-N 118.727 0.694 . . . . 0.51000000000000001 110.176 174.72 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -55.75 -49.89 71.88 Favored 'General case' 0 N--CA 1.465 0.298 0 C-N-CA 124.513 1.125 . . . . 3.4500000000000002 111.833 172.137 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -50.8 -56.65 11.11 Favored 'General case' 0 CA--C 1.531 0.236 0 N-CA-C 109.222 -0.659 . . . . 3.9300000000000002 109.222 176.739 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 73' ' ' LEU . . . . . 0.591 ' CB ' HG21 ' A' ' 85' ' ' VAL . 0.1 OUTLIER -66.4 -25.91 66.99 Favored 'General case' 0 C--N 1.327 -0.402 0 C-N-CA 124.346 1.059 . . . . 0.48999999999999999 111.236 -175.511 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 74' ' ' MET . . . . . 0.403 ' HA ' ' CE2' ' A' ' 93' ' ' PHE . 0.2 OUTLIER -63.49 -39.16 93.71 Favored 'General case' 0 C--O 1.231 0.125 0 CA-C-N 118.646 0.657 . . . . 2.3399999999999999 109.912 -179.42 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 7.1 p80 -97.62 -9.72 26.4 Favored 'General case' 0 CA--C 1.531 0.246 0 CA-C-O 116.277 -1.821 . . . . 0.96999999999999997 114.191 179.331 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 5.1 m -36.2 114.88 0.31 Allowed 'General case' 0 CA--C 1.512 -0.511 0 CA-C-N 120.698 1.59 . . . . 1.1200000000000001 111.162 -173.303 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -51.62 -37.25 49.3 Favored 'General case' 0 N--CA 1.448 -0.568 0 CA-C-N 114.259 -1.337 . . . . 1.04 110.7 -173.67 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 53.9 t0 -73.41 107.19 5.57 Favored 'General case' 0 N--CA 1.452 -0.365 0 C-N-CA 116.95 -1.9 . . . . 2.3999999999999999 109.563 164.955 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 20.9 p-80 -38.97 -38.22 0.43 Allowed 'General case' 0 N--CA 1.454 -0.234 0 C-N-CA 125.247 1.419 . . . . 4.5899999999999999 112.5 169.431 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -53.89 -54.67 35.48 Favored 'General case' 0 N--CA 1.449 -0.485 0 CA-C-N 118.197 0.453 . . . . 0.57999999999999996 109.789 -179.23 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -57.06 -35.88 69.86 Favored 'General case' 0 CA--C 1.514 -0.431 0 C-N-CA 122.957 0.503 . . . . 4.5800000000000001 111.852 -175.238 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 22.0 mtp180 -61.97 -50.03 73.74 Favored 'General case' 0 N--CA 1.449 -0.52 0 C-N-CA 119.744 -0.783 . . . . 2.2599999999999998 109.397 175.987 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 1.6 mm? -67.24 -18.54 65.27 Favored 'General case' 0 N--CA 1.456 -0.17 0 CA-C-O 118.093 -0.956 . . . . 0.53000000000000003 113.41 176.743 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 2.5 mptm? -65.44 -50.47 65.27 Favored 'General case' 0 CA--C 1.517 -0.294 0 CA-C-N 120.65 1.568 . . . . 1.4099999999999999 107.413 169.827 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 85' ' ' VAL . . . . . 0.591 HG21 ' CB ' ' A' ' 73' ' ' LEU . 94.4 t -57.39 -50.17 77.81 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.528 0 CA-C-O 118.85 -0.595 . . . . 0.46999999999999997 110.458 176.387 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -62.38 -52.56 63.13 Favored 'General case' 0 N--CA 1.45 -0.432 0 CA-C-N 119.472 1.033 . . . . 2.21 111.223 -173.518 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 29.5 pttt -63.58 -40.25 96.47 Favored 'General case' 0 CA--C 1.53 0.176 0 O-C-N 121.78 -0.575 . . . . 2.4900000000000002 109.96 -175.531 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 50.8 m-20 -72.14 -28.47 63.28 Favored 'General case' 0 C--O 1.224 -0.249 0 C-N-CA 122.763 0.425 . . . . 0.98999999999999999 110.635 -178.855 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -141.43 74.7 23.64 Favored Pre-proline 0 C--O 1.237 0.419 0 C-N-CA 125.901 1.68 . . . . 0.41999999999999998 108.914 -170.559 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 85.5 Cg_endo -78.29 68.55 7.9 Favored 'Trans proline' 0 N--CA 1.457 -0.655 0 C-N-CA 123.874 3.05 . . . . 1.8600000000000001 110.146 -171.307 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 1.2 ptmt 166.47 -55.23 0.0 OUTLIER 'General case' 0 C--O 1.224 -0.272 0 C-N-CA 126.432 1.893 . . . . 2.1800000000000002 111.204 -167.083 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 6.0 m -56.47 -44.03 80.18 Favored 'General case' 0 CA--C 1.518 -0.265 0 CA-C-N 120.071 1.305 . . . . 0.47999999999999998 110.514 -178.404 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 93' ' ' PHE . . . . . 0.403 ' CE2' ' HA ' ' A' ' 74' ' ' MET . 13.9 t80 -57.16 -48.87 77.65 Favored 'General case' 0 CA--C 1.513 -0.475 0 C-N-CA 120.073 -0.651 . . . . 2.0099999999999998 110.68 175.865 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 19.3 tt0 -59.87 -28.97 67.99 Favored 'General case' 0 N--CA 1.443 -0.779 0 CA-C-N 114.93 -1.032 . . . . 1.6399999999999999 110.844 -179.104 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 2.6 t80 -63.26 -57.02 11.81 Favored 'General case' 0 N--CA 1.457 -0.113 0 C-N-CA 124.258 1.023 . . . . 1.1200000000000001 109.133 -176.213 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 3.3 mp -60.24 -42.69 91.35 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.302 0 N-CA-C 108.498 -0.927 . . . . 0.83999999999999997 108.498 177.069 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 12.8 t-20 -56.89 -36.34 70.0 Favored 'General case' 0 CA--C 1.537 0.466 0 CA-C-N 117.836 0.289 . . . . 1.8999999999999999 111.589 -177.892 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.462 0.144 0 C-N-CA 125.172 1.389 . . . . 2.1299999999999999 109.399 175.756 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 CA--C 1.52 -0.175 0 CA-C-O 120.904 0.383 . . . . 3.6800000000000002 110.638 . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 0.7 OUTLIER -64.59 -38.88 83.77 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.303 0 N-CA-C 112.069 0.396 . . . . 0.45000000000000001 112.069 179.354 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 12.4 t60 -59.29 -56.18 25.37 Favored 'General case' 0 CA--C 1.53 0.184 0 N-CA-C 107.741 -1.207 . . . . 0.54000000000000004 107.741 -179.67 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 34.3 mt-10 -57.87 -37.55 74.13 Favored 'General case' 0 N--CA 1.451 -0.418 0 C-N-CA 124.406 1.083 . . . . 2.4199999999999999 111.057 178.507 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -54.47 -52.15 62.77 Favored 'General case' 0 CA--C 1.521 -0.165 0 CA-C-N 119.457 1.026 . . . . 3.48 109.871 173.878 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -47.82 -46.37 25.23 Favored Glycine 0 CA--C 1.526 0.75 0 N-CA-C 110.696 -0.961 . . . . 0.57999999999999996 110.696 173.849 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 20' ' ' HIS . . . . . 0.536 ' CE1' ' HB1' ' A' ' 64' ' ' ALA . 2.6 t60 -65.66 -45.97 80.9 Favored 'General case' 0 N--CA 1.454 -0.248 0 O-C-N 121.951 -0.735 . . . . 1.8 112.272 -177.883 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -61.78 -34.32 75.68 Favored 'General case' 0 N--CA 1.452 -0.353 0 O-C-N 120.925 -1.109 . . . . 1.1000000000000001 109.123 179.298 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 94.2 t -76.77 -26.88 16.48 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.428 0 C-N-CA 120.233 -0.587 . . . . 1.6299999999999999 110.284 179.509 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 34.7 t0 . . . . . 0 N--CA 1.456 -0.171 0 CA-C-O 121.953 0.883 . . . . 2.3500000000000001 110.328 172.141 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 2.5 m-20 . . . . . 0 CA--C 1.521 -0.169 0 N-CA-C 109.072 -0.714 . . . . 3.2799999999999998 109.072 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 11.3 mm -49.52 -56.6 2.81 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.229 0 C-N-CA 125.329 1.451 . . . . 0.68999999999999995 108.922 -178.443 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 28.9 t80 -61.69 -37.5 84.37 Favored 'General case' 0 N--CA 1.453 -0.311 0 C-N-CA 124.614 1.166 . . . . 0.51000000000000001 112.337 175.551 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . 0.464 ' HA ' ' HE2' ' A' ' 49' ' ' LYS . 0.2 OUTLIER -62.0 -45.17 94.77 Favored 'General case' 0 CA--C 1.519 -0.218 0 CA-C-N 119.652 1.115 . . . . 1.3700000000000001 111.1 -175.502 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 2.9 tp10 -80.19 -67.51 0.76 Allowed 'General case' 0 N--CA 1.451 -0.425 0 CA-C-O 122.387 1.089 . . . . 2.6200000000000001 108.962 179.074 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . 0.583 ' OE2' ' HE2' ' A' ' 91' ' ' LYS . 59.2 mm-40 -76.45 -19.69 57.8 Favored 'General case' 0 N--CA 1.453 -0.293 0 C-N-CA 123.389 0.675 . . . . 3.0499999999999998 111.51 -164.773 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -68.83 36.31 0.28 Allowed Glycine 0 CA--C 1.532 1.145 0 C-N-CA 124.393 0.997 . . . . 0.59999999999999998 113.12 167.684 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 59.9 p -148.84 23.63 0.97 Allowed 'General case' 0 N--CA 1.448 -0.532 0 O-C-N 120.444 -1.621 . . . . 1.8 110.855 161.488 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 58.7 t-20 -135.51 -43.52 0.69 Allowed 'General case' 0 CA--C 1.52 -0.209 0 CA-C-O 120.896 0.379 . . . . 2.3300000000000001 111.444 -160.15 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 20.6 mt -66.14 -37.16 85.0 Favored 'General case' 0 C--N 1.331 -0.205 0 C-N-CA 120.445 -0.502 . . . . 0.47999999999999998 110.674 -179.41 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 2.7 t 175.78 173.1 0.32 Allowed 'General case' 0 CA--C 1.533 0.301 0 C-N-CA 125.269 1.428 . . . . 0.60999999999999999 108.193 -173.136 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 8.8 p -64.04 -36.3 83.54 Favored 'General case' 0 N--CA 1.455 -0.188 0 C-N-CA 123.889 0.876 . . . . 2.29 110.504 172.666 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -64.38 -14.8 58.52 Favored 'General case' 0 N--CA 1.464 0.266 0 N-CA-C 112.041 0.385 . . . . 1.02 112.041 172.247 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -75.57 -13.6 82.8 Favored Glycine 0 N--CA 1.443 -0.885 0 N-CA-C 110.848 -0.901 . . . . 0.42999999999999999 110.848 174.339 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 3.6 tmt_? -113.75 -8.65 13.21 Favored 'General case' 0 CA--C 1.52 -0.174 0 CA-C-N 118.967 1.384 . . . . 2.7999999999999998 113.028 -171.34 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 18.8 p -69.09 -115.21 0.0 OUTLIER 'General case' 0 C--N 1.327 -0.377 0 C-N-CA 124.368 1.067 . . . . 1.3899999999999999 110.042 177.215 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 9.8 t-20 -86.94 154.1 21.07 Favored 'General case' 0 N--CA 1.454 -0.228 0 O-C-N 120.553 -1.342 . . . . 2.3500000000000001 107.724 177.829 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 78.8 tt0 -58.68 -34.57 71.41 Favored 'General case' 0 CA--C 1.535 0.383 0 CA-C-N 118.87 0.759 . . . . 2.9500000000000002 109.731 175.416 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 64' ' ' ALA . . . . . 0.536 ' HB1' ' CE1' ' A' ' 20' ' ' HIS . . . -65.93 -29.04 69.39 Favored 'General case' 0 N--CA 1.455 -0.215 0 N-CA-C 113.128 0.788 . . . . 0.63 113.128 177.521 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 11.9 mt-10 -77.42 -45.68 25.05 Favored 'General case' 0 CA--C 1.513 -0.471 0 O-C-N 121.075 -1.016 . . . . 2.2200000000000002 110.05 175.856 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 49.8 t80 -47.64 -48.71 28.55 Favored 'General case' 0 C--N 1.33 -0.271 0 C-N-CA 125.717 1.607 . . . . 0.56000000000000005 111.27 172.19 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 56.5 t80 -63.26 -43.78 97.0 Favored 'General case' 0 CA--C 1.538 0.517 0 O-C-N 121.174 -0.954 . . . . 0.81000000000000005 110.833 177.013 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -66.49 -52.33 47.22 Favored 'General case' 0 CA--C 1.539 0.534 0 O-C-N 121.114 -0.991 . . . . 0.46999999999999997 112.851 -174.185 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -57.63 -39.8 77.75 Favored 'General case' 0 C--N 1.331 -0.215 0 O-C-N 120.701 -1.249 . . . . 4.0 111.017 170.382 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -56.71 -44.0 81.12 Favored 'General case' 0 N--CA 1.451 -0.416 0 CA-C-O 118.4 -0.81 . . . . 0.47999999999999998 110.251 176.648 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 71.3 t80 -55.92 -49.98 71.95 Favored 'General case' 0 N--CA 1.466 0.371 0 CA-C-N 119.725 1.148 . . . . 3.0699999999999998 111.672 173.517 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 64.1 ttt180 -47.98 -57.59 5.55 Favored 'General case' 0 CA--C 1.533 0.325 0 CA-C-N 118.568 0.622 . . . . 2.3700000000000001 109.899 177.537 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 73' ' ' LEU . . . . . 0.601 ' CB ' HG21 ' A' ' 85' ' ' VAL . 0.1 OUTLIER -67.3 -27.6 67.31 Favored 'General case' 0 C--N 1.327 -0.385 0 C-N-CA 124.538 1.135 . . . . 0.52000000000000002 111.263 -176.476 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 1.2 ttp -62.29 -38.32 88.91 Favored 'General case' 0 N--CA 1.454 -0.244 0 C-N-CA 122.814 0.445 . . . . 2.3999999999999999 109.852 179.763 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 23.1 p80 -91.27 -36.61 13.8 Favored 'General case' 0 N--CA 1.452 -0.334 0 CA-C-O 115.886 -2.007 . . . . 1.01 111.572 -175.083 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 18.6 m -6.11 118.4 0.01 OUTLIER 'General case' 0 C--N 1.347 0.492 0 C-N-CA 128.493 2.717 . . . . 1.01 114.575 -174.655 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 4.9 p -46.21 -47.24 17.91 Favored 'General case' 0 N--CA 1.451 -0.376 0 C-N-CA 125.234 1.414 . . . . 0.96999999999999997 109.638 175.136 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 12.9 t0 -70.36 114.18 8.23 Favored 'General case' 0 N--CA 1.451 -0.393 0 CA-C-O 122.13 0.967 . . . . 2.3900000000000001 109.929 169.7 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 13.2 m170 -63.04 -29.41 70.8 Favored 'General case' 0 N--CA 1.451 -0.377 0 CA-C-N 115.779 -0.646 . . . . 6.0999999999999996 111.189 176.964 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -63.21 -46.1 88.59 Favored 'General case' 0 N--CA 1.453 -0.29 0 CA-C-N 119.313 0.96 . . . . 1.25 110.07 179.369 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -48.66 -41.99 33.09 Favored 'General case' 0 C--O 1.231 0.13 0 C-N-CA 124.554 1.142 . . . . 4.2300000000000004 110.771 175.105 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -64.35 -52.52 57.94 Favored 'General case' 0 C--N 1.33 -0.247 0 N-CA-C 109.417 -0.586 . . . . 3.1600000000000001 109.417 179.39 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . 0.418 HD13 ' HA ' ' A' ' 83' ' ' LEU . 1.3 mm? -66.19 -16.88 64.36 Favored 'General case' 0 CA--C 1.522 -0.128 0 N-CA-C 112.861 0.689 . . . . 1.25 112.861 179.239 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 33.5 mttt -66.4 -51.24 59.04 Favored 'General case' 0 N--CA 1.45 -0.454 0 N-CA-C 106.953 -1.499 . . . . 2.1400000000000001 106.953 168.865 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 85' ' ' VAL . . . . . 0.601 HG21 ' CB ' ' A' ' 73' ' ' LEU . 98.8 t -56.18 -46.3 81.17 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.449 0 CA-C-O 118.195 -0.907 . . . . 0.60999999999999999 111.994 174.557 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 1.6 mt-30 -66.84 -49.89 64.27 Favored 'General case' 0 C--O 1.224 -0.252 0 CA-C-N 120.662 1.574 . . . . 2.21 112.183 -175.589 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 5.3 pttp -68.11 -38.39 82.22 Favored 'General case' 0 C--O 1.226 -0.161 0 O-C-N 121.178 -0.951 . . . . 3.96 109.978 -174.678 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 3.1 m120 -62.38 -45.42 93.24 Favored 'General case' 0 N--CA 1.453 -0.322 0 N-CA-C 108.866 -0.79 . . . . 1.3400000000000001 108.866 175.883 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -128.53 86.19 58.35 Favored Pre-proline 0 N--CA 1.451 -0.385 0 C-N-CA 126.324 1.85 . . . . 0.52000000000000002 109.755 -172.467 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 92.1 Cg_endo -80.46 46.18 2.18 Favored 'Trans proline' 0 CA--C 1.539 0.737 0 C-N-CA 123.361 2.707 . . . . 1.8500000000000001 111.596 -176.899 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 91' ' ' LYS . . . . . 0.583 ' HE2' ' OE2' ' A' ' 51' ' ' GLU . 21.1 pttt -160.88 -53.2 0.05 OUTLIER 'General case' 0 N--CA 1.452 -0.339 0 C-N-CA 125.443 1.497 . . . . 2.6099999999999999 110.743 177.27 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 3.4 m -50.43 -47.06 56.83 Favored 'General case' 0 N--CA 1.464 0.228 0 C-N-CA 123.649 0.78 . . . . 0.66000000000000003 111.781 -178.135 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 12.2 t80 -57.47 -49.56 75.89 Favored 'General case' 0 CA--C 1.516 -0.343 0 CA-C-O 121.793 0.806 . . . . 2.3900000000000001 110.883 178.845 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 1.4 mt-30 -59.69 -26.48 65.61 Favored 'General case' 0 N--CA 1.446 -0.634 0 CA-C-N 114.657 -1.156 . . . . 2.04 110.773 -179.027 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 3.6 t80 -66.93 -58.39 5.07 Favored 'General case' 0 N--CA 1.451 -0.383 0 C-N-CA 123.586 0.755 . . . . 1.05 110.227 -178.16 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 96' ' ' ILE . . . . . 0.402 HD12 ' H ' ' A' ' 96' ' ' ILE . 3.3 mp -55.63 -42.54 69.41 Favored 'Isoleucine or valine' 0 CA--C 1.528 0.098 0 N-CA-C 108.701 -0.852 . . . . 1.1799999999999999 108.701 175.638 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 21.8 t-20 -55.8 -43.91 77.33 Favored 'General case' 0 CA--C 1.537 0.452 0 CA-C-O 120.886 0.374 . . . . 2.3100000000000001 111.181 -179.869 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 CA--C 1.533 0.318 0 C-N-CA 124.44 1.096 . . . . 2.27 110.178 177.523 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 9.2 t80 . . . . . 0 C--O 1.219 -0.541 0 N-CA-C 108.71 -0.848 . . . . 2.73 108.71 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -59.19 -37.16 67.01 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.389 0 N-CA-C 113.087 0.773 . . . . 0.39000000000000001 113.087 176.421 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 6.4 t60 -61.03 -54.01 50.09 Favored 'General case' 0 N--CA 1.465 0.277 0 N-CA-C 106.354 -1.721 . . . . 0.46999999999999997 106.354 177.775 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 67.9 mt-10 -53.26 -40.64 64.8 Favored 'General case' 0 C--O 1.223 -0.333 0 C-N-CA 122.698 0.399 . . . . 2.5499999999999998 110.512 176.988 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -60.84 -50.17 74.54 Favored 'General case' 0 CA--C 1.518 -0.251 0 C-N-CA 125.173 1.389 . . . . 2.0600000000000001 109.379 -175.291 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -49.04 -46.33 33.11 Favored Glycine 0 CA--C 1.528 0.9 0 N-CA-C 110.447 -1.061 . . . . 0.42999999999999999 110.447 173.161 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 20' ' ' HIS . . . . . 0.539 ' CE1' ' HB1' ' A' ' 64' ' ' ALA . 2.1 t60 -63.34 -42.15 98.93 Favored 'General case' 0 N--CA 1.451 -0.417 0 O-C-N 122.035 -0.685 . . . . 1.8 111.784 179.571 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -65.5 -30.42 71.18 Favored 'General case' 0 N--CA 1.452 -0.372 0 O-C-N 121.378 -0.826 . . . . 0.65000000000000002 109.956 -179.938 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 82.5 t -70.01 -40.05 78.1 Favored 'Isoleucine or valine' 0 C--O 1.232 0.165 0 O-C-N 121.328 -0.857 . . . . 0.88 109.609 176.355 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 3.6 m-20 . . . . . 0 C--N 1.334 -0.099 0 N-CA-C 112.047 0.388 . . . . 2.5 112.047 172.375 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 12.8 t70 . . . . . 0 N--CA 1.465 0.308 0 CA-C-O 121.597 0.713 . . . . 2.3700000000000001 111.032 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 47' ' ' ILE . . . . . 0.474 HD13 ' HE3' ' A' ' 91' ' ' LYS . 5.7 mm -50.63 -52.59 15.81 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.308 0 C-N-CA 124.559 1.144 . . . . 0.62 108.677 177.461 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 20.0 t80 -67.52 -33.7 75.6 Favored 'General case' 0 N--CA 1.452 -0.332 0 C-N-CA 123.403 0.681 . . . . 0.78000000000000003 112.043 177.201 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . 0.508 ' HE2' ' N ' ' A' ' 49' ' ' LYS . 0.6 OUTLIER -61.93 -49.16 77.25 Favored 'General case' 0 CA--C 1.519 -0.235 0 CA-C-N 119.899 1.227 . . . . 1.8300000000000001 109.195 -174.44 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 7.3 mm-40 -80.08 -66.17 0.91 Allowed 'General case' 0 N--CA 1.448 -0.563 0 CA-C-O 122.14 0.971 . . . . 2.79 109.089 -178.461 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 17.8 mm-40 -73.79 -21.52 60.14 Favored 'General case' 0 C--O 1.235 0.298 0 C-N-CA 123.442 0.697 . . . . 2.5699999999999998 110.659 -164.791 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -68.2 37.52 0.25 Allowed Glycine 0 CA--C 1.531 1.064 0 C-N-CA 125.429 1.49 . . . . 0.34999999999999998 113.454 169.073 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 61.5 p -148.94 23.25 0.97 Allowed 'General case' 0 N--CA 1.446 -0.663 0 O-C-N 120.673 -1.486 . . . . 2.04 110.839 163.388 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 3.2 t-20 -136.19 -39.84 0.67 Allowed 'General case' 0 CA--C 1.517 -0.301 0 N-CA-C 113.147 0.795 . . . . 1.5600000000000001 113.147 -164.799 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . 0.643 HD22 HG22 ' A' ' 85' ' ' VAL . 16.2 mt -66.96 -36.86 83.15 Favored 'General case' 0 C--N 1.332 -0.194 0 C-N-CA 120.214 -0.594 . . . . 0.35999999999999999 110.473 -178.533 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 1.2 t 178.83 170.3 0.87 Allowed 'General case' 0 C--N 1.331 -0.206 0 C-N-CA 125.451 1.5 . . . . 0.48999999999999999 107.637 -178.581 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 9.6 m -57.56 -35.35 70.22 Favored 'General case' 0 N--CA 1.453 -0.279 0 C-N-CA 123.175 0.59 . . . . 0.92000000000000004 110.554 170.056 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -58.5 -33.84 70.27 Favored 'General case' 0 C--N 1.34 0.154 0 CA-C-N 117.837 0.289 . . . . 1.1699999999999999 110.418 173.842 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -63.96 -16.36 59.48 Favored Glycine 0 C--O 1.22 -0.74 0 CA-C-O 119.106 -0.83 . . . . 0.54000000000000004 111.792 178.481 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 50.7 ttt-85 -104.6 -8.55 18.88 Favored 'General case' 0 N--CA 1.457 -0.111 0 CA-C-N 119.184 1.492 . . . . 2.1299999999999999 113.735 178.942 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 44.0 p -67.65 -139.12 0.0 OUTLIER 'General case' 0 CA--C 1.54 0.596 0 CA-C-O 121.205 0.526 . . . . 0.97999999999999998 110.585 174.567 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 1.1 t-20 -65.22 149.48 49.86 Favored 'General case' 0 N--CA 1.453 -0.307 0 O-C-N 120.067 -1.646 . . . . 1.95 108.703 178.473 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 3.4 tm-20 -60.58 -32.69 71.78 Favored 'General case' 0 CA--C 1.532 0.282 0 O-C-N 121.915 -0.491 . . . . 3.1499999999999999 110.259 179.454 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 64' ' ' ALA . . . . . 0.539 ' HB1' ' CE1' ' A' ' 20' ' ' HIS . . . -61.62 -29.76 70.26 Favored 'General case' 0 N--CA 1.454 -0.246 0 N-CA-C 113.798 1.036 . . . . 0.62 113.798 175.166 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 2.1 mt-10 -81.44 -41.03 22.44 Favored 'General case' 0 CA--C 1.508 -0.653 0 O-C-N 121.169 -0.957 . . . . 2.52 110.597 176.776 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 37.3 t80 -50.42 -47.7 56.52 Favored 'General case' 0 N--CA 1.45 -0.437 0 C-N-CA 124.194 0.997 . . . . 0.31 111.155 170.283 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 42.1 t80 -64.59 -46.02 84.48 Favored 'General case' 0 CA--C 1.538 0.504 0 O-C-N 121.34 -0.85 . . . . 0.68000000000000005 109.98 176.979 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -61.28 -54.61 41.88 Favored 'General case' 0 CA--C 1.539 0.53 0 O-C-N 121.082 -1.011 . . . . 0.26000000000000001 113.061 -174.297 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -57.28 -39.86 76.56 Favored 'General case' 0 C--N 1.331 -0.211 0 O-C-N 121.008 -1.057 . . . . 3.8999999999999999 110.86 171.511 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -56.69 -42.18 78.64 Favored 'General case' 0 N--CA 1.453 -0.316 0 CA-C-N 119.15 0.886 . . . . 0.35999999999999999 110.806 175.995 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 76.7 t80 -58.53 -49.66 76.59 Favored 'General case' 0 N--CA 1.464 0.261 0 CA-C-N 119.912 1.233 . . . . 3.0699999999999998 111.633 172.821 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 22.8 ttp180 -47.84 -57.75 5.24 Favored 'General case' 0 N--CA 1.465 0.284 0 CA-C-N 119.238 0.926 . . . . 2.6299999999999999 110.203 177.449 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -63.6 -30.15 71.3 Favored 'General case' 0 C--N 1.326 -0.414 0 C-N-CA 124.838 1.255 . . . . 0.45000000000000001 111.104 -177.153 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 1.2 ttp -59.2 -42.23 90.45 Favored 'General case' 0 C--O 1.233 0.227 0 C-N-CA 122.756 0.422 . . . . 2.5 110.488 -179.938 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 8.9 p80 -96.7 -6.12 37.17 Favored 'General case' 0 N--CA 1.455 -0.183 0 CA-C-O 116.365 -1.779 . . . . 0.89000000000000001 113.68 -177.181 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 16.6 m -36.94 126.93 0.91 Allowed 'General case' 0 N--CA 1.453 -0.29 0 CA-C-O 123.267 1.508 . . . . 1.02 111.905 -171.697 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 7.8 p -52.83 -44.95 67.08 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 112.849 -1.978 . . . . 1.1799999999999999 108.207 177.133 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 13.0 t0 -65.68 107.52 1.78 Allowed 'General case' 0 N--CA 1.45 -0.459 0 CA-C-O 121.863 0.84 . . . . 2.1400000000000001 108.91 166.687 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -57.58 -33.01 67.74 Favored 'General case' 0 N--CA 1.454 -0.266 0 CA-C-N 116.068 -0.515 . . . . 5.4100000000000001 110.432 177.452 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -61.95 -47.4 85.06 Favored 'General case' 0 N--CA 1.451 -0.38 0 CA-C-N 118.567 0.621 . . . . 0.67000000000000004 110.745 179.952 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 5.7 mt-10 -49.1 -41.44 35.66 Favored 'General case' 0 CA--C 1.519 -0.245 0 C-N-CA 123.943 0.897 . . . . 2.6000000000000001 110.908 178.444 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 2.2 mtp180 -62.45 -50.2 72.4 Favored 'General case' 0 C--N 1.327 -0.396 0 N-CA-C 109.056 -0.72 . . . . 2.8599999999999999 109.056 178.484 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 1.3 mm? -64.99 -18.18 65.06 Favored 'General case' 0 N--CA 1.451 -0.398 0 CA-C-O 117.682 -1.152 . . . . 0.45000000000000001 113.487 176.51 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 6.6 mttt -69.32 -48.8 60.38 Favored 'General case' 0 C--O 1.224 -0.27 0 CA-C-N 121.404 1.911 . . . . 1.27 107.511 168.774 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 85' ' ' VAL . . . . . 0.643 HG22 HD22 ' A' ' 55' ' ' LEU . 33.4 t -58.57 -42.61 85.19 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.596 0 CA-C-O 118.112 -0.947 . . . . 0.46999999999999997 111.449 176.237 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 1.3 mt-30 -69.44 -52.77 23.67 Favored 'General case' 0 C--O 1.224 -0.255 0 CA-C-N 121.253 1.842 . . . . 1.95 111.741 -179.949 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 35.6 tttt -51.96 -50.8 60.52 Favored 'General case' 0 N--CA 1.451 -0.393 0 C-N-CA 123.436 0.694 . . . . 2.2000000000000002 110.075 -177.661 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 4.0 m-20 -65.93 -46.08 79.51 Favored 'General case' 0 N--CA 1.449 -0.479 0 C-N-CA 123.389 0.676 . . . . 1.52 109.565 179.276 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -130.63 78.1 74.55 Favored Pre-proline 0 C--O 1.238 0.45 0 C-N-CA 125.672 1.589 . . . . 0.42999999999999999 110.847 -168.634 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 73.9 Cg_endo -74.7 15.9 0.66 Allowed 'Trans proline' 0 CA--C 1.536 0.594 0 C-N-CA 123.062 2.508 . . . . 1.51 112.683 -175.233 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 91' ' ' LYS . . . . . 0.474 ' HE3' HD13 ' A' ' 47' ' ' ILE . 7.9 ptmt -128.69 -46.43 1.29 Allowed 'General case' 0 N--CA 1.451 -0.421 0 C-N-CA 125.773 1.629 . . . . 2.6600000000000001 109.526 -177.751 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 3.3 m -54.61 -49.4 70.56 Favored 'General case' 0 N--CA 1.464 0.242 0 CA-C-N 119.533 1.061 . . . . 0.33000000000000002 111.067 176.227 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 22.5 t80 -59.01 -50.48 73.92 Favored 'General case' 0 CA--C 1.51 -0.583 0 C-N-CA 119.927 -0.709 . . . . 1.8400000000000001 110.428 -179.724 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 22.4 tt0 -57.72 -29.63 64.89 Favored 'General case' 0 N--CA 1.444 -0.732 0 CA-C-N 114.69 -1.141 . . . . 2.4199999999999999 110.1 -177.158 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 13.1 t80 -66.07 -58.42 5.52 Favored 'General case' 0 N--CA 1.45 -0.45 0 C-N-CA 123.358 0.663 . . . . 1.45 109.34 -177.882 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 3.2 mp -55.02 -41.99 62.03 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.217 0 N-CA-C 109.297 -0.631 . . . . 0.83999999999999997 109.297 175.718 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 14.0 t-20 -60.98 -35.73 77.58 Favored 'General case' 0 N--CA 1.455 -0.187 0 C-N-CA 123.382 0.673 . . . . 2.29 111.772 -175.957 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 27.0 t70 . . . . . 0 CA--C 1.528 0.126 0 C-N-CA 123.585 0.754 . . . . 2.1699999999999999 110.333 174.481 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 16.0 t80 . . . . . 0 C--O 1.223 -0.303 0 N-CA-C 109.504 -0.554 . . . . 3.3700000000000001 109.504 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER -60.74 -33.9 56.86 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.328 0 O-C-N 121.724 -0.61 . . . . 0.60999999999999999 111.708 -179.894 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 13.6 t60 -61.7 -51.56 67.88 Favored 'General case' 0 CA--C 1.536 0.442 0 N-CA-C 107.796 -1.186 . . . . 0.72999999999999998 107.796 177.607 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 43.6 mt-10 -54.13 -40.69 67.61 Favored 'General case' 0 C--O 1.225 -0.22 0 O-C-N 121.013 -1.054 . . . . 2.29 110.668 175.173 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 1.3 t80 -58.23 -41.37 83.96 Favored 'General case' 0 N--CA 1.453 -0.314 0 C-N-CA 123.244 0.618 . . . . 2.3700000000000001 109.931 178.752 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -49.87 -49.71 34.4 Favored Glycine 0 CA--C 1.529 0.927 0 N-CA-C 111.226 -0.75 . . . . 0.68999999999999995 111.226 170.47 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 70.8 m-70 -57.15 -52.16 66.42 Favored 'General case' 0 C--O 1.227 -0.11 0 CA-C-N 117.93 0.865 . . . . 3.7999999999999998 110.917 176.833 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -60.59 -27.42 67.71 Favored 'General case' 0 N--CA 1.454 -0.226 0 CA-C-N 117.802 0.273 . . . . 0.81000000000000005 111.691 -177.904 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 54.2 t -71.83 -40.12 68.71 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.212 0 O-C-N 121.15 -0.969 . . . . 1.02 109.563 176.51 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 3.2 t0 . . . . . 0 N--CA 1.451 -0.419 0 N-CA-C 112.215 0.45 . . . . 2.4900000000000002 112.215 179.837 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 94.7 m-20 . . . . . 0 N--CA 1.465 0.291 0 CA-C-O 120.431 0.158 . . . . 3.8100000000000001 111.11 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 8.8 mm -47.65 -60.58 0.59 Allowed 'Isoleucine or valine' 0 CA--C 1.536 0.406 0 C-N-CA 125.692 1.597 . . . . 0.75 108.955 175.963 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 23.7 t80 -65.35 -30.6 71.45 Favored 'General case' 0 N--CA 1.454 -0.257 0 O-C-N 121.031 -1.043 . . . . 0.64000000000000001 112.304 178.185 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -65.22 -49.55 69.26 Favored 'General case' 0 N--CA 1.454 -0.251 0 O-C-N 120.256 -1.527 . . . . 1.21 109.76 -176.942 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 26.8 mm-40 -85.94 -57.14 3.15 Favored 'General case' 0 N--CA 1.449 -0.499 0 CA-C-O 121.452 0.644 . . . . 4.3300000000000001 109.557 -171.98 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 37.3 mt-10 -80.95 -23.32 38.92 Favored 'General case' 0 C--O 1.235 0.329 0 O-C-N 121.775 -0.578 . . . . 3.54 110.502 -171.692 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . 0.42 ' HA2' ' CD1' ' A' ' 66' ' ' PHE . . . -71.17 43.52 0.67 Allowed Glycine 0 CA--C 1.531 1.039 0 C-N-CA 125.791 1.662 . . . . 0.39000000000000001 113.776 168.934 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 34.6 t -160.25 35.79 0.17 Allowed 'General case' 0 N--CA 1.447 -0.62 0 C-N-CA 125.022 1.329 . . . . 1.79 108.023 162.9 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 31.9 t30 -146.34 -34.76 0.29 Allowed 'General case' 0 C--N 1.341 0.228 0 N-CA-C 113.589 0.959 . . . . 1.8700000000000001 113.589 -169.699 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 18.8 mt -64.01 -41.28 97.52 Favored 'General case' 0 CA--C 1.53 0.187 0 O-C-N 121.4 -0.813 . . . . 0.55000000000000004 110.124 174.912 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 1.6 t 177.7 174.67 0.5 Allowed 'General case' 0 CA--C 1.534 0.337 0 C-N-CA 125.907 1.683 . . . . 0.65000000000000002 107.67 -177.116 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 74.5 m -59.57 -31.5 69.49 Favored 'General case' 0 CA--C 1.529 0.166 0 O-C-N 121.584 -0.697 . . . . 0.96999999999999997 110.472 166.935 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -64.65 -19.87 65.97 Favored 'General case' 0 CA--C 1.535 0.403 0 CA-C-N 118.066 0.394 . . . . 1.8899999999999999 111.755 176.112 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -84.29 -11.9 77.21 Favored Glycine 0 N--CA 1.446 -0.642 0 CA-C-O 119.177 -0.791 . . . . 0.40999999999999998 111.394 176.494 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 3.9 tmt_? -107.18 -13.85 15.05 Favored 'General case' 0 N--CA 1.455 -0.194 0 CA-C-N 118.29 1.045 . . . . 2.6699999999999999 112.132 -178.106 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 1.1 p -62.73 -165.76 0.01 OUTLIER 'General case' 0 CA--C 1.538 0.501 0 C-N-CA 123.752 0.821 . . . . 1.0700000000000001 110.162 164.987 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 14.6 m-20 -49.52 148.53 2.77 Favored 'General case' 0 CA--C 1.528 0.122 0 O-C-N 121.268 -0.895 . . . . 2.1400000000000001 110.879 -178.679 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 60.4 tt0 -62.83 -27.86 69.61 Favored 'General case' 0 CA--C 1.533 0.322 0 CA-C-O 121.298 0.57 . . . . 2.6400000000000001 111.117 -177.547 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -54.46 -40.43 68.42 Favored 'General case' 0 N--CA 1.455 -0.201 0 O-C-N 121.553 -0.717 . . . . 0.68999999999999995 112.152 169.429 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 1.3 mt-10 -78.25 -39.37 40.39 Favored 'General case' 0 CA--C 1.507 -0.68 0 CA-C-O 118.418 -0.801 . . . . 2.8500000000000001 110.022 -178.059 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 66' ' ' PHE . . . . . 0.42 ' CD1' ' HA2' ' A' ' 52' ' ' GLY . 56.5 t80 -51.47 -50.87 58.98 Favored 'General case' 0 N--CA 1.452 -0.354 0 C-N-CA 123.863 0.865 . . . . 0.46999999999999997 111.354 171.735 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 79.1 t80 -62.89 -44.23 96.65 Favored 'General case' 0 CA--C 1.541 0.619 0 O-C-N 121.473 -0.767 . . . . 0.55000000000000004 110.132 177.426 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -64.57 -55.54 19.79 Favored 'General case' 0 CA--C 1.537 0.448 0 N-CA-C 113.795 1.035 . . . . 0.29999999999999999 113.795 -174.438 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -54.8 -39.44 68.47 Favored 'General case' 0 C--N 1.33 -0.244 0 O-C-N 120.665 -1.272 . . . . 3.8500000000000001 111.404 169.047 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -59.02 -35.58 73.52 Favored 'General case' 0 CA--C 1.534 0.345 0 CA-C-N 119.63 1.104 . . . . 0.40000000000000002 110.789 174.465 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -61.52 -53.33 57.87 Favored 'General case' 0 C--O 1.233 0.194 0 CA-C-N 119.085 0.857 . . . . 3.71 111.481 171.202 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 2.3 ttt180 -45.39 -64.53 0.7 Allowed 'General case' 0 CA--C 1.528 0.129 0 C-N-CA 123.202 0.601 . . . . 2.4300000000000002 109.966 177.548 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 73' ' ' LEU . . . . . 0.427 HD12 HG23 ' A' ' 85' ' ' VAL . 0.2 OUTLIER -51.08 -53.51 33.4 Favored 'General case' 0 C--N 1.326 -0.448 0 C-N-CA 126.363 1.865 . . . . 0.84999999999999998 110.063 -179.296 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -61.92 -30.15 70.7 Favored 'General case' 0 CA--C 1.535 0.37 0 O-C-N 121.742 -0.599 . . . . 2.8799999999999999 112.238 -172.43 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 1.7 p80 -90.9 -18.71 24.3 Favored 'General case' 0 N--CA 1.463 0.201 0 CA-C-O 118.049 -0.977 . . . . 1.2 112.215 176.115 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 5.1 m -55.36 112.69 1.16 Allowed 'General case' 0 N--CA 1.446 -0.63 0 CA-C-N 119.82 1.191 . . . . 1.8700000000000001 107.963 -173.989 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -44.74 -37.43 3.74 Favored 'General case' 0 C--N 1.325 -0.497 0 C-N-CA 125.684 1.593 . . . . 2.4300000000000002 110.908 -178.051 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 19.1 t0 -55.33 99.23 0.03 OUTLIER 'General case' 0 N--CA 1.449 -0.493 0 CA-C-O 122.721 1.248 . . . . 2.1400000000000001 111.439 168.348 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 14.2 p-80 -44.42 -36.73 3.01 Favored 'General case' 0 N--CA 1.449 -0.482 0 CA-C-N 114.467 -1.242 . . . . 4.9000000000000004 112.558 171.251 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -63.23 -53.71 48.84 Favored 'General case' 0 N--CA 1.449 -0.507 0 CA-C-N 119.365 0.984 . . . . 0.88 110.746 -178.202 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -50.21 -44.37 53.16 Favored 'General case' 0 N--CA 1.465 0.276 0 CA-C-N 119.235 0.925 . . . . 3.5600000000000001 109.525 178.287 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 44.0 mtp180 -62.59 -56.64 16.01 Favored 'General case' 0 N--CA 1.452 -0.327 0 CA-C-N 115.99 -0.55 . . . . 3.0299999999999998 110.576 -177.812 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 1.1 mm? -63.72 -17.81 63.38 Favored 'General case' 0 N--CA 1.448 -0.538 0 C-N-CA 123.516 0.727 . . . . 0.68000000000000005 112.634 179.491 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 45.5 mttt -70.09 -45.64 66.55 Favored 'General case' 0 CA--C 1.511 -0.552 0 CA-C-N 119.835 1.198 . . . . 1.1699999999999999 108.567 170.51 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 85' ' ' VAL . . . . . 0.427 HG23 HD12 ' A' ' 73' ' ' LEU . 57.2 t -54.28 -51.52 47.38 Favored 'Isoleucine or valine' 0 C--O 1.214 -0.791 0 C-N-CA 119.538 -0.865 . . . . 0.62 109.241 170.062 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 4.2 tm0? -67.06 -51.59 52.71 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 119.583 1.083 . . . . 2.8799999999999999 111.927 -167.598 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 7.8 ttmm -55.38 -44.81 76.45 Favored 'General case' 0 C--N 1.331 -0.22 0 C-N-CA 124.651 1.18 . . . . 2.6000000000000001 110.828 175.427 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 15.9 m-20 -77.63 -22.45 50.72 Favored 'General case' 0 CA--C 1.532 0.266 0 C-N-CA 122.732 0.413 . . . . 0.94999999999999996 111.458 -177.068 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -155.9 69.7 5.14 Favored Pre-proline 0 C--O 1.238 0.459 0 C-N-CA 125.492 1.517 . . . . 0.53000000000000003 109.365 -165.367 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 30.8 Cg_endo -61.22 -34.82 87.83 Favored 'Trans proline' 0 N--CA 1.449 -1.126 0 C-N-CA 121.873 1.716 . . . . 2.2000000000000002 109.911 -175.388 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 11.1 tttt -79.45 -44.05 22.1 Favored 'General case' 0 N--CA 1.448 -0.545 0 C-N-CA 124.974 1.31 . . . . 4.6200000000000001 110.414 -174.375 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 7.2 m -58.16 -47.4 83.49 Favored 'General case' 0 N--CA 1.464 0.269 0 CA-C-N 119.217 0.917 . . . . 0.56999999999999995 108.983 176.384 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 12.9 t80 -59.59 -45.39 92.01 Favored 'General case' 0 CA--C 1.501 -0.931 0 O-C-N 122.018 -0.426 . . . . 2.0 111.543 -178.265 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 46.8 tt0 -48.99 -44.26 40.97 Favored 'General case' 0 N--CA 1.443 -0.795 0 O-C-N 124.332 1.02 . . . . 3.0299999999999998 109.333 176.511 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 4.0 t80 -61.99 -54.31 43.46 Favored 'General case' 0 CA--C 1.529 0.148 0 N-CA-C 109.695 -0.483 . . . . 1.6299999999999999 109.695 -177.378 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 34.8 mm -59.72 -29.41 42.77 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.199 0 C-N-CA 123.518 0.727 . . . . 1.53 111.512 -178.361 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -78.36 -33.89 48.71 Favored 'General case' 0 N--CA 1.453 -0.282 0 O-C-N 121.195 -0.941 . . . . 1.6699999999999999 110.324 178.863 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 CA--C 1.53 0.199 0 C-N-CA 124.747 1.219 . . . . 2.1299999999999999 108.799 177.404 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 72.8 t80 . . . . . 0 N--CA 1.455 -0.22 0 CA-C-O 121.497 0.665 . . . . 2.4199999999999999 110.31 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 15' ' ' ILE . . . . . 0.45 HD12 ' CE1' ' A' ' 75' ' ' HIS . 0.8 OUTLIER -66.29 -28.95 45.1 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.259 0 O-C-N 121.177 -0.952 . . . . 0.81999999999999995 112.745 179.105 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 1.6 t-160 -58.82 -53.76 54.75 Favored 'General case' 0 C--N 1.342 0.248 0 N-CA-C 105.938 -1.875 . . . . 0.67000000000000004 105.938 174.607 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 7.4 mt-10 -53.74 -43.01 68.77 Favored 'General case' 0 C--O 1.223 -0.308 0 CA-C-O 118.824 -0.607 . . . . 2.5600000000000001 111.175 177.208 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 7.2 t80 -56.83 -44.94 82.58 Favored 'General case' 0 C--N 1.333 -0.137 0 CA-C-N 119.156 0.889 . . . . 2.1099999999999999 111.228 178.498 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -51.49 -49.64 44.89 Favored Glycine 0 CA--C 1.524 0.645 0 N-CA-C 110.198 -1.161 . . . . 0.57999999999999996 110.198 170.837 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 20' ' ' HIS . . . . . 0.506 ' CE1' ' HB1' ' A' ' 64' ' ' ALA . 2.0 t60 -59.28 -44.46 92.47 Favored 'General case' 0 N--CA 1.45 -0.473 0 O-C-N 121.59 -0.947 . . . . 1.75 111.641 -178.72 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -61.29 -32.56 72.4 Favored 'General case' 0 N--CA 1.452 -0.343 0 CA-C-N 118.398 0.544 . . . . 0.59999999999999998 109.849 178.212 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 3.5 t -67.16 -38.66 81.53 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.213 0 O-C-N 121.191 -0.943 . . . . 1.01 111.501 175.122 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 6.8 t0 . . . . . 0 C--N 1.333 -0.149 0 CA-C-O 120.9 0.381 . . . . 1.99 110.702 175.02 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 5.8 t70 . . . . . 0 N--CA 1.47 0.561 0 CA-C-O 121.344 0.592 . . . . 2.3199999999999998 109.483 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 47' ' ' ILE . . . . . 0.46 ' HA ' ' HE2' ' A' ' 91' ' ' LYS . 3.4 mm -50.99 -52.0 19.13 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.238 0 C-N-CA 124.989 1.316 . . . . 0.47999999999999998 107.989 -179.967 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 28.5 t80 -61.82 -36.18 80.41 Favored 'General case' 0 N--CA 1.45 -0.469 0 C-N-CA 124.852 1.261 . . . . 0.40000000000000002 113.665 173.845 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . 0.468 ' HA ' ' HE2' ' A' ' 49' ' ' LYS . 1.0 OUTLIER -59.54 -49.15 78.91 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 120.025 1.284 . . . . 1.0 110.926 -175.23 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 9.5 mm-40 -81.94 -64.02 1.27 Allowed 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 121.902 0.858 . . . . 2.3399999999999999 109.302 178.708 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 25.6 mm-40 -75.04 -24.05 58.24 Favored 'General case' 0 C--O 1.235 0.341 0 O-C-N 121.703 -0.623 . . . . 2.8199999999999998 111.208 -164.933 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -72.79 45.2 1.05 Allowed Glycine 0 N--CA 1.442 -0.956 0 C-N-CA 124.622 1.106 . . . . 0.34999999999999998 112.551 168.716 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 22.2 t -153.2 32.9 0.47 Allowed 'General case' 0 N--CA 1.449 -0.492 0 O-C-N 121.147 -1.208 . . . . 2.3199999999999998 109.058 151.89 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 2.2 t-20 -133.71 -45.56 0.81 Allowed 'General case' 0 CA--C 1.521 -0.171 0 CA-C-O 120.638 0.256 . . . . 1.5800000000000001 111.276 -168.433 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . 0.535 HD22 HG22 ' A' ' 85' ' ' VAL . 21.2 mt -59.86 -37.22 78.69 Favored 'General case' 0 CA--C 1.529 0.147 0 O-C-N 122.128 -0.357 . . . . 0.67000000000000004 111.273 -177.275 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER 178.27 173.15 0.66 Allowed 'General case' 0 CA--C 1.533 0.294 0 C-N-CA 126.031 1.733 . . . . 0.68999999999999995 107.171 -177.889 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 15.5 m -61.94 -35.08 77.38 Favored 'General case' 0 N--CA 1.455 -0.188 0 O-C-N 121.6 -0.687 . . . . 0.93000000000000005 110.719 169.178 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 1.1 m-85 -69.31 -8.05 42.68 Favored 'General case' 0 N--CA 1.467 0.401 0 O-C-N 121.804 -0.56 . . . . 1.23 112.096 172.32 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -80.65 -18.39 70.77 Favored Glycine 0 N--CA 1.445 -0.72 0 N-CA-C 110.693 -0.963 . . . . 0.45000000000000001 110.693 170.544 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -104.09 -16.34 15.3 Favored 'General case' 0 CA--C 1.518 -0.254 0 CA-C-N 118.719 1.259 . . . . 2.4500000000000002 113.128 -176.132 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 41.6 p -64.43 -161.17 0.01 OUTLIER 'General case' 0 CA--C 1.539 0.535 0 N-CA-C 108.972 -0.751 . . . . 0.89000000000000001 108.972 169.925 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 39.6 m-80 -51.47 145.53 8.57 Favored 'General case' 0 CA--C 1.53 0.21 0 O-C-N 120.369 -1.457 . . . . 1.95 111.011 -176.867 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 47.4 tt0 -60.21 -19.37 53.98 Favored 'General case' 0 CA--C 1.541 0.623 0 C-N-CA 124.223 1.009 . . . . 2.9500000000000002 111.938 -177.703 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 64' ' ' ALA . . . . . 0.506 ' HB1' ' CE1' ' A' ' 20' ' ' HIS . . . -61.24 -47.92 83.84 Favored 'General case' 0 N--CA 1.453 -0.315 0 C-N-CA 125.973 1.709 . . . . 0.46999999999999997 112.022 168.688 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 5.2 mt-10 -70.39 -42.23 71.99 Favored 'General case' 0 CA--C 1.51 -0.587 0 O-C-N 121.548 -0.72 . . . . 1.7 111.036 177.935 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 63.6 t80 -45.89 -53.26 10.12 Favored 'General case' 0 N--CA 1.45 -0.45 0 C-N-CA 123.397 0.679 . . . . 0.35999999999999999 110.896 172.385 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 82.0 t80 -64.35 -41.14 96.9 Favored 'General case' 0 CA--C 1.534 0.332 0 O-C-N 122.131 -0.356 . . . . 0.96999999999999997 111.62 176.523 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -61.38 -50.56 72.4 Favored 'General case' 0 CA--C 1.537 0.462 0 O-C-N 121.022 -1.049 . . . . 0.26000000000000001 111.262 -174.935 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 5.4 mm-40 -53.69 -43.71 69.17 Favored 'General case' 0 CA--C 1.521 -0.157 0 C-N-CA 124.653 1.181 . . . . 4.1699999999999999 110.466 168.524 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -55.87 -39.93 72.22 Favored 'General case' 0 N--CA 1.453 -0.3 0 CA-C-N 118.487 0.585 . . . . 0.53000000000000003 110.214 179.437 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 2.7 t80 -65.04 -51.59 60.64 Favored 'General case' 0 CA--C 1.53 0.2 0 CA-C-N 119.239 0.927 . . . . 2.2799999999999998 110.921 175.247 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 12.5 ttt180 -43.72 -56.87 3.52 Favored 'General case' 0 N--CA 1.469 0.499 0 C-N-CA 123.849 0.86 . . . . 2.4900000000000002 110.558 177.134 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 73' ' ' LEU . . . . . 0.461 HD12 HG23 ' A' ' 85' ' ' VAL . 0.2 OUTLIER -59.67 -52.91 63.5 Favored 'General case' 0 N--CA 1.452 -0.371 0 C-N-CA 125.664 1.585 . . . . 1.1599999999999999 109.819 179.679 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 0.6 OUTLIER -58.26 -37.57 75.22 Favored 'General case' 0 CA--C 1.531 0.22 0 CA-C-N 118.94 0.791 . . . . 2.6699999999999999 111.899 -171.667 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 75' ' ' HIS . . . . . 0.45 ' CE1' HD12 ' A' ' 15' ' ' ILE . 2.6 p80 -85.49 -14.9 44.59 Favored 'General case' 0 N--CA 1.461 0.091 0 CA-C-O 118.356 -0.83 . . . . 1.6000000000000001 111.735 -179.849 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 1.1 t -56.5 117.05 3.48 Favored 'General case' 0 N--CA 1.443 -0.809 0 N-CA-C 106.616 -1.624 . . . . 2.3399999999999999 106.616 -174.65 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -53.39 -32.83 51.31 Favored 'General case' 0 C--N 1.319 -0.757 0 CA-C-N 115.351 -0.84 . . . . 2.6600000000000001 110.997 -178.838 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 24.4 t0 -55.51 106.26 0.23 Allowed 'General case' 0 N--CA 1.447 -0.584 0 CA-C-O 122.73 1.252 . . . . 2.0299999999999998 110.247 165.312 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 32.7 m80 -63.12 -29.31 70.7 Favored 'General case' 0 N--CA 1.449 -0.514 0 CA-C-N 115.151 -0.931 . . . . 5.5 110.189 178.985 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -59.81 -56.69 18.66 Favored 'General case' 0 N--CA 1.448 -0.557 0 CA-C-N 119.093 0.86 . . . . 0.78000000000000003 109.714 177.323 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -43.47 -47.62 7.13 Favored 'General case' 0 C--O 1.232 0.15 0 C-N-CA 124.98 1.312 . . . . 2.7799999999999998 110.778 179.13 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 35.8 mtp180 -63.83 -54.14 39.64 Favored 'General case' 0 N--CA 1.451 -0.407 0 CA-C-N 114.857 -1.065 . . . . 2.2999999999999998 110.036 -177.721 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . 0.423 HD13 ' HA ' ' A' ' 83' ' ' LEU . 0.9 OUTLIER -63.35 -17.67 62.84 Favored 'General case' 0 N--CA 1.45 -0.46 0 CA-C-O 117.97 -1.014 . . . . 0.85999999999999999 112.603 176.439 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 2.0 mptm? -66.39 -46.64 75.93 Favored 'General case' 0 CA--C 1.516 -0.329 0 CA-C-N 121.29 1.859 . . . . 1.3300000000000001 107.731 169.066 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 85' ' ' VAL . . . . . 0.535 HG22 HD22 ' A' ' 55' ' ' LEU . 56.4 t -56.36 -50.93 69.62 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.657 0 CA-C-O 117.607 -1.187 . . . . 0.81000000000000005 109.822 174.7 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 1.9 mt-30 -59.12 -57.23 13.96 Favored 'General case' 0 N--CA 1.466 0.374 0 CA-C-N 121.475 1.943 . . . . 2.25 112.304 -178.684 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 11.4 tttm -57.25 -38.27 73.6 Favored 'General case' 0 C--N 1.329 -0.292 0 C-N-CA 123.41 0.684 . . . . 2.4700000000000002 111.602 -175.116 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 17.0 m-80 -84.51 -20.88 30.92 Favored 'General case' 0 C--O 1.222 -0.372 0 CA-C-O 118.476 -0.774 . . . . 1.98 110.705 179.387 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -144.68 81.48 10.93 Favored Pre-proline 0 C--O 1.237 0.403 0 C-N-CA 125.417 1.487 . . . . 0.54000000000000004 109.907 -174.152 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 84.5 Cg_endo -78.53 35.35 0.54 Allowed 'Trans proline' 0 CA--C 1.54 0.805 0 C-N-CA 123.509 2.806 . . . . 1.8200000000000001 112.476 -175.205 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 91' ' ' LYS . . . . . 0.46 ' HE2' ' HA ' ' A' ' 47' ' ' ILE . 14.4 ptmt -149.87 -52.41 0.15 Allowed 'General case' 0 N--CA 1.454 -0.232 0 C-N-CA 125.72 1.608 . . . . 2.79 109.628 -179.655 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 3.3 m -50.36 -47.21 56.17 Favored 'General case' 0 N--CA 1.462 0.149 0 O-C-N 121.419 -0.801 . . . . 0.51000000000000001 111.379 178.2 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 16.6 t80 -58.64 -49.28 78.12 Favored 'General case' 0 CA--C 1.508 -0.659 0 C-N-CA 120.277 -0.569 . . . . 1.9199999999999999 112.095 -177.901 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 39.8 tt0 -53.02 -36.57 60.66 Favored 'General case' 0 N--CA 1.446 -0.647 0 CA-C-N 115.115 -0.948 . . . . 1.46 109.507 -179.88 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -60.61 -59.87 4.7 Favored 'General case' 0 N--CA 1.45 -0.43 0 C-N-CA 123.296 0.639 . . . . 1.1599999999999999 109.424 -178.455 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 23.4 mm -47.98 -46.59 12.61 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.249 0 C-N-CA 124.01 0.924 . . . . 1.5 110.428 175.728 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 1.4 t30 -61.21 -35.29 76.81 Favored 'General case' 0 CA--C 1.53 0.186 0 C-N-CA 123.413 0.685 . . . . 1.6000000000000001 111.175 -176.969 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 35.7 t0 . . . . . 0 CA--C 1.52 -0.2 0 C-N-CA 124.152 0.981 . . . . 2.1400000000000001 108.855 174.919 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 25.5 t80 . . . . . 0 N--CA 1.454 -0.239 0 CA-C-O 121.143 0.497 . . . . 2.2999999999999998 111.487 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 15' ' ' ILE . . . . . 0.414 HD12 ' CE1' ' A' ' 75' ' ' HIS . 0.7 OUTLIER -66.02 -32.34 57.68 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.217 0 O-C-N 121.232 -0.918 . . . . 0.44 111.934 179.001 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 3.4 t60 -58.4 -52.28 66.29 Favored 'General case' 0 C--N 1.342 0.279 0 N-CA-C 106.993 -1.484 . . . . 0.48999999999999999 106.993 176.064 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 44.7 mt-10 -57.47 -41.49 80.74 Favored 'General case' 0 N--CA 1.454 -0.258 0 CA-C-O 118.69 -0.671 . . . . 2.0099999999999998 111.108 179.298 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -51.66 -47.29 63.84 Favored 'General case' 0 N--CA 1.464 0.269 0 CA-C-N 119.126 0.875 . . . . 3.04 111.72 175.396 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -48.0 -49.91 22.61 Favored Glycine 0 CA--C 1.528 0.895 0 N-CA-C 110.482 -1.047 . . . . 0.44 110.482 174.328 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 20' ' ' HIS . . . . . 0.567 ' CE1' ' HB1' ' A' ' 64' ' ' ALA . 1.7 t-160 -62.11 -40.64 96.59 Favored 'General case' 0 N--CA 1.451 -0.408 0 O-C-N 122.033 -0.687 . . . . 1.8999999999999999 111.817 178.701 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -60.5 -32.5 71.5 Favored 'General case' 0 N--CA 1.454 -0.244 0 O-C-N 121.002 -1.061 . . . . 0.59999999999999998 109.971 179.452 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 58.0 t -70.67 -34.43 56.84 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.222 0 O-C-N 121.293 -0.879 . . . . 0.81000000000000005 111.142 178.041 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 80.0 m-20 . . . . . 0 N--CA 1.468 0.441 0 CA-C-N 118.744 0.702 . . . . 2.4199999999999999 111.33 172.205 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 20.0 t70 . . . . . 0 N--CA 1.479 0.98 0 N-CA-C 112.517 0.562 . . . . 3.0299999999999998 112.517 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 10.5 mm -38.05 -65.66 0.07 OUTLIER 'Isoleucine or valine' 0 N--CA 1.449 -0.521 0 C-N-CA 129.84 3.256 . . . . 0.97999999999999998 109.912 173.453 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 24.2 t80 -64.74 -26.67 68.46 Favored 'General case' 0 N--CA 1.453 -0.3 0 O-C-N 120.98 -1.075 . . . . 0.46000000000000002 112.363 179.775 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . 0.568 ' HA ' ' HE2' ' A' ' 49' ' ' LYS . 10.2 mmpt? -69.4 -47.79 63.1 Favored 'General case' 0 N--CA 1.452 -0.362 0 O-C-N 120.092 -1.63 . . . . 1.04 111.07 -176.195 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -89.31 -63.36 1.3 Allowed 'General case' 0 C--N 1.33 -0.274 0 N-CA-C 108.077 -1.082 . . . . 3.3599999999999999 108.077 -177.721 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 7.8 mm-40 -67.16 -33.05 74.59 Favored 'General case' 0 CA--C 1.532 0.278 0 N-CA-C 109.193 -0.669 . . . . 2.2000000000000002 109.193 -169.221 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -68.13 39.97 0.26 Allowed Glycine 0 CA--C 1.531 1.036 0 C-N-CA 125.836 1.684 . . . . 0.32000000000000001 114.308 167.646 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 26.4 m -146.75 24.36 1.21 Allowed 'General case' 0 CA--C 1.533 0.29 0 O-C-N 120.771 -1.429 . . . . 2.1099999999999999 110.66 154.026 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -131.14 -36.67 1.3 Allowed 'General case' 0 C--N 1.341 0.218 0 N-CA-C 113.283 0.845 . . . . 2.77 113.283 -170.81 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . 0.561 HD22 HG22 ' A' ' 85' ' ' VAL . 32.7 mt -66.23 -35.47 80.52 Favored 'General case' 0 N--CA 1.465 0.281 0 CA-C-N 119.383 0.992 . . . . 0.55000000000000004 110.876 -176.873 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 1.3 t 177.98 172.87 0.62 Allowed 'General case' 0 CA--C 1.531 0.246 0 C-N-CA 125.403 1.481 . . . . 0.58999999999999997 107.837 -178.438 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 6.4 m -57.91 -34.98 70.41 Favored 'General case' 0 N--CA 1.452 -0.34 0 C-N-CA 123.364 0.666 . . . . 0.93999999999999995 110.544 166.851 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -65.89 -16.54 63.94 Favored 'General case' 0 CA--C 1.534 0.349 0 N-CA-C 112.253 0.464 . . . . 1.0 112.253 175.312 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -85.29 -11.48 75.44 Favored Glycine 0 N--CA 1.444 -0.776 0 N-CA-C 110.786 -0.926 . . . . 0.37 110.786 175.334 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 4.5 tmt_? -105.81 -19.88 13.62 Favored 'General case' 0 C--O 1.228 -0.062 0 CA-C-N 119.025 1.412 . . . . 3.3399999999999999 112.112 179.556 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 1.6 p -59.46 -164.12 0.01 OUTLIER 'General case' 0 CA--C 1.536 0.442 0 C-N-CA 124.998 1.319 . . . . 0.80000000000000004 110.723 170.88 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 50.9 t30 -54.46 149.58 10.2 Favored 'General case' 0 CA--C 1.529 0.172 0 O-C-N 120.635 -1.29 . . . . 2.1600000000000001 110.158 -176.429 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 14.8 tm-20 -56.85 -39.46 74.32 Favored 'General case' 0 C--O 1.222 -0.348 0 CA-C-O 120.995 0.426 . . . . 3.5699999999999998 110.24 -173.492 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 64' ' ' ALA . . . . . 0.567 ' HB1' ' CE1' ' A' ' 20' ' ' HIS . . . -56.83 -29.18 62.56 Favored 'General case' 0 C--N 1.328 -0.333 0 N-CA-C 113.421 0.897 . . . . 0.51000000000000001 113.421 178.857 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 6.2 mt-10 -76.95 -42.87 37.39 Favored 'General case' 0 N--CA 1.452 -0.365 0 O-C-N 121.085 -1.009 . . . . 2.1499999999999999 110.499 175.839 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 27.8 t80 -52.51 -49.63 64.4 Favored 'General case' 0 CA--C 1.532 0.261 0 C-N-CA 125.03 1.332 . . . . 0.28000000000000003 111.299 172.585 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 47.8 t80 -64.65 -47.01 80.06 Favored 'General case' 0 CA--C 1.534 0.361 0 O-C-N 120.898 -1.126 . . . . 0.52000000000000002 110.239 177.031 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -57.68 -56.14 25.73 Favored 'General case' 0 CA--C 1.536 0.412 0 O-C-N 121.243 -0.911 . . . . 0.29999999999999999 111.927 -175.198 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -59.99 -34.0 72.74 Favored 'General case' 0 CA--C 1.53 0.208 0 C-N-CA 123.713 0.805 . . . . 3.7000000000000002 111.7 174.384 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -56.27 -46.19 79.81 Favored 'General case' 0 C--O 1.221 -0.443 0 CA-C-N 119.155 0.889 . . . . 0.44 109.856 172.211 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 2.2 t80 -55.73 -49.02 74.18 Favored 'General case' 0 N--CA 1.463 0.202 0 CA-C-N 119.355 0.979 . . . . 2.8500000000000001 111.371 179.539 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 32.6 ttt180 -47.93 -59.67 3.17 Favored 'General case' 0 N--CA 1.466 0.363 0 N-CA-C 109.419 -0.585 . . . . 2.23 109.419 174.04 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 73' ' ' LEU . . . . . 0.48 ' CB ' HG21 ' A' ' 85' ' ' VAL . 0.1 OUTLIER -63.1 -30.62 71.73 Favored 'General case' 0 C--N 1.33 -0.252 0 C-N-CA 124.594 1.158 . . . . 0.41999999999999998 111.579 -175.043 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -62.92 -41.42 99.46 Favored 'General case' 0 C--N 1.328 -0.366 0 C-N-CA 124.416 1.086 . . . . 3.02 110.14 -175.282 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 75' ' ' HIS . . . . . 0.414 ' CE1' HD12 ' A' ' 15' ' ' ILE . 7.9 p80 -95.81 -4.11 44.42 Favored 'General case' 0 N--CA 1.452 -0.342 0 CA-C-O 116.312 -1.804 . . . . 0.88 112.928 -179.19 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 3.2 m -37.73 125.74 1.15 Allowed 'General case' 0 CA--C 1.516 -0.336 0 CA-C-N 120.296 1.407 . . . . 1.02 111.645 -166.781 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -51.94 -40.57 61.02 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 113.418 -1.719 . . . . 1.04 109.38 178.987 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 78' ' ' ASP . . . . . 0.515 ' OD2' ' HB3' ' A' ' 80' ' ' ALA . 14.6 t0 -72.19 110.44 6.64 Favored 'General case' 0 N--CA 1.446 -0.651 0 C-N-CA 119.357 -0.937 . . . . 1.8200000000000001 109.448 163.793 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 1.8 p80 -47.44 -39.61 16.07 Favored 'General case' 0 N--CA 1.454 -0.246 0 CA-C-N 115.82 -0.627 . . . . 4.5899999999999999 112.091 170.869 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 80' ' ' ALA . . . . . 0.515 ' HB3' ' OD2' ' A' ' 78' ' ' ASP . . . -61.6 -48.3 81.56 Favored 'General case' 0 N--CA 1.452 -0.374 0 CA-C-N 118.127 0.422 . . . . 0.59999999999999998 110.036 -174.873 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 32.1 mt-10 -48.17 -39.39 20.67 Favored 'General case' 0 N--CA 1.452 -0.368 0 C-N-CA 124.22 1.008 . . . . 2.75 111.644 176.588 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 4.8 mtp180 -65.64 -47.26 76.19 Favored 'General case' 0 C--N 1.326 -0.415 0 C-N-CA 119.604 -0.838 . . . . 2.6699999999999999 108.878 179.545 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 1.5 mm? -61.79 -26.57 68.17 Favored 'General case' 0 N--CA 1.453 -0.285 0 CA-C-O 117.674 -1.155 . . . . 0.55000000000000004 112.321 174.779 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -62.77 -42.05 99.51 Favored 'General case' 0 C--O 1.224 -0.257 0 CA-C-N 121.231 1.832 . . . . 1.3700000000000001 108.329 172.773 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 85' ' ' VAL . . . . . 0.561 HG22 HD22 ' A' ' 55' ' ' LEU . 56.0 t -63.41 -61.79 1.5 Allowed 'Isoleucine or valine' 0 C--O 1.22 -0.48 0 CA-C-O 117.425 -1.274 . . . . 0.39000000000000001 111.148 173.273 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 3.9 mt-30 -49.33 -49.71 42.87 Favored 'General case' 0 N--CA 1.466 0.328 0 CA-C-N 121.024 1.738 . . . . 2.2400000000000002 111.103 -175.258 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 37.1 tttt -56.85 -53.27 59.79 Favored 'General case' 0 N--CA 1.447 -0.606 0 C-N-CA 123.764 0.826 . . . . 1.95 111.192 178.243 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 56.1 m-20 -88.43 9.75 22.46 Favored 'General case' 0 C--N 1.332 -0.166 0 C-N-CA 122.696 0.398 . . . . 1.3999999999999999 111.245 -172.986 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 89' ' ' ALA . . . . . 0.493 ' HB2' HD21 ' A' ' 55' ' ' LEU . . . -164.82 68.91 1.39 Allowed Pre-proline 0 N--CA 1.446 -0.642 0 C-N-CA 124.52 1.128 . . . . 0.5 109.013 -177.385 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 93.0 Cg_endo -80.86 57.51 6.57 Favored 'Trans proline' 0 CA--C 1.535 0.535 0 C-N-CA 124.737 3.625 . . . . 2.0899999999999999 111.939 -170.556 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 5.0 ptmt 174.72 -47.48 0.01 OUTLIER 'General case' 0 CA--C 1.533 0.315 0 C-N-CA 128.299 2.639 . . . . 2.3199999999999998 109.847 -170.268 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 13.8 m -55.56 -45.81 77.25 Favored 'General case' 0 N--CA 1.465 0.321 0 O-C-N 121.093 -1.004 . . . . 0.37 111.067 176.627 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 29.4 t80 -55.16 -47.24 75.41 Favored 'General case' 0 CA--C 1.513 -0.462 0 CA-C-O 121.584 0.707 . . . . 2.1000000000000001 110.595 176.684 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 4.3 mt-30 -57.49 -29.2 64.07 Favored 'General case' 0 N--CA 1.443 -0.783 0 CA-C-N 114.427 -1.26 . . . . 2.4199999999999999 111.443 178.787 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 8.3 t80 -62.91 -55.29 27.37 Favored 'General case' 0 CA--C 1.528 0.119 0 CA-C-N 118.939 0.791 . . . . 1.3100000000000001 110.093 -179.468 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 3.6 mp -61.2 -41.47 89.64 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.186 0 N-CA-C 108.34 -0.985 . . . . 0.87 108.34 177.121 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 7.0 t30 -58.93 -37.78 77.48 Favored 'General case' 0 CA--C 1.532 0.255 0 N-CA-C 111.884 0.327 . . . . 2.0800000000000001 111.884 -178.125 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--N 1.333 -0.143 0 C-N-CA 125.729 1.611 . . . . 2.73 109.04 175.045 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 8.5 t80 . . . . . 0 N--CA 1.452 -0.345 0 CA-C-O 120.756 0.312 . . . . 2.5699999999999998 111.122 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 15' ' ' ILE . . . . . 0.467 HD12 ' CE1' ' A' ' 75' ' ' HIS . 0.5 OUTLIER -67.47 -33.69 63.92 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.314 0 O-C-N 121.538 -0.726 . . . . 0.48999999999999999 112.205 -179.597 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 8.2 t60 -62.21 -55.89 24.06 Favored 'General case' 0 CA--C 1.53 0.183 0 N-CA-C 107.351 -1.351 . . . . 0.55000000000000004 107.351 179.558 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 41.6 mt-10 -55.03 -39.33 69.03 Favored 'General case' 0 N--CA 1.449 -0.493 0 C-N-CA 126.051 1.74 . . . . 2.3199999999999998 110.823 178.222 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 36.4 t80 -56.69 -52.41 65.03 Favored 'General case' 0 C--N 1.333 -0.144 0 CA-C-N 119.222 0.919 . . . . 2.8900000000000001 109.813 175.828 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -48.15 -45.61 27.17 Favored Glycine 0 CA--C 1.526 0.756 0 N-CA-C 111.498 -0.641 . . . . 0.56999999999999995 111.498 172.375 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 20' ' ' HIS . . . . . 0.597 ' CE1' ' HB1' ' A' ' 64' ' ' ALA . 3.0 t60 -61.67 -49.96 74.42 Favored 'General case' 0 N--CA 1.448 -0.56 0 O-C-N 121.631 -0.923 . . . . 1.9099999999999999 111.456 -179.68 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -59.83 -31.7 69.97 Favored 'General case' 0 N--CA 1.449 -0.479 0 C-N-CA 123.825 0.85 . . . . 0.58999999999999997 109.643 -176.592 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 93.3 t -62.88 -51.9 66.19 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.24 0 C-N-CA 120.309 -0.556 . . . . 0.72999999999999998 109.844 177.409 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--N 1.328 -0.332 0 CA-C-N 116.361 -0.381 . . . . 3.1499999999999999 111.376 179.072 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 6.8 m-20 . . . . . 0 N--CA 1.464 0.267 0 N-CA-C 108.374 -0.973 . . . . 3.25 108.374 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 11.9 mm -48.18 -52.97 6.64 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.243 0 C-N-CA 125.298 1.439 . . . . 0.45000000000000001 109.292 -177.743 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 33.1 t80 -64.42 -33.98 77.14 Favored 'General case' 0 N--CA 1.449 -0.487 0 N-CA-C 112.821 0.674 . . . . 0.45000000000000001 112.821 179.407 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . 0.554 ' HA ' ' HE2' ' A' ' 49' ' ' LYS . 9.4 mmpt? -67.85 -46.28 72.19 Favored 'General case' 0 C--N 1.331 -0.228 0 O-C-N 119.938 -1.726 . . . . 1.29 110.669 -177.994 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 11.8 mm-40 -82.27 -65.97 0.95 Allowed 'General case' 0 N--CA 1.452 -0.359 0 N-CA-C 108.429 -0.952 . . . . 3.9300000000000002 108.429 -175.887 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 3.7 mm-40 -68.44 -35.37 77.51 Favored 'General case' 0 N--CA 1.451 -0.405 0 C-N-CA 123.935 0.894 . . . . 2.9500000000000002 109.432 -169.567 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -67.29 38.23 0.21 Allowed Glycine 0 CA--C 1.532 1.136 0 C-N-CA 126.286 1.898 . . . . 0.44 114.035 170.231 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 60.6 p -146.62 22.43 1.29 Allowed 'General case' 0 N--CA 1.449 -0.503 0 O-C-N 120.342 -1.681 . . . . 2.1699999999999999 112.07 159.747 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -127.29 -46.17 1.5 Allowed 'General case' 0 CA--C 1.518 -0.267 0 CA-C-O 118.936 -0.554 . . . . 2.8900000000000001 111.62 -176.558 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 29.2 mt -57.13 -35.97 70.11 Favored 'General case' 0 N--CA 1.467 0.395 0 CA-C-N 118.802 0.728 . . . . 0.45000000000000001 110.896 -169.187 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER 179.53 175.72 0.7 Allowed 'General case' 0 C--O 1.233 0.221 0 C-N-CA 125.508 1.523 . . . . 0.51000000000000001 107.203 175.233 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 7.9 m -55.86 -32.66 63.84 Favored 'General case' 0 N--CA 1.452 -0.326 0 O-C-N 121.597 -0.689 . . . . 0.93000000000000005 110.582 165.15 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -63.28 -26.77 68.93 Favored 'General case' 0 C--N 1.342 0.271 0 CA-C-O 121.142 0.496 . . . . 1.22 111.828 175.304 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -75.32 -8.83 84.09 Favored Glycine 0 N--CA 1.442 -0.958 0 CA-C-O 118.24 -1.311 . . . . 0.51000000000000001 111.465 176.704 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 10.9 ttt-85 -113.06 -17.21 12.48 Favored 'General case' 0 CA--C 1.522 -0.097 0 CA-C-N 119.564 1.682 . . . . 2.7000000000000002 112.579 -177.493 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -61.27 -168.14 0.01 OUTLIER 'General case' 0 CA--C 1.534 0.358 0 C-N-CA 123.537 0.735 . . . . 1.1200000000000001 110.115 163.503 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -47.51 148.78 1.3 Allowed 'General case' 0 N--CA 1.464 0.244 0 O-C-N 121.561 -0.712 . . . . 2.0499999999999998 111.665 -174.311 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 5.0 mt-10 -55.56 -30.26 60.46 Favored 'General case' 0 CA--C 1.534 0.361 0 CA-C-O 121.285 0.564 . . . . 4.6799999999999997 110.759 -179.862 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 64' ' ' ALA . . . . . 0.597 ' HB1' ' CE1' ' A' ' 20' ' ' HIS . . . -66.18 -35.08 79.53 Favored 'General case' 0 N--CA 1.453 -0.281 0 C-N-CA 124.044 0.938 . . . . 0.63 113.056 176.484 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 6.4 mt-10 -76.27 -41.37 49.14 Favored 'General case' 0 CA--C 1.516 -0.331 0 O-C-N 121.48 -0.763 . . . . 1.8899999999999999 110.626 176.943 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 50.4 t80 -50.41 -51.85 42.71 Favored 'General case' 0 N--CA 1.451 -0.395 0 C-N-CA 124.441 1.097 . . . . 0.5 110.68 170.024 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 58.0 t80 -65.79 -46.63 77.98 Favored 'General case' 0 CA--C 1.537 0.457 0 O-C-N 121.34 -0.85 . . . . 0.59999999999999998 110.824 -179.472 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -61.27 -48.97 78.96 Favored 'General case' 0 CA--C 1.535 0.392 0 O-C-N 121.195 -0.94 . . . . 0.34999999999999998 112.045 -175.345 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -61.96 -37.54 85.14 Favored 'General case' 0 N--CA 1.454 -0.245 0 O-C-N 121.346 -0.846 . . . . 3.5800000000000001 110.58 173.487 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -55.26 -42.79 73.97 Favored 'General case' 0 C--O 1.22 -0.472 0 CA-C-N 119.009 0.822 . . . . 0.40000000000000002 109.979 175.329 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -55.8 -51.11 68.57 Favored 'General case' 0 N--CA 1.466 0.339 0 CA-C-N 119.263 0.938 . . . . 3.5600000000000001 112.147 172.464 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 23.3 ttt180 -50.88 -57.14 9.23 Favored 'General case' 0 CA--C 1.535 0.374 0 N-CA-C 109.409 -0.589 . . . . 2.2599999999999998 109.409 179.007 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 73' ' ' LEU . . . . . 0.462 ' HB3' HG21 ' A' ' 85' ' ' VAL . 0.1 OUTLIER -66.37 -28.42 68.64 Favored 'General case' 0 C--N 1.326 -0.423 0 C-N-CA 125.128 1.371 . . . . 0.46000000000000002 111.686 -177.197 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 2.1 ttp -64.66 -36.45 84.32 Favored 'General case' 0 N--CA 1.452 -0.372 0 O-C-N 121.98 -0.45 . . . . 2.98 109.971 -178.832 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 75' ' ' HIS . . . . . 0.467 ' CE1' HD12 ' A' ' 15' ' ' ILE . 26.2 p80 -88.04 -39.85 14.31 Favored 'General case' 0 N--CA 1.452 -0.369 0 CA-C-O 115.827 -2.035 . . . . 1.1299999999999999 110.591 -178.977 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 21.9 m -5.51 113.37 0.01 OUTLIER 'General case' 0 C--N 1.346 0.443 0 C-N-CA 128.254 2.621 . . . . 1.03 114.361 -171.403 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 3.0 p -47.07 -44.61 21.09 Favored 'General case' 0 N--CA 1.451 -0.401 0 C-N-CA 124.975 1.31 . . . . 1.1599999999999999 110.27 179.692 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 9.9 t0 -65.86 106.58 1.58 Allowed 'General case' 0 N--CA 1.449 -0.482 0 CA-C-O 121.827 0.822 . . . . 1.9099999999999999 109.141 166.105 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 54.8 m170 -57.11 -33.04 66.93 Favored 'General case' 0 N--CA 1.454 -0.27 0 CA-C-O 118.974 -0.536 . . . . 5.3099999999999996 111.04 177.667 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -59.65 -46.74 88.1 Favored 'General case' 0 N--CA 1.45 -0.451 0 CA-C-N 118.713 0.688 . . . . 0.78000000000000003 110.397 -179.743 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 5.7 mt-10 -48.71 -41.64 32.47 Favored 'General case' 0 C--O 1.232 0.148 0 C-N-CA 123.901 0.88 . . . . 2.6800000000000002 111.008 176.952 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -64.37 -47.52 78.97 Favored 'General case' 0 C--N 1.329 -0.31 0 N-CA-C 108.518 -0.919 . . . . 3.0600000000000001 108.518 179.123 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 1.3 mm? -64.99 -18.9 65.69 Favored 'General case' 0 N--CA 1.453 -0.285 0 CA-C-O 117.119 -1.419 . . . . 0.48999999999999999 113.087 175.573 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -63.69 -49.83 71.61 Favored 'General case' 0 CA--C 1.519 -0.24 0 CA-C-N 122.077 2.217 . . . . 1.6000000000000001 107.034 167.516 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 85' ' ' VAL . . . . . 0.462 HG21 ' HB3' ' A' ' 73' ' ' LEU . 58.9 t -55.07 -41.33 58.75 Favored 'Isoleucine or valine' 0 C--O 1.214 -0.776 0 CA-C-O 118.486 -0.768 . . . . 0.44 110.846 175.747 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 2.2 tm0? -77.94 -47.61 18.2 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 120.434 1.47 . . . . 3.04 111.844 -171.027 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 20.8 ttmt -54.58 -49.29 70.75 Favored 'General case' 0 C--O 1.226 -0.137 0 O-C-N 121.6 -0.688 . . . . 2.3100000000000001 109.905 175.721 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 17.2 m120 -72.73 -41.3 65.32 Favored 'General case' 0 C--O 1.225 -0.213 0 CA-C-O 119.703 -0.189 . . . . 2.25 111.159 -177.728 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -129.56 75.62 79.64 Favored Pre-proline 0 C--O 1.238 0.478 0 C-N-CA 125.832 1.653 . . . . 0.35999999999999999 110.236 -173.509 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 27.2 Cg_endo -59.58 -33.28 96.92 Favored 'Trans proline' 0 N--CA 1.446 -1.284 0 C-N-CA 121.341 1.361 . . . . 2.02 110.288 -177.244 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 9.1 tttp -80.44 -51.6 8.63 Favored 'General case' 0 N--CA 1.45 -0.47 0 C-N-CA 125.177 1.391 . . . . 5.1500000000000004 111.13 -173.524 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 5.7 m -54.19 -42.77 70.09 Favored 'General case' 0 N--CA 1.469 0.523 0 CA-C-N 119.378 0.99 . . . . 0.51000000000000001 110.801 -179.53 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 21.0 t80 -57.52 -47.14 82.78 Favored 'General case' 0 CA--C 1.509 -0.626 0 CA-C-O 121.19 0.519 . . . . 2.1600000000000001 111.644 179.32 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 21.0 tt0 -56.03 -36.18 67.71 Favored 'General case' 0 N--CA 1.443 -0.798 0 CA-C-N 115.02 -0.991 . . . . 1.75 109.929 178.993 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 9.1 t80 -66.45 -53.59 33.74 Favored 'General case' 0 N--CA 1.455 -0.187 0 C-N-CA 124.158 0.983 . . . . 1.01 110.275 -176.175 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 44.3 mm -59.4 -42.19 86.79 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.209 0 O-C-N 121.828 -0.545 . . . . 1.46 109.78 179.083 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 9.2 m-20 -58.36 -36.19 73.09 Favored 'General case' 0 CA--C 1.528 0.127 0 O-C-N 122.128 -0.357 . . . . 2.3500000000000001 111.306 177.96 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 1.6 t0 . . . . . 0 CA--C 1.53 0.188 0 CA-C-O 121.963 0.887 . . . . 2.0099999999999998 109.327 177.466 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 N--CA 1.458 -0.071 0 CA-C-O 121.666 0.746 . . . . 3.0699999999999998 110.884 . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 15' ' ' ILE . . . . . 0.424 HD12 ' CE1' ' A' ' 75' ' ' HIS . 0.4 OUTLIER -67.09 -33.46 63.35 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.434 0 O-C-N 121.99 -0.443 . . . . 0.51000000000000001 111.314 -176.733 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 3.7 t-160 -62.63 -52.95 61.35 Favored 'General case' 0 N--CA 1.45 -0.472 0 N-CA-C 107.584 -1.265 . . . . 0.95999999999999996 107.584 -178.765 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 20.2 mt-10 -60.51 -34.51 74.19 Favored 'General case' 0 N--CA 1.45 -0.456 0 C-N-CA 124.244 1.018 . . . . 2.8300000000000001 110.566 179.132 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -52.3 -54.03 36.61 Favored 'General case' 0 CA--C 1.517 -0.29 0 CA-C-N 119.288 0.949 . . . . 2.4100000000000001 110.512 171.429 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -47.63 -50.29 19.63 Favored Glycine 0 C--N 1.336 0.535 0 N-CA-C 110.277 -1.129 . . . . 0.72999999999999998 110.277 172.459 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 20' ' ' HIS . . . . . 0.544 ' CE1' ' HB1' ' A' ' 64' ' ' ALA . 1.8 t-160 -62.26 -35.96 80.57 Favored 'General case' 0 N--CA 1.452 -0.341 0 O-C-N 121.918 -0.754 . . . . 2.02 112.676 -177.555 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -65.68 -32.2 73.64 Favored 'General case' 0 N--CA 1.45 -0.475 0 CA-C-N 119.068 0.849 . . . . 1.3400000000000001 109.194 178.291 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 17.6 t -66.08 -38.64 82.46 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.239 0 C-N-CA 118.14 -1.424 . . . . 1.49 111.417 173.975 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 11.7 t70 . . . . . 0 N--CA 1.464 0.267 0 CA-C-O 121.863 0.84 . . . . 2.54 110.647 173.689 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 5.0 t70 . . . . . 0 N--CA 1.464 0.271 0 CA-C-O 122.327 1.061 . . . . 2.3100000000000001 111.445 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 6.1 mm -58.6 -54.42 33.57 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.402 0 CA-C-N 115.046 -0.979 . . . . 0.93000000000000005 108.547 179.14 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 28.8 t80 -60.9 -28.95 69.28 Favored 'General case' 0 C--O 1.226 -0.182 0 C-N-CA 124.967 1.307 . . . . 0.51000000000000001 111.86 176.758 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . 0.421 ' CA ' ' HE2' ' A' ' 49' ' ' LYS . 0.1 OUTLIER -66.48 -46.86 74.88 Favored 'General case' 0 N--CA 1.453 -0.324 0 O-C-N 120.854 -1.154 . . . . 1.1599999999999999 110.191 -172.643 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 6.4 tp10 -84.0 -57.72 3.08 Favored 'General case' 0 N--CA 1.451 -0.412 0 CA-C-O 121.903 0.859 . . . . 2.3100000000000001 108.984 -179.712 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 20.6 mm-40 -82.62 -20.83 35.62 Favored 'General case' 0 C--O 1.234 0.279 0 O-C-N 121.631 -0.668 . . . . 2.6499999999999999 111.385 -165.132 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -73.13 41.97 0.93 Allowed Glycine 0 CA--C 1.529 0.953 0 C-N-CA 124.729 1.157 . . . . 0.41999999999999998 113.365 172.116 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 27.9 m -152.69 33.93 0.49 Allowed 'General case' 0 N--CA 1.453 -0.318 0 C-N-CA 126.57 1.948 . . . . 1.8300000000000001 107.789 160.508 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 9.7 t-20 -144.73 -38.72 0.27 Allowed 'General case' 0 C--N 1.341 0.213 0 N-CA-C 113.242 0.83 . . . . 2.3599999999999999 113.242 -161.928 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 16.2 mt -72.01 -38.59 69.58 Favored 'General case' 0 C--N 1.33 -0.257 0 O-C-N 122.236 -0.29 . . . . 0.68000000000000005 110.947 179.167 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 4.4 t 171.03 172.72 0.07 Allowed 'General case' 0 N--CA 1.467 0.377 0 C-N-CA 125.579 1.551 . . . . 0.91000000000000003 108.709 -171.412 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 7.6 m -61.56 -36.49 80.78 Favored 'General case' 0 N--CA 1.455 -0.224 0 C-N-CA 124.228 1.011 . . . . 1.3400000000000001 111.037 172.587 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -65.86 -17.8 64.9 Favored 'General case' 0 CA--C 1.535 0.377 0 CA-C-N 118.107 0.412 . . . . 1.1299999999999999 111.456 173.818 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -78.8 -12.81 83.79 Favored Glycine 0 N--CA 1.443 -0.85 0 CA-C-O 118.938 -0.923 . . . . 0.44 111.31 174.512 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 4.2 tmt_? -110.08 -15.6 13.99 Favored 'General case' 0 CA--C 1.523 -0.092 0 CA-C-N 119.149 1.475 . . . . 2.6600000000000001 112.661 -176.946 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 1.3 p -61.8 -168.38 0.01 OUTLIER 'General case' 0 CA--C 1.537 0.447 0 C-N-CA 123.397 0.679 . . . . 1.1100000000000001 109.798 162.332 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 9.7 m-20 -48.17 145.75 3.03 Favored 'General case' 0 N--CA 1.463 0.222 0 O-C-N 121.359 -0.838 . . . . 2.1899999999999999 110.882 -177.95 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -50.51 -31.99 16.99 Favored 'General case' 0 CA--C 1.534 0.349 0 C-N-CA 123.99 0.916 . . . . 5.5599999999999996 111.884 175.177 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 64' ' ' ALA . . . . . 0.544 ' HB1' ' CE1' ' A' ' 20' ' ' HIS . . . -61.11 -42.06 97.83 Favored 'General case' 0 N--CA 1.451 -0.418 0 C-N-CA 124.263 1.025 . . . . 0.52000000000000002 110.438 178.311 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 7.9 mt-10 -69.82 -45.26 68.24 Favored 'General case' 0 N--CA 1.448 -0.528 0 CA-C-O 117.921 -1.038 . . . . 1.8899999999999999 110.477 177.073 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 35.7 t80 -51.45 -45.01 62.53 Favored 'General case' 0 CA--C 1.533 0.315 0 C-N-CA 126.041 1.737 . . . . 0.35999999999999999 112.005 175.303 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 90.4 t80 -69.23 -45.81 68.87 Favored 'General case' 0 C--N 1.328 -0.349 0 O-C-N 120.859 -1.151 . . . . 0.46000000000000002 109.847 178.267 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -65.02 -39.4 93.36 Favored 'General case' 0 CA--C 1.542 0.65 0 O-C-N 121.495 -0.753 . . . . 0.35999999999999999 112.058 -174.806 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -72.15 -33.78 68.01 Favored 'General case' 0 C--N 1.333 -0.135 0 O-C-N 121.092 -1.005 . . . . 3.7999999999999998 110.266 175.233 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -54.01 -42.42 69.06 Favored 'General case' 0 C--O 1.223 -0.313 0 CA-C-N 119.114 0.87 . . . . 0.38 110.419 171.706 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 47.4 t80 -56.65 -49.94 73.55 Favored 'General case' 0 N--CA 1.466 0.357 0 CA-C-N 119.954 1.252 . . . . 4.1500000000000004 111.315 171.667 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -49.45 -58.77 4.55 Favored 'General case' 0 C--N 1.34 0.157 0 CA-C-N 118.649 0.659 . . . . 3.73 109.791 -179.98 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 73' ' ' LEU . . . . . 0.574 ' CB ' HG21 ' A' ' 85' ' ' VAL . 0.1 OUTLIER -63.78 -27.89 69.5 Favored 'General case' 0 N--CA 1.45 -0.454 0 C-N-CA 124.888 1.275 . . . . 0.54000000000000004 110.997 -175.429 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 1.5 tmt? -68.64 -36.03 78.06 Favored 'General case' 0 N--CA 1.448 -0.558 0 C-N-CA 122.695 0.398 . . . . 2.6200000000000001 111.725 -178.988 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 75' ' ' HIS . . . . . 0.424 ' CE1' HD12 ' A' ' 15' ' ' ILE . 10.8 p80 -93.94 -10.6 33.23 Favored 'General case' 0 C--O 1.231 0.08 0 CA-C-O 117.384 -1.293 . . . . 1.2 113.169 -179.535 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 60.1 m -39.01 126.9 1.63 Allowed 'General case' 0 N--CA 1.449 -0.505 0 CA-C-O 123.028 1.394 . . . . 1.01 112.554 -169.488 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 4.1 p -53.53 -44.48 69.22 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 113.254 -1.793 . . . . 1.3300000000000001 108.588 176.404 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 12.3 t0 -65.8 107.23 1.74 Allowed 'General case' 0 N--CA 1.447 -0.612 0 N-CA-C 108.717 -0.846 . . . . 2.3700000000000001 108.717 167.151 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -55.9 -33.19 64.42 Favored 'General case' 0 N--CA 1.454 -0.267 0 CA-C-N 116.028 -0.533 . . . . 5.1900000000000004 110.626 176.304 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -61.06 -49.51 77.06 Favored 'General case' 0 N--CA 1.447 -0.615 0 CA-C-O 118.205 -0.902 . . . . 0.83999999999999997 110.323 -179.831 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 1.2 mt-10 -46.58 -42.56 16.2 Favored 'General case' 0 C--N 1.34 0.185 0 CA-C-N 119.263 0.938 . . . . 2.7400000000000002 110.061 179.371 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 2.2 mtp180 -64.87 -54.0 37.89 Favored 'General case' 0 CA--C 1.517 -0.314 0 CA-C-N 115.714 -0.675 . . . . 2.9900000000000002 109.556 -179.268 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 1.4 mm? -65.68 -17.33 64.52 Favored 'General case' 0 N--CA 1.452 -0.344 0 CA-C-O 117.774 -1.108 . . . . 0.5 112.774 179.89 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 2.5 mptm? -67.54 -48.12 67.9 Favored 'General case' 0 CA--C 1.517 -0.297 0 CA-C-N 121.175 1.807 . . . . 1.5600000000000001 107.407 168.49 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 85' ' ' VAL . . . . . 0.574 HG21 ' CB ' ' A' ' 73' ' ' LEU . 93.0 t -57.37 -45.62 85.38 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.692 0 C-N-CA 120.452 -0.499 . . . . 0.51000000000000001 110.689 175.942 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -71.18 -48.76 49.78 Favored 'General case' 0 N--CA 1.45 -0.447 0 CA-C-N 119.667 1.122 . . . . 1.77 110.857 -172.487 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 51.2 tttt -55.41 -51.81 65.63 Favored 'General case' 0 N--CA 1.451 -0.384 0 C-N-CA 124.34 1.056 . . . . 2.6000000000000001 110.506 177.92 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 12.2 m-20 -64.64 -40.42 95.42 Favored 'General case' 0 N--CA 1.454 -0.262 0 C-N-CA 123.174 0.59 . . . . 1.54 109.967 -179.813 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -137.83 74.21 45.23 Favored Pre-proline 0 C--O 1.238 0.498 0 C-N-CA 125.961 1.705 . . . . 0.46999999999999997 111.173 -165.136 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 40.5 Cg_endo -64.24 -16.79 56.95 Favored 'Trans proline' 0 N--CA 1.453 -0.908 0 C-N-CA 122.315 2.01 . . . . 1.98 111.934 -175.547 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 22.5 pttt -95.48 -40.28 9.55 Favored 'General case' 0 CA--C 1.531 0.231 0 C-N-CA 123.203 0.601 . . . . 3.4199999999999999 112.352 -179.125 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 3.3 m -62.46 -45.3 93.69 Favored 'General case' 0 CA--C 1.521 -0.135 0 O-C-N 120.739 -1.225 . . . . 0.35999999999999999 110.628 -179.522 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 10.3 t80 -61.22 -45.37 94.86 Favored 'General case' 0 CA--C 1.508 -0.659 0 C-N-CA 119.965 -0.694 . . . . 1.8500000000000001 110.946 -179.906 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 36.7 tt0 -53.88 -37.56 63.84 Favored 'General case' 0 N--CA 1.44 -0.938 0 CA-C-N 114.995 -1.002 . . . . 1.8899999999999999 110.097 177.212 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 4.9 t80 -60.69 -56.99 14.67 Favored 'General case' 0 N--CA 1.453 -0.276 0 N-CA-C 109.135 -0.691 . . . . 1.25 109.135 -177.74 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 33.9 mm -53.4 -44.07 53.88 Favored 'Isoleucine or valine' 0 C--O 1.227 -0.118 0 O-C-N 121.992 -0.443 . . . . 1.52 110.201 178.05 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 14.7 t30 -62.36 -30.81 71.45 Favored 'General case' 0 CA--C 1.531 0.225 0 C-N-CA 122.886 0.474 . . . . 1.48 111.999 -178.075 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 26.9 t70 . . . . . 0 C--O 1.231 0.095 0 C-N-CA 123.124 0.57 . . . . 2.6400000000000001 110.273 174.989 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 N--CA 1.454 -0.226 0 CA-C-O 122.038 0.923 . . . . 3.04 109.319 . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 15' ' ' ILE . . . . . 0.479 HG13 ' CG ' ' A' ' 72' ' ' ARG . 0.7 OUTLIER -64.56 -32.28 57.15 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.302 0 O-C-N 121.334 -0.854 . . . . 0.37 111.768 177.807 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 5.0 t60 -59.96 -47.68 84.82 Favored 'General case' 0 CA--C 1.532 0.268 0 N-CA-C 107.828 -1.175 . . . . 0.56999999999999995 107.828 176.353 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 20.3 mt-10 -60.8 -38.55 85.72 Favored 'General case' 0 N--CA 1.454 -0.248 0 C-N-CA 124.321 1.048 . . . . 2.5899999999999999 110.157 179.527 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 1.3 t80 -53.07 -45.99 68.36 Favored 'General case' 0 C--N 1.332 -0.169 0 C-N-CA 123.155 0.582 . . . . 2.2599999999999998 110.028 172.856 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -48.57 -50.3 25.16 Favored Glycine 0 CA--C 1.529 0.94 0 N-CA-C 111.473 -0.651 . . . . 0.5 111.473 171.923 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 40.6 m-70 -58.84 -50.49 73.78 Favored 'General case' 0 C--O 1.224 -0.247 0 O-C-N 121.148 -1.207 . . . . 3.23 112.205 176.931 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -59.78 -27.92 66.97 Favored 'General case' 0 N--CA 1.453 -0.286 0 CA-C-N 118.227 0.467 . . . . 0.73999999999999999 110.854 -176.938 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 53.9 t -69.11 -45.18 80.26 Favored 'Isoleucine or valine' 0 C--O 1.232 0.153 0 O-C-N 121.208 -0.933 . . . . 0.78000000000000003 109.935 174.042 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 1.9 t0 . . . . . 0 C--N 1.327 -0.38 0 C-N-CA 124.453 1.101 . . . . 1.8600000000000001 111.78 178.0 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 4.5 t0 . . . . . 0 N--CA 1.473 0.714 0 N-CA-C 109.048 -0.723 . . . . 2.7400000000000002 109.048 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 5.8 mm -53.75 -56.07 10.71 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.331 0 N-CA-C 108.108 -1.071 . . . . 0.48999999999999999 108.108 -174.801 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 48' ' ' PHE . . . . . 0.538 ' CD2' ' HG2' ' A' ' 63' ' ' GLU . 29.2 t80 -57.73 -34.36 69.42 Favored 'General case' 0 N--CA 1.452 -0.364 0 N-CA-C 113.068 0.766 . . . . 0.40999999999999998 113.068 174.21 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . 0.534 ' HA ' ' HE2' ' A' ' 49' ' ' LYS . 9.3 mmpt? -62.88 -48.33 79.46 Favored 'General case' 0 N--CA 1.454 -0.234 0 O-C-N 120.531 -1.355 . . . . 1.1699999999999999 111.575 -172.465 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -88.32 -62.95 1.37 Allowed 'General case' 0 C--N 1.329 -0.316 0 N-CA-C 107.226 -1.398 . . . . 4.04 107.226 -177.806 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 13.9 mm-40 -66.21 -34.56 78.3 Favored 'General case' 0 C--O 1.235 0.31 0 CA-C-O 121.369 0.604 . . . . 2.48 109.869 -167.954 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -69.37 34.47 0.33 Allowed Glycine 0 CA--C 1.531 1.071 0 C-N-CA 125.447 1.498 . . . . 0.48999999999999999 113.328 169.463 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 60.8 p -146.57 27.93 1.09 Allowed 'General case' 0 N--CA 1.451 -0.383 0 O-C-N 120.195 -1.768 . . . . 1.6399999999999999 110.585 157.152 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 52.5 t-20 -134.48 -47.06 0.75 Allowed 'General case' 0 N--CA 1.453 -0.284 0 CA-C-O 120.725 0.298 . . . . 1.6299999999999999 111.149 -165.83 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 14.5 mt -63.42 -35.06 79.18 Favored 'General case' 0 C--N 1.333 -0.142 0 O-C-N 121.865 -0.522 . . . . 0.46000000000000002 111.125 -176.666 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 1.5 t 175.19 167.88 0.31 Allowed 'General case' 0 CA--C 1.531 0.237 0 C-N-CA 125.488 1.515 . . . . 0.55000000000000004 108.148 -178.272 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 9.7 m -59.53 -33.63 71.63 Favored 'General case' 0 N--CA 1.453 -0.281 0 C-N-CA 123.44 0.696 . . . . 0.92000000000000004 110.827 168.835 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -66.83 -14.23 62.46 Favored 'General case' 0 CA--C 1.535 0.377 0 C-N-CA 122.775 0.43 . . . . 2.46 111.672 175.842 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -90.26 -11.59 62.63 Favored Glycine 0 N--CA 1.445 -0.733 0 C-N-CA 124.415 1.007 . . . . 0.60999999999999999 111.105 175.239 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -104.41 -13.93 15.91 Favored 'General case' 0 CA--C 1.521 -0.166 0 CA-C-N 118.711 1.255 . . . . 2.9500000000000002 112.314 179.177 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 1.3 p -59.83 -173.1 0.02 OUTLIER 'General case' 0 CA--C 1.541 0.607 0 C-N-CA 123.205 0.602 . . . . 1.1599999999999999 110.006 161.834 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 98.1 m-20 -49.59 153.05 1.24 Allowed 'General case' 0 N--CA 1.467 0.409 0 O-C-N 121.347 -0.846 . . . . 1.5800000000000001 111.793 -172.8 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . 0.538 ' HG2' ' CD2' ' A' ' 48' ' ' PHE . 42.0 mt-10 -54.32 -34.24 60.59 Favored 'General case' 0 CA--C 1.533 0.321 0 O-C-N 122.299 -0.251 . . . . 3.1299999999999999 111.34 -179.684 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -56.12 -39.36 72.11 Favored 'General case' 0 C--N 1.334 -0.078 0 O-C-N 121.552 -0.718 . . . . 0.62 112.558 176.058 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 1.8 mm-40 -80.19 -34.92 37.08 Favored 'General case' 0 CA--C 1.508 -0.65 0 CA-C-O 118.664 -0.684 . . . . 2.98 110.592 -178.203 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 62.7 t80 -55.15 -48.9 73.07 Favored 'General case' 0 N--CA 1.449 -0.51 0 C-N-CA 123.928 0.891 . . . . 0.51000000000000001 111.13 170.929 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 82.5 t80 -63.13 -44.7 94.84 Favored 'General case' 0 CA--C 1.535 0.371 0 O-C-N 121.028 -1.045 . . . . 0.68000000000000005 110.398 175.648 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -60.94 -52.53 64.65 Favored 'General case' 0 CA--C 1.539 0.543 0 O-C-N 121.077 -1.015 . . . . 0.37 112.58 -175.213 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 1.9 pp20? -63.41 -33.29 75.22 Favored 'General case' 0 C--N 1.331 -0.196 0 C-N-CA 124.426 1.09 . . . . 3.73 111.213 174.915 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -53.09 -58.74 5.99 Favored 'General case' 0 C--O 1.222 -0.37 0 CA-C-O 118.075 -0.964 . . . . 0.51000000000000001 108.741 170.331 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 44.5 t80 -48.5 -48.01 38.33 Favored 'General case' 0 N--CA 1.468 0.445 0 CA-C-N 119.654 1.115 . . . . 2.2999999999999998 112.01 179.454 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 72' ' ' ARG . . . . . 0.479 ' CG ' HG13 ' A' ' 15' ' ' ILE . 2.4 tmm_? -48.34 -51.46 26.11 Favored 'General case' 0 CA--C 1.539 0.522 0 C-N-CA 122.544 0.338 . . . . 3.2400000000000002 110.238 176.331 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 73' ' ' LEU . . . . . 0.642 HD12 HG23 ' A' ' 85' ' ' VAL . 0.1 OUTLIER -75.7 -27.35 58.2 Favored 'General case' 0 C--O 1.225 -0.186 0 C-N-CA 124.5 1.12 . . . . 0.48999999999999999 111.924 -176.711 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 34.0 mmt -58.52 -40.82 83.98 Favored 'General case' 0 CA--C 1.516 -0.349 0 CA-C-N 118.931 0.787 . . . . 5.7999999999999998 109.627 -179.941 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 22.9 p80 -90.2 -39.6 12.71 Favored 'General case' 0 N--CA 1.449 -0.483 0 CA-C-O 115.815 -2.04 . . . . 1.0700000000000001 110.758 -176.975 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 3.6 m -3.18 112.46 0.01 OUTLIER 'General case' 0 C--N 1.349 0.569 0 C-N-CA 128.156 2.582 . . . . 1.0 114.445 -172.636 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 2.6 p -46.64 -43.91 17.96 Favored 'General case' 0 N--CA 1.451 -0.396 0 C-N-CA 125.366 1.466 . . . . 0.93999999999999995 110.836 178.713 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 61.9 t0 -72.35 108.1 5.29 Favored 'General case' 0 N--CA 1.453 -0.313 0 C-N-CA 119.055 -1.058 . . . . 1.9099999999999999 108.629 167.708 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 92.8 m-70 -50.39 -34.08 22.99 Favored 'General case' 0 N--CA 1.453 -0.292 0 C-N-CA 123.478 0.711 . . . . 5.25 110.93 175.14 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -53.57 -48.94 68.71 Favored 'General case' 0 N--CA 1.45 -0.435 0 CA-C-O 119.205 -0.426 . . . . 0.64000000000000001 111.039 176.659 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -56.17 -38.52 71.03 Favored 'General case' 0 CA--C 1.52 -0.188 0 CA-C-N 118.363 0.529 . . . . 3.7400000000000002 110.641 -178.847 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -64.86 -50.32 67.08 Favored 'General case' 0 N--CA 1.452 -0.335 0 N-CA-C 109.068 -0.716 . . . . 3.1499999999999999 109.068 179.111 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 1.2 mm? -65.11 -21.75 66.85 Favored 'General case' 0 N--CA 1.451 -0.378 0 CA-C-O 118.166 -0.921 . . . . 0.42999999999999999 112.548 178.241 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 30.6 mttt -66.98 -46.62 74.05 Favored 'General case' 0 C--O 1.222 -0.387 0 N-CA-C 107.083 -1.451 . . . . 1.6899999999999999 107.083 171.889 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 85' ' ' VAL . . . . . 0.642 HG23 HD12 ' A' ' 73' ' ' LEU . 86.8 t -59.87 -43.32 91.76 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.688 0 C-N-CA 119.541 -0.864 . . . . 0.48999999999999999 112.183 173.965 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 86' ' ' GLN . . . . . 0.445 ' HG2' ' CG ' ' A' ' 93' ' ' PHE . 1.4 mm-40 -67.76 -53.13 29.75 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 120.554 1.525 . . . . 2.6200000000000001 110.735 -174.994 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 18.6 tttm -52.82 -50.47 63.62 Favored 'General case' 0 N--CA 1.453 -0.279 0 C-N-CA 125.148 1.379 . . . . 2.0699999999999998 110.431 177.606 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 5.8 m-20 -67.27 -36.03 80.74 Favored 'General case' 0 N--CA 1.452 -0.327 0 CA-C-O 118.894 -0.574 . . . . 1.1000000000000001 110.501 -179.034 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -141.06 80.8 16.65 Favored Pre-proline 0 C--O 1.238 0.491 0 C-N-CA 126.266 1.826 . . . . 0.34999999999999998 110.968 -168.686 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 92.6 Cg_endo -80.26 37.97 0.71 Allowed 'Trans proline' 0 CA--C 1.541 0.837 0 C-N-CA 123.525 2.817 . . . . 1.53 111.974 -176.498 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 2.0 ptmt -155.51 -47.88 0.08 Allowed 'General case' 0 CA--C 1.531 0.225 0 C-N-CA 125.431 1.492 . . . . 2.7599999999999998 110.079 -175.34 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 3.6 m -53.94 -45.21 71.19 Favored 'General case' 0 N--CA 1.463 0.187 0 O-C-N 121.041 -1.037 . . . . 0.39000000000000001 110.323 171.957 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 93' ' ' PHE . . . . . 0.445 ' CG ' ' HG2' ' A' ' 86' ' ' GLN . 7.8 t80 -56.82 -47.92 79.16 Favored 'General case' 0 CA--C 1.505 -0.755 0 C-N-CA 120.281 -0.568 . . . . 2.3300000000000001 111.396 178.582 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 56.3 tt0 -51.27 -35.67 38.47 Favored 'General case' 0 N--CA 1.447 -0.624 0 CA-C-N 115.533 -0.758 . . . . 2.2200000000000002 110.655 179.934 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 9.0 t80 -55.68 -59.6 4.63 Favored 'General case' 0 CA--C 1.532 0.252 0 CA-C-N 118.534 0.606 . . . . 1.6399999999999999 110.83 -176.907 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 3.8 mp -69.43 -32.86 54.77 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.202 0 O-C-N 121.624 -0.673 . . . . 1.22 109.297 -178.846 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 47.2 t30 -60.37 -31.78 70.66 Favored 'General case' 0 N--CA 1.453 -0.284 0 O-C-N 121.807 -0.558 . . . . 2.1499999999999999 110.606 -179.243 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 N--CA 1.456 -0.126 0 C-N-CA 124.688 1.195 . . . . 2.1800000000000002 108.67 171.15 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 28.2 t80 . . . . . 0 C--O 1.226 -0.172 0 N-CA-C 108.813 -0.81 . . . . 3.3599999999999999 108.813 . . . . . . . . . 0 0 . 1 . 021 nuclear nobuild core ' A' A ' 15' ' ' ILE . . . . . 0.411 HD12 ' CE1' ' A' ' 75' ' ' HIS . 0.5 OUTLIER -64.19 -32.51 57.72 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.229 0 CA-C-O 118.832 -0.604 . . . . 0.41999999999999998 112.456 178.705 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild core ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 1.6 t-160 -55.47 -57.91 9.95 Favored 'General case' 0 C--N 1.342 0.261 0 N-CA-C 106.78 -1.563 . . . . 0.46000000000000002 106.78 176.23 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 6.5 mt-10 -58.84 -36.35 74.41 Favored 'General case' 0 C--O 1.223 -0.307 0 C-N-CA 124.078 0.951 . . . . 3.0600000000000001 110.624 -178.619 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 1.8 t80 -56.81 -51.33 69.38 Favored 'General case' 0 CA--C 1.521 -0.158 0 C-N-CA 124.075 0.95 . . . . 1.98 110.386 176.907 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -51.79 -45.15 55.49 Favored Glycine 0 CA--C 1.526 0.746 0 N-CA-C 110.309 -1.116 . . . . 0.56000000000000005 110.309 175.681 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 20' ' ' HIS . . . . . 0.425 ' CE1' ' HB1' ' A' ' 64' ' ' ALA . 2.7 t60 -62.35 -42.91 99.78 Favored 'General case' 0 N--CA 1.451 -0.384 0 O-C-N 122.075 -0.662 . . . . 1.79 111.401 179.445 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -65.42 -30.0 70.75 Favored 'General case' 0 N--CA 1.452 -0.339 0 O-C-N 121.242 -0.911 . . . . 0.79000000000000004 110.02 179.175 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 71.2 t -71.92 -34.73 51.99 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.175 0 O-C-N 121.067 -1.021 . . . . 1.21 110.278 177.121 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 18.0 t70 . . . . . 0 C--O 1.233 0.203 0 CA-C-O 120.952 0.406 . . . . 1.8400000000000001 111.581 172.787 . . . . . . . . 0 0 . 1 . 021 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 26.6 p-10 . . . . . 0 CA--C 1.533 0.322 0 CA-C-O 120.699 0.285 . . . . 3.9399999999999999 110.584 . . . . . . . . . 0 0 . 1 . 021 nuclear nobuild core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 4.6 mm -55.7 -49.97 70.68 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.416 0 C-N-CA 127.316 2.246 . . . . 0.55000000000000004 107.504 176.138 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 26.5 t80 -60.58 -36.63 79.0 Favored 'General case' 0 N--CA 1.449 -0.498 0 C-N-CA 123.874 0.87 . . . . 0.54000000000000004 112.866 174.155 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . 0.526 ' HA ' ' HE2' ' A' ' 49' ' ' LYS . 10.2 mmpt? -62.61 -46.8 86.62 Favored 'General case' 0 CA--C 1.519 -0.248 0 C-N-CA 118.576 -1.25 . . . . 1.03 110.542 -173.41 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 4.6 tp10 -85.05 -64.76 1.1 Allowed 'General case' 0 N--CA 1.449 -0.479 0 CA-C-O 121.916 0.865 . . . . 2.1800000000000002 108.669 -177.825 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 14.2 mm-40 -72.52 -29.58 63.72 Favored 'General case' 0 CA--C 1.533 0.324 0 O-C-N 121.609 -0.682 . . . . 2.54 110.331 -167.835 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -70.57 37.8 0.47 Allowed Glycine 0 CA--C 1.528 0.902 0 C-N-CA 125.844 1.688 . . . . 0.37 113.869 169.487 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 63.8 p -142.41 23.89 1.96 Allowed 'General case' 0 N--CA 1.447 -0.624 0 O-C-N 121.085 -1.244 . . . . 1.8500000000000001 110.152 157.497 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -134.26 -39.45 0.83 Allowed 'General case' 0 C--N 1.341 0.209 0 N-CA-C 112.842 0.682 . . . . 1.76 112.842 -164.541 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . 0.514 HD22 HG22 ' A' ' 85' ' ' VAL . 25.7 mt -65.91 -36.6 83.83 Favored 'General case' 0 N--CA 1.463 0.175 0 C-N-CA 120.118 -0.633 . . . . 0.41999999999999998 110.495 -177.988 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER 178.23 169.65 0.77 Allowed 'General case' 0 CA--C 1.533 0.32 0 C-N-CA 125.622 1.569 . . . . 0.48999999999999999 107.908 -178.762 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 16.4 m -59.19 -37.88 78.5 Favored 'General case' 0 CA--C 1.529 0.15 0 C-N-CA 124.026 0.93 . . . . 0.91000000000000003 110.994 171.628 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -60.13 -32.92 71.46 Favored 'General case' 0 C--O 1.223 -0.34 0 C-N-CA 123.784 0.834 . . . . 1.54 109.175 172.53 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -64.06 -6.16 18.05 Favored Glycine 0 CA--C 1.524 0.594 0 O-C-N 121.196 -0.94 . . . . 0.39000000000000001 112.442 176.46 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -121.57 0.88 10.0 Favored 'General case' 0 N--CA 1.454 -0.27 0 CA-C-N 119.01 1.405 . . . . 4.3600000000000003 112.491 -177.49 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 58.9 p -73.92 -127.58 0.01 OUTLIER 'General case' 0 CA--C 1.534 0.359 0 N-CA-C 108.881 -0.785 . . . . 0.93000000000000005 108.881 174.834 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 1.7 m120 -74.63 150.91 39.43 Favored 'General case' 0 CA--C 1.531 0.23 0 O-C-N 120.072 -1.642 . . . . 1.6799999999999999 108.822 176.484 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 31.0 tt0 -62.41 -24.23 67.28 Favored 'General case' 0 CA--C 1.539 0.523 0 O-C-N 121.596 -0.69 . . . . 3.3399999999999999 111.191 179.615 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 64' ' ' ALA . . . . . 0.425 ' HB1' ' CE1' ' A' ' 20' ' ' HIS . . . -67.33 -33.89 76.19 Favored 'General case' 0 N--CA 1.454 -0.241 0 C-N-CA 124.15 0.98 . . . . 0.77000000000000002 112.132 173.364 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 3.3 mt-10 -75.97 -49.61 17.22 Favored 'General case' 0 C--O 1.219 -0.525 0 N-CA-C 108.23 -1.026 . . . . 2.0699999999999998 108.23 177.778 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 59.8 t80 -40.06 -51.31 2.59 Favored 'General case' 0 CA--C 1.537 0.464 0 C-N-CA 123.885 0.874 . . . . 0.37 111.874 170.932 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 62.9 t80 -60.82 -43.89 97.61 Favored 'General case' 0 CA--C 1.539 0.54 0 O-C-N 121.705 -0.622 . . . . 0.46999999999999997 111.887 174.927 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -62.11 -52.07 65.34 Favored 'General case' 0 CA--C 1.535 0.368 0 C-N-CA 124.647 1.179 . . . . 0.33000000000000002 112.352 -177.951 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 4.5 mp0 -57.29 -43.69 83.38 Favored 'General case' 0 CA--C 1.515 -0.402 0 O-C-N 121.075 -1.015 . . . . 4.46 109.89 172.56 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -57.49 -34.57 69.19 Favored 'General case' 0 N--CA 1.451 -0.396 0 CA-C-N 118.286 0.494 . . . . 0.5 110.421 -179.544 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -60.51 -55.67 30.58 Favored 'General case' 0 CA--C 1.534 0.363 0 C-N-CA 124.057 0.943 . . . . 2.9900000000000002 111.385 169.917 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -48.92 -53.8 18.1 Favored 'General case' 0 CA--C 1.536 0.408 0 O-C-N 121.513 -0.742 . . . . 3.8900000000000001 110.407 178.61 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -68.69 -49.16 61.14 Favored 'General case' 0 N--CA 1.449 -0.521 0 C-N-CA 126.465 1.906 . . . . 0.52000000000000002 109.586 -171.509 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -63.16 -26.5 68.84 Favored 'General case' 0 CA--C 1.529 0.158 0 O-C-N 120.719 -1.238 . . . . 2.6699999999999999 111.895 -178.506 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 75' ' ' HIS . . . . . 0.411 ' CE1' HD12 ' A' ' 15' ' ' ILE . 0.3 OUTLIER -91.23 -13.97 31.8 Favored 'General case' 0 C--N 1.338 0.106 0 CA-C-O 117.627 -1.177 . . . . 1.01 111.736 175.974 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 73.5 p -46.61 123.72 5.27 Favored 'General case' 0 N--CA 1.447 -0.585 0 CA-C-O 122.819 1.295 . . . . 2.1699999999999999 108.611 -168.666 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -52.82 -39.75 62.7 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 113.604 -1.635 . . . . 1.3600000000000001 109.206 -179.254 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 78' ' ' ASP . . . . . 0.417 ' OD2' ' HB3' ' A' ' 80' ' ' ALA . 17.3 t0 -68.1 104.45 1.79 Allowed 'General case' 0 N--CA 1.444 -0.759 0 CA-C-O 122.411 1.1 . . . . 2.0299999999999998 110.466 167.816 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 9.0 p-80 -39.46 -40.9 0.9 Allowed 'General case' 0 N--CA 1.453 -0.299 0 CA-C-N 114.904 -1.044 . . . . 4.5199999999999996 113.362 168.609 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 80' ' ' ALA . . . . . 0.417 ' HB3' ' OD2' ' A' ' 78' ' ' ASP . . . -65.15 -48.23 74.26 Favored 'General case' 0 N--CA 1.45 -0.469 0 CA-C-N 119.159 0.891 . . . . 0.64000000000000001 110.273 -176.001 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 3.6 mt-10 -50.28 -38.14 39.65 Favored 'General case' 0 N--CA 1.454 -0.256 0 CA-C-N 118.884 0.766 . . . . 2.8799999999999999 110.949 175.631 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 2.6 mtp180 -63.97 -52.51 59.32 Favored 'General case' 0 CA--C 1.516 -0.33 0 C-N-CA 119.156 -1.018 . . . . 2.4399999999999999 109.733 177.8 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 1.3 mm? -60.19 -23.68 64.18 Favored 'General case' 0 N--CA 1.452 -0.356 0 CA-C-O 117.819 -1.086 . . . . 0.52000000000000002 112.267 178.778 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 2.7 mptm? -61.46 -43.9 98.05 Favored 'General case' 0 C--O 1.224 -0.283 0 CA-C-N 120.811 1.641 . . . . 1.3 108.791 172.061 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 85' ' ' VAL . . . . . 0.514 HG22 HD22 ' A' ' 55' ' ' LEU . 61.7 t -62.22 -61.83 1.44 Allowed 'Isoleucine or valine' 0 C--O 1.221 -0.431 0 CA-C-N 118.898 0.772 . . . . 0.55000000000000004 109.745 171.321 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -55.12 -30.55 59.98 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 119.046 0.839 . . . . 2.6699999999999999 113.073 -168.274 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 43.1 tttt -75.98 -60.17 2.44 Favored 'General case' 0 N--CA 1.451 -0.402 0 C-N-CA 125.526 1.531 . . . . 2.3199999999999998 109.932 173.117 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 10.0 m-20 -76.79 6.51 5.96 Favored 'General case' 0 CA--C 1.533 0.303 0 C-N-CA 123.776 0.83 . . . . 1.25 111.917 -172.798 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 89' ' ' ALA . . . . . 0.509 ' HB2' HD21 ' A' ' 55' ' ' LEU . . . -162.21 73.66 2.26 Favored Pre-proline 0 N--CA 1.445 -0.724 0 C-N-CA 125.657 1.583 . . . . 0.40999999999999998 108.625 -176.85 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 68.7 Cg_endo -81.82 49.85 3.3 Favored 'Trans proline' 0 CA--C 1.539 0.749 0 C-N-CA 124.041 3.161 . . . . 2.04 111.513 -172.726 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 1.2 ptmt -175.01 -49.99 0.01 OUTLIER 'General case' 0 C--O 1.225 -0.229 0 C-N-CA 126.972 2.109 . . . . 2.4199999999999999 109.407 -173.783 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 3.2 m -53.2 -41.97 65.83 Favored 'General case' 0 N--CA 1.462 0.163 0 O-C-N 121.293 -0.879 . . . . 0.40999999999999998 111.448 176.694 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 34.2 t80 -57.88 -52.46 65.4 Favored 'General case' 0 CA--C 1.503 -0.854 0 C-N-CA 120.127 -0.629 . . . . 2.3599999999999999 110.971 177.251 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 32.2 tt0 -53.22 -34.11 55.67 Favored 'General case' 0 N--CA 1.444 -0.764 0 CA-C-N 115.148 -0.933 . . . . 1.8899999999999999 110.043 178.152 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 6.0 t80 -61.7 -58.13 9.23 Favored 'General case' 0 N--CA 1.451 -0.408 0 C-N-CA 123.138 0.575 . . . . 1.05 110.393 -176.711 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 4.2 mp -63.21 -33.87 63.58 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.195 0 O-C-N 120.912 -1.117 . . . . 0.89000000000000001 109.695 176.912 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -60.89 -33.06 72.54 Favored 'General case' 0 CA--C 1.535 0.382 0 CA-C-N 118.814 0.734 . . . . 1.71 110.839 -178.592 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 28.0 t70 . . . . . 0 N--CA 1.464 0.257 0 C-N-CA 124.542 1.137 . . . . 2.98 110.009 172.794 . . . . . . . . 0 0 . 1 . 022 nuclear nobuild core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 1.1 t80 . . . . . 0 N--CA 1.455 -0.176 0 N-CA-C 109.139 -0.689 . . . . 2.6099999999999999 109.139 . . . . . . . . . 0 0 . 1 . 022 nuclear nobuild core ' A' A ' 15' ' ' ILE . . . . . 0.405 HD12 ' CE1' ' A' ' 75' ' ' HIS . 1.1 pt -62.11 -36.37 73.9 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.301 0 CA-C-O 119.12 -0.467 . . . . 0.40000000000000002 112.057 175.625 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 3.5 t60 -58.25 -54.52 46.05 Favored 'General case' 0 CA--C 1.534 0.363 0 N-CA-C 107.286 -1.376 . . . . 0.46000000000000002 107.286 176.99 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 5.6 mt-10 -50.14 -49.05 53.28 Favored 'General case' 0 C--O 1.224 -0.255 0 C-N-CA 124.755 1.222 . . . . 3.0299999999999998 109.38 176.673 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -53.72 -47.98 70.05 Favored 'General case' 0 CA--C 1.518 -0.265 0 C-N-CA 124.829 1.252 . . . . 2.29 110.933 -178.931 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -49.06 -49.65 29.48 Favored Glycine 0 CA--C 1.524 0.617 0 N-CA-C 110.393 -1.083 . . . . 0.42999999999999999 110.393 173.614 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 20' ' ' HIS . . . . . 0.576 ' CE1' ' HB1' ' A' ' 64' ' ' ALA . 2.1 t-160 -61.33 -43.25 99.19 Favored 'General case' 0 N--CA 1.452 -0.331 0 O-C-N 121.901 -0.764 . . . . 1.95 111.413 178.041 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -61.94 -29.6 70.34 Favored 'General case' 0 N--CA 1.45 -0.464 0 O-C-N 120.909 -1.12 . . . . 0.62 110.396 -179.474 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 90.2 t -68.01 -41.11 84.25 Favored 'Isoleucine or valine' 0 CA--C 1.52 -0.201 0 O-C-N 121.332 -0.855 . . . . 0.81000000000000005 110.07 174.594 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 17.0 t0 . . . . . 0 C--O 1.234 0.263 0 CA-C-O 121.779 0.8 . . . . 2.1000000000000001 111.087 173.9 . . . . . . . . 0 0 . 1 . 022 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 2.9 t70 . . . . . 0 C--O 1.225 -0.203 0 N-CA-C 109.319 -0.623 . . . . 2.3100000000000001 109.319 . . . . . . . . . 0 0 . 1 . 022 nuclear nobuild core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 7.9 mm -44.78 -57.19 0.75 Allowed 'Isoleucine or valine' 0 CA--C 1.539 0.53 0 C-N-CA 125.53 1.532 . . . . 0.67000000000000004 109.075 169.799 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 18.0 t80 -60.2 -32.44 71.1 Favored 'General case' 0 C--O 1.222 -0.36 0 O-C-N 120.219 -1.551 . . . . 0.44 112.778 176.253 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . 0.537 ' HA ' ' HE2' ' A' ' 49' ' ' LYS . 7.0 mmpt? -66.17 -48.57 70.29 Favored 'General case' 0 C--N 1.327 -0.401 0 O-C-N 119.964 -1.71 . . . . 1.0600000000000001 111.227 -177.259 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 6.2 tp10 -86.96 -62.96 1.39 Allowed 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 108.117 -1.068 . . . . 2.4100000000000001 108.117 -175.162 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 29.8 mp0 -68.45 -30.3 69.13 Favored 'General case' 0 C--O 1.235 0.338 0 O-C-N 121.701 -0.624 . . . . 2.3799999999999999 111.041 -173.361 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -70.37 44.67 0.59 Allowed Glycine 0 CA--C 1.529 0.948 0 C-N-CA 125.154 1.359 . . . . 0.40000000000000002 113.927 169.123 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 52.3 p -150.72 31.77 0.63 Allowed 'General case' 0 N--CA 1.448 -0.563 0 O-C-N 120.879 -1.365 . . . . 1.8600000000000001 109.942 159.962 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 3.4 t-20 -143.85 -44.28 0.27 Allowed 'General case' 0 N--CA 1.454 -0.269 0 N-CA-C 112.4 0.519 . . . . 1.6799999999999999 112.4 -166.151 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . 0.59 HD21 ' HB2' ' A' ' 89' ' ' ALA . 15.4 mt -59.96 -35.62 75.36 Favored 'General case' 0 N--CA 1.464 0.235 0 O-C-N 122.324 -0.235 . . . . 0.5 111.124 -176.714 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER 178.15 171.61 0.7 Allowed 'General case' 0 CA--C 1.532 0.257 0 C-N-CA 126.148 1.779 . . . . 0.53000000000000003 106.886 179.961 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 13.2 m -61.24 -35.15 76.47 Favored 'General case' 0 N--CA 1.455 -0.214 0 O-C-N 121.599 -0.688 . . . . 0.93999999999999995 110.442 168.391 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -69.3 -4.06 16.51 Favored 'General case' 0 CA--C 1.535 0.383 0 N-CA-C 112.315 0.487 . . . . 1.4099999999999999 112.315 173.182 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -93.73 -6.97 61.86 Favored Glycine 0 N--CA 1.446 -0.681 0 CA-C-O 118.771 -1.016 . . . . 0.41999999999999998 111.084 173.131 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 54.1 ttt180 -111.15 -17.52 13.2 Favored 'General case' 0 C--O 1.23 0.076 0 CA-C-N 119.14 1.47 . . . . 3.3799999999999999 111.832 179.555 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 21.7 p -61.56 -163.95 0.01 OUTLIER 'General case' 0 CA--C 1.54 0.57 0 C-N-CA 123.532 0.733 . . . . 0.83999999999999997 109.73 167.976 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 2.8 m-20 -46.37 144.2 2.2 Favored 'General case' 0 CA--C 1.53 0.189 0 O-C-N 120.682 -1.262 . . . . 1.5600000000000001 111.455 -176.951 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -55.38 -32.1 62.33 Favored 'General case' 0 CA--C 1.532 0.267 0 CA-C-O 121.811 0.815 . . . . 2.8300000000000001 110.493 -179.604 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 64' ' ' ALA . . . . . 0.576 ' HB1' ' CE1' ' A' ' 20' ' ' HIS . . . -59.1 -39.68 82.95 Favored 'General case' 0 N--CA 1.448 -0.572 0 C-N-CA 123.74 0.816 . . . . 0.56000000000000005 112.382 176.538 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 9.3 mt-10 -71.81 -43.02 66.35 Favored 'General case' 0 C--O 1.223 -0.315 0 O-C-N 121.306 -0.871 . . . . 2.21 110.618 175.67 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 53.3 t80 -50.01 -50.36 47.57 Favored 'General case' 0 CA--C 1.531 0.215 0 C-N-CA 123.524 0.73 . . . . 0.46000000000000002 110.764 175.125 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 72.2 t80 -62.91 -45.05 94.33 Favored 'General case' 0 N--CA 1.451 -0.418 0 C-N-CA 123.738 0.815 . . . . 0.46000000000000002 110.928 177.298 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -61.31 -48.89 79.29 Favored 'General case' 0 CA--C 1.537 0.455 0 O-C-N 121.078 -1.013 . . . . 0.31 111.464 -176.051 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 6.4 mm-40 -56.02 -44.12 78.41 Favored 'General case' 0 CA--C 1.515 -0.381 0 C-N-CA 124.244 1.018 . . . . 4.0099999999999998 110.732 170.394 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -54.37 -43.71 71.59 Favored 'General case' 0 N--CA 1.451 -0.408 0 CA-C-O 118.662 -0.685 . . . . 0.37 109.423 -178.423 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 14.9 t80 -58.02 -52.28 66.19 Favored 'General case' 0 N--CA 1.463 0.188 0 C-N-CA 123.756 0.823 . . . . 2.1800000000000002 111.995 171.849 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 4.0 tmm_? -47.14 -52.57 15.11 Favored 'General case' 0 N--CA 1.465 0.321 0 C-N-CA 123.592 0.757 . . . . 2.52 110.191 179.917 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 73' ' ' LEU . . . . . 0.749 HD12 HG23 ' A' ' 85' ' ' VAL . 0.2 OUTLIER -66.44 -37.96 86.34 Favored 'General case' 0 C--N 1.329 -0.298 0 C-N-CA 126.55 1.94 . . . . 0.48999999999999999 111.003 178.297 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild core ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER -58.7 -37.57 76.38 Favored 'General case' 0 C--O 1.233 0.193 0 C-N-CA 123.385 0.674 . . . . 2.3900000000000001 111.506 -172.093 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 75' ' ' HIS . . . . . 0.405 ' CE1' HD12 ' A' ' 15' ' ' ILE . 10.0 p80 -95.43 -7.81 37.28 Favored 'General case' 0 CA--C 1.529 0.145 0 CA-C-O 116.395 -1.764 . . . . 0.93000000000000005 113.503 -179.979 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 7.6 m -38.53 125.01 1.36 Allowed 'General case' 0 C--N 1.342 0.277 0 CA-C-N 120.413 1.461 . . . . 0.98999999999999999 111.861 -167.006 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 2.7 p -51.94 -43.4 63.45 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 113.491 -1.686 . . . . 0.98999999999999999 109.045 176.7 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 10.6 t0 -66.84 106.15 1.8 Allowed 'General case' 0 N--CA 1.448 -0.531 0 N-CA-C 108.565 -0.902 . . . . 1.97 108.565 164.132 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 5.0 t-80 -62.36 -25.47 67.93 Favored 'General case' 0 N--CA 1.454 -0.264 0 O-C-N 121.373 -0.829 . . . . 6.0499999999999998 111.213 179.491 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -64.24 -43.76 93.94 Favored 'General case' 0 N--CA 1.452 -0.33 0 CA-C-N 118.988 0.813 . . . . 0.75 110.529 176.87 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 81' ' ' GLU . . . . . 0.542 ' HA ' ' HE3' ' A' ' 84' ' ' LYS . 7.5 mt-10 -49.77 -39.06 36.66 Favored 'General case' 0 CA--C 1.513 -0.451 0 C-N-CA 124.094 0.958 . . . . 2.6000000000000001 111.521 176.738 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 8.4 mtp180 -62.61 -47.68 82.71 Favored 'General case' 0 C--N 1.325 -0.482 0 N-CA-C 108.707 -0.849 . . . . 2.52 108.707 177.765 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . 0.416 HD13 ' HA ' ' A' ' 83' ' ' LEU . 1.6 mm? -64.81 -21.09 66.71 Favored 'General case' 0 N--CA 1.453 -0.316 0 CA-C-O 117.163 -1.398 . . . . 0.5 113.671 173.887 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 84' ' ' LYS . . . . . 0.542 ' HE3' ' HA ' ' A' ' 81' ' ' GLU . 0.0 OUTLIER -64.61 -43.52 93.48 Favored 'General case' 0 N--CA 1.463 0.202 0 CA-C-N 122.234 2.288 . . . . 2.2200000000000002 107.594 170.053 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild core ' A' A ' 85' ' ' VAL . . . . . 0.749 HG23 HD12 ' A' ' 73' ' ' LEU . 68.3 t -63.18 -59.23 4.69 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.603 0 CA-C-O 117.267 -1.349 . . . . 0.40999999999999998 110.792 173.786 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 15.5 mt-30 -53.84 -44.15 70.05 Favored 'General case' 0 N--CA 1.465 0.286 0 CA-C-N 122.14 2.246 . . . . 1.78 112.29 -176.415 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 34.2 tttm -57.33 -48.24 79.48 Favored 'General case' 0 N--CA 1.449 -0.493 0 O-C-N 121.306 -0.871 . . . . 2.1299999999999999 110.903 178.139 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 6.3 m-20 -90.12 -0.37 57.57 Favored 'General case' 0 C--N 1.328 -0.327 0 C-N-CA 122.584 0.353 . . . . 0.92000000000000004 111.037 -174.635 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 89' ' ' ALA . . . . . 0.59 ' HB2' HD21 ' A' ' 55' ' ' LEU . . . -168.48 57.62 0.35 Allowed Pre-proline 0 CA--C 1.536 0.418 0 C-N-CA 124.876 1.27 . . . . 0.46000000000000002 109.764 -163.789 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 34.3 Cg_endo -61.12 -36.33 81.87 Favored 'Trans proline' 0 N--CA 1.455 -0.744 0 C-N-CA 121.87 1.713 . . . . 2.3199999999999998 109.501 -174.302 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 2.6 ptpt -75.82 -44.85 39.07 Favored 'General case' 0 N--CA 1.449 -0.489 0 C-N-CA 124.498 1.119 . . . . 2.3999999999999999 112.342 177.706 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 3.6 m -58.64 -45.13 89.95 Favored 'General case' 0 N--CA 1.463 0.178 0 CA-C-N 120.355 1.434 . . . . 0.38 110.675 -176.424 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 17.2 t80 -59.46 -49.53 77.44 Favored 'General case' 0 CA--C 1.508 -0.657 0 CA-C-O 120.99 0.424 . . . . 2.2000000000000002 110.083 178.267 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 26.1 tt0 -57.79 -28.72 64.26 Favored 'General case' 0 N--CA 1.445 -0.713 0 CA-C-N 115.283 -0.871 . . . . 1.3999999999999999 110.449 -178.64 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 8.7 t80 -64.37 -57.79 8.33 Favored 'General case' 0 N--CA 1.452 -0.348 0 C-N-CA 123.683 0.793 . . . . 1.3600000000000001 110.445 -176.579 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 96' ' ' ILE . . . . . 0.419 HD12 ' H ' ' A' ' 96' ' ' ILE . 3.7 mp -58.05 -39.45 72.5 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.187 0 N-CA-C 108.894 -0.78 . . . . 0.87 108.894 174.79 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 14.4 t30 -62.6 -30.83 71.63 Favored 'General case' 0 CA--C 1.536 0.412 0 O-C-N 121.55 -0.719 . . . . 1.48 111.601 -178.869 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 2.1 t0 . . . . . 0 C--O 1.23 0.079 0 C-N-CA 125.306 1.442 . . . . 2.23 108.544 174.899 . . . . . . . . 0 0 . 1 . 023 nuclear nobuild core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 36.1 t80 . . . . . 0 CA--C 1.515 -0.4 0 N-CA-C 109.689 -0.485 . . . . 4.1399999999999997 109.689 . . . . . . . . . 0 0 . 1 . 023 nuclear nobuild core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER -62.6 -36.22 74.07 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.32 0 O-C-N 122.064 -0.398 . . . . 0.55000000000000004 111.815 -178.084 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 9.6 t60 -59.94 -55.49 33.43 Favored 'General case' 0 C--N 1.343 0.305 0 N-CA-C 107.168 -1.419 . . . . 0.47999999999999998 107.168 176.715 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 43.6 mt-10 -58.7 -32.45 69.18 Favored 'General case' 0 N--CA 1.456 -0.173 0 C-N-CA 123.463 0.705 . . . . 1.96 112.251 -179.626 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 24.8 t80 -59.94 -40.75 90.03 Favored 'General case' 0 CA--C 1.517 -0.292 0 CA-C-N 118.797 0.726 . . . . 3.8199999999999998 109.2 177.213 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -52.04 -46.98 55.5 Favored Glycine 0 CA--C 1.53 0.981 0 C-N-CA 120.622 -0.799 . . . . 0.57999999999999996 111.452 170.583 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 42.3 m-70 -58.18 -47.11 84.44 Favored 'General case' 0 N--CA 1.464 0.262 0 CA-C-N 119.119 1.46 . . . . 3.6499999999999999 111.384 176.121 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -59.43 -30.54 68.55 Favored 'General case' 0 N--CA 1.454 -0.267 0 O-C-N 122.105 -0.372 . . . . 0.83999999999999997 110.943 -178.619 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 77.1 t -72.21 -42.33 66.51 Favored 'Isoleucine or valine' 0 C--O 1.232 0.146 0 O-C-N 121.205 -0.934 . . . . 1.0700000000000001 110.5 177.581 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--N 1.329 -0.298 0 C-N-CA 123.195 0.598 . . . . 2.21 110.893 172.011 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 9.1 t70 . . . . . 0 CA--C 1.529 0.147 0 CA-C-O 121.36 0.6 . . . . 2.52 110.057 . . . . . . . . . 0 0 . 1 . 023 nuclear nobuild core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 3.6 mm -51.1 -59.65 1.19 Allowed 'Isoleucine or valine' 0 CA--C 1.535 0.396 0 C-N-CA 125.81 1.644 . . . . 0.56000000000000005 109.321 -174.067 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 24.8 t80 -54.94 -34.67 63.44 Favored 'General case' 0 C--N 1.329 -0.316 0 O-C-N 121.365 -0.835 . . . . 0.51000000000000001 112.558 177.878 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . 0.56 ' HA ' ' HE2' ' A' ' 49' ' ' LYS . 0.1 OUTLIER -65.59 -40.54 92.81 Favored 'General case' 0 N--CA 1.452 -0.356 0 O-C-N 120.365 -1.459 . . . . 1.05 111.581 -176.127 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 4.9 tp10 -89.68 -65.78 0.98 Allowed 'General case' 0 N--CA 1.452 -0.362 0 N-CA-C 108.834 -0.802 . . . . 2.1200000000000001 108.834 -178.719 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . 0.403 ' OE1' ' HE2' ' A' ' 91' ' ' LYS . 9.9 mp0 -68.49 -27.71 66.37 Favored 'General case' 0 C--O 1.234 0.285 0 O-C-N 121.478 -0.764 . . . . 3.0899999999999999 111.109 -171.795 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . 0.415 ' HA2' ' CD1' ' A' ' 66' ' ' PHE . . . -67.99 37.29 0.24 Allowed Glycine 0 CA--C 1.53 1.01 0 C-N-CA 125.254 1.407 . . . . 0.34000000000000002 114.018 169.81 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 59.6 p -146.62 20.77 1.32 Allowed 'General case' 0 N--CA 1.448 -0.559 0 O-C-N 120.695 -1.473 . . . . 2.0699999999999998 111.485 159.996 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 46.8 t30 -130.93 -38.34 1.26 Allowed 'General case' 0 C--N 1.342 0.245 0 N-CA-C 112.954 0.724 . . . . 1.8300000000000001 112.954 -165.227 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 22.9 mt -68.36 -36.23 78.91 Favored 'General case' 0 N--CA 1.463 0.198 0 O-C-N 121.434 -0.791 . . . . 0.56999999999999995 110.615 -178.36 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 1.4 t 176.93 169.95 0.52 Allowed 'General case' 0 CA--C 1.53 0.189 0 C-N-CA 125.313 1.445 . . . . 0.56999999999999995 108.043 -175.155 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 8.2 m -61.24 -31.3 71.09 Favored 'General case' 0 N--CA 1.453 -0.285 0 C-N-CA 123.466 0.707 . . . . 1.02 110.909 170.296 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -64.63 -23.13 67.16 Favored 'General case' 0 N--CA 1.464 0.237 0 CA-C-O 121.089 0.471 . . . . 1.01 111.253 173.269 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -74.51 -12.77 82.23 Favored Glycine 0 N--CA 1.443 -0.89 0 CA-C-O 118.722 -1.044 . . . . 0.46999999999999997 111.313 175.156 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 60.0 ttt-85 -110.02 -16.01 13.92 Favored 'General case' 0 C--O 1.23 0.075 0 CA-C-N 119.177 1.489 . . . . 2.3399999999999999 112.76 -177.623 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 1.5 p -60.71 -169.21 0.01 OUTLIER 'General case' 0 CA--C 1.536 0.436 0 C-N-CA 122.487 0.315 . . . . 0.91000000000000003 110.281 166.645 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 5.3 m120 -45.92 147.29 1.02 Allowed 'General case' 0 C--N 1.341 0.211 0 O-C-N 121.346 -0.846 . . . . 2.0899999999999999 111.065 179.606 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 14.1 tm-20 -61.44 -28.89 69.59 Favored 'General case' 0 CA--C 1.533 0.321 0 CA-C-O 120.649 0.261 . . . . 3.3799999999999999 111.017 -173.999 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -52.36 -37.15 55.49 Favored 'General case' 0 CA--C 1.52 -0.203 0 N-CA-C 113.414 0.894 . . . . 0.48999999999999999 113.414 171.854 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 2.3 mm-40 -84.89 -35.96 21.83 Favored 'General case' 0 C--N 1.322 -0.613 0 C-N-CA 124.468 1.107 . . . . 2.5899999999999999 110.039 -173.84 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 66' ' ' PHE . . . . . 0.415 ' CD1' ' HA2' ' A' ' 52' ' ' GLY . 67.9 t80 -53.02 -50.47 64.2 Favored 'General case' 0 N--CA 1.453 -0.284 0 C-N-CA 124.403 1.081 . . . . 0.32000000000000001 111.219 166.555 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 77.5 t80 -63.03 -48.14 80.03 Favored 'General case' 0 CA--C 1.535 0.375 0 O-C-N 121.237 -0.915 . . . . 0.38 110.432 178.424 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -61.66 -53.47 55.67 Favored 'General case' 0 CA--C 1.536 0.426 0 N-CA-C 114.106 1.151 . . . . 0.45000000000000001 114.106 -176.524 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -58.81 -40.23 83.48 Favored 'General case' 0 C--N 1.329 -0.29 0 O-C-N 121.019 -1.051 . . . . 3.6899999999999999 110.821 174.094 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -55.93 -42.04 75.51 Favored 'General case' 0 C--O 1.222 -0.35 0 CA-C-N 118.52 0.6 . . . . 0.60999999999999999 110.326 174.258 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -54.56 -51.44 65.23 Favored 'General case' 0 N--CA 1.464 0.229 0 C-N-CA 123.943 0.897 . . . . 3.1400000000000001 111.375 172.45 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 52.2 ttt-85 -51.96 -50.13 61.83 Favored 'General case' 0 N--CA 1.462 0.148 0 CA-C-N 117.918 0.326 . . . . 2.2000000000000002 110.206 179.363 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 73' ' ' LEU . . . . . 0.503 ' CB ' HG21 ' A' ' 85' ' ' VAL . 0.1 OUTLIER -68.7 -30.81 69.55 Favored 'General case' 0 C--N 1.328 -0.351 0 C-N-CA 124.389 1.075 . . . . 0.56000000000000005 110.938 -178.388 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild core ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 2.4 ttp -63.73 -34.54 78.1 Favored 'General case' 0 N--CA 1.454 -0.244 0 C-N-CA 123.267 0.627 . . . . 2.6299999999999999 111.059 -174.614 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 10.0 p80 -99.21 1.46 44.85 Favored 'General case' 0 CA--C 1.531 0.227 0 CA-C-O 116.663 -1.637 . . . . 1.22 113.724 178.679 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 6.7 m -42.31 120.37 1.62 Allowed 'General case' 0 C--N 1.343 0.304 0 CA-C-N 120.573 1.533 . . . . 1.26 110.473 -171.843 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 2.7 p -48.34 -43.88 33.79 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 113.744 -1.571 . . . . 1.3100000000000001 109.064 178.449 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 11.7 t0 -69.72 105.91 2.9 Favored 'General case' 0 N--CA 1.446 -0.652 0 CA-C-O 122.006 0.908 . . . . 1.99 109.291 163.942 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 49.4 p-80 -49.38 -38.4 28.46 Favored 'General case' 0 N--CA 1.453 -0.285 0 CA-C-N 115.476 -0.784 . . . . 4.3399999999999999 111.98 173.605 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -61.52 -42.41 98.77 Favored 'General case' 0 C--N 1.331 -0.209 0 O-C-N 121.689 -0.632 . . . . 1.0700000000000001 110.778 -177.741 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 81' ' ' GLU . . . . . 0.423 ' HA ' ' HD3' ' A' ' 84' ' ' LYS . 18.7 mm-40 -53.77 -36.87 62.86 Favored 'General case' 0 N--CA 1.451 -0.424 0 C-N-CA 123.183 0.593 . . . . 4.4100000000000001 111.964 175.429 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 14.6 mtp180 -65.06 -46.26 81.93 Favored 'General case' 0 C--N 1.325 -0.471 0 C-N-CA 119.022 -1.071 . . . . 2.3199999999999998 108.683 176.861 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 1.6 mm? -62.29 -23.17 66.58 Favored 'General case' 0 N--CA 1.455 -0.195 0 CA-C-O 117.724 -1.132 . . . . 0.46999999999999997 112.909 175.88 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 84' ' ' LYS . . . . . 0.423 ' HD3' ' HA ' ' A' ' 81' ' ' GLU . 2.4 mptm? -60.98 -46.15 91.93 Favored 'General case' 0 CA--C 1.516 -0.329 0 CA-C-N 120.922 1.692 . . . . 1.3799999999999999 108.18 169.891 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 85' ' ' VAL . . . . . 0.503 HG21 ' CB ' ' A' ' 73' ' ' LEU . 90.3 t -62.12 -61.08 1.79 Allowed 'Isoleucine or valine' 0 N--CA 1.45 -0.463 0 CA-C-O 118.141 -0.933 . . . . 0.42999999999999999 109.951 176.448 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 2.5 mt-30 -50.03 -49.67 50.16 Favored 'General case' 0 CA--C 1.53 0.183 0 CA-C-N 119.842 1.201 . . . . 1.8999999999999999 111.88 -173.058 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 13.2 ptpt -65.99 -40.37 91.12 Favored 'General case' 0 N--CA 1.456 -0.157 0 O-C-N 121.896 -0.503 . . . . 4.0999999999999996 111.055 -176.227 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 52.1 m-20 -79.43 -10.78 59.88 Favored 'General case' 0 N--CA 1.461 0.105 0 N-CA-C 112.051 0.389 . . . . 1.77 112.051 -179.694 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -155.7 71.48 5.38 Favored Pre-proline 0 N--CA 1.446 -0.64 0 C-N-CA 124.409 1.084 . . . . 0.42999999999999999 109.413 -170.568 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 76.5 Cg_endo -81.13 60.49 7.85 Favored 'Trans proline' 0 N--CA 1.459 -0.552 0 C-N-CA 124.506 3.471 . . . . 1.7 110.822 -173.769 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 91' ' ' LYS . . . . . 0.403 ' HE2' ' OE1' ' A' ' 51' ' ' GLU . 5.4 ptmt 175.03 -51.52 0.01 OUTLIER 'General case' 0 C--O 1.224 -0.287 0 C-N-CA 126.986 2.114 . . . . 2.1400000000000001 109.716 -170.202 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 2.9 m -57.34 -44.93 84.67 Favored 'General case' 0 CA--C 1.522 -0.116 0 CA-C-N 119.286 0.948 . . . . 0.39000000000000001 110.245 176.946 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 8.0 t80 -59.25 -47.46 85.27 Favored 'General case' 0 CA--C 1.506 -0.716 0 C-N-CA 120.309 -0.557 . . . . 1.95 110.391 177.709 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 54.4 tt0 -57.34 -33.83 68.16 Favored 'General case' 0 N--CA 1.44 -0.946 0 CA-C-N 115.173 -0.921 . . . . 1.75 110.594 178.085 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 6.2 t80 -62.63 -54.49 38.69 Favored 'General case' 0 C--N 1.333 -0.117 0 N-CA-C 108.645 -0.872 . . . . 1.1499999999999999 108.645 -175.016 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 3.0 mp -60.34 -42.05 89.39 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.37 0 N-CA-C 108.475 -0.935 . . . . 0.82999999999999996 108.475 176.677 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 3.2 t30 -62.32 -25.99 68.18 Favored 'General case' 0 CA--C 1.535 0.377 0 CA-C-N 118.413 0.551 . . . . 1.46 111.857 -177.305 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 7.8 t70 . . . . . 0 C--O 1.228 -0.07 0 C-N-CA 124.627 1.171 . . . . 2.1699999999999999 109.202 176.609 . . . . . . . . 0 0 . 1 . 024 nuclear nobuild core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.455 -0.193 0 CA-C-O 122.071 0.939 . . . . 2.8100000000000001 109.17 . . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER -71.4 -29.3 34.86 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.453 0 CA-C-N 115.867 -0.606 . . . . 0.85999999999999999 111.641 -176.249 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 3.9 t60 -59.96 -53.37 58.69 Favored 'General case' 0 N--CA 1.453 -0.303 0 N-CA-C 106.749 -1.575 . . . . 0.92000000000000004 106.749 176.759 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 13.0 mm-40 -63.37 -30.72 71.8 Favored 'General case' 0 N--CA 1.449 -0.501 0 CA-C-O 117.943 -1.027 . . . . 4.5999999999999996 111.672 -177.13 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 1.0 OUTLIER -53.37 -54.55 35.01 Favored 'General case' 0 N--CA 1.464 0.24 0 CA-C-N 119.975 1.261 . . . . 2.46 111.085 168.042 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -48.81 -47.19 31.3 Favored Glycine 0 CA--C 1.524 0.594 0 N-CA-C 109.808 -1.317 . . . . 0.95999999999999996 109.808 174.997 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 1.8 t-160 -63.28 -41.65 99.03 Favored 'General case' 0 N--CA 1.447 -0.577 0 N-CA-C 113.295 0.85 . . . . 1.75 113.295 -176.565 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -65.93 -30.98 71.65 Favored 'General case' 0 N--CA 1.449 -0.506 0 C-N-CA 123.734 0.814 . . . . 1.22 109.238 -178.759 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 93.5 t -68.52 -37.1 77.25 Favored 'Isoleucine or valine' 0 C--O 1.233 0.222 0 C-N-CA 118.57 -1.252 . . . . 1.3200000000000001 110.27 173.589 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 1.7 t70 . . . . . 0 C--N 1.331 -0.217 0 N-CA-C 111.968 0.359 . . . . 2.0499999999999998 111.968 173.291 . . . . . . . . 0 0 . 1 . 024 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 5.0 t70 . . . . . 0 N--CA 1.47 0.553 0 N-CA-C 108.557 -0.905 . . . . 2.54 108.557 . . . . . . . . . 0 0 . 1 . 024 nuclear nobuild core ' A' A ' 47' ' ' ILE . . . . . 0.507 HD13 ' HE2' ' A' ' 91' ' ' LYS . 5.1 mm -49.17 -56.15 3.03 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.478 0 C-N-CA 125.976 1.71 . . . . 0.71999999999999997 108.229 176.903 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 26.4 t80 -63.38 -30.35 71.5 Favored 'General case' 0 C--N 1.328 -0.351 0 O-C-N 120.51 -1.369 . . . . 0.94999999999999996 113.052 175.803 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . 0.498 ' HA ' ' HE2' ' A' ' 49' ' ' LYS . 0.4 OUTLIER -63.67 -50.72 68.13 Favored 'General case' 0 C--N 1.33 -0.252 0 O-C-N 120.138 -1.601 . . . . 1.72 110.76 -178.898 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 17.3 tt0 -90.63 -53.41 4.43 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.957 0.408 . . . . 3.7799999999999998 110.024 -171.823 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 10.0 mp0 -74.07 -29.66 61.99 Favored 'General case' 0 C--O 1.235 0.303 0 O-C-N 121.249 -0.907 . . . . 2.7799999999999998 110.6 -176.978 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . 0.445 ' HA2' ' CD1' ' A' ' 66' ' ' PHE . . . -71.16 33.69 0.53 Allowed Glycine 0 CA--C 1.528 0.878 0 C-N-CA 124.613 1.101 . . . . 0.62 114.306 173.462 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 44.7 t -149.15 43.19 0.95 Allowed 'General case' 0 N--CA 1.447 -0.595 0 N-CA-C 107.678 -1.231 . . . . 1.6899999999999999 107.678 158.592 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -145.4 -44.41 0.22 Allowed 'General case' 0 CA--C 1.518 -0.286 0 N-CA-C 113.226 0.824 . . . . 2.1400000000000001 113.226 -176.436 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 19.3 mt -55.72 -40.63 72.7 Favored 'General case' 0 N--CA 1.462 0.16 0 CA-C-O 121.118 0.485 . . . . 0.46000000000000002 111.445 -174.879 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 56' ' ' THR . . . . . 0.4 HG23 ' H ' ' A' ' 59' ' ' GLY . 0.0 OUTLIER -179.79 162.1 1.03 Allowed 'General case' 0 C--N 1.329 -0.309 0 N-CA-C 106.855 -1.535 . . . . 0.45000000000000001 106.855 -178.254 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 74.3 m -59.11 -33.47 70.88 Favored 'General case' 0 N--CA 1.456 -0.151 0 O-C-N 122.155 -0.341 . . . . 1.3100000000000001 110.235 171.779 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 58' ' ' TYR . . . . . 0.406 ' O ' HG22 ' A' ' 61' ' ' THR . 0.1 OUTLIER -61.71 -39.51 91.74 Favored 'General case' 0 C--O 1.226 -0.161 0 O-C-N 121.786 -0.571 . . . . 1.1699999999999999 110.255 177.149 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild core ' A' A ' 59' ' ' GLY . . . . . 0.4 ' H ' HG23 ' A' ' 56' ' ' THR . . . -74.44 -2.02 62.44 Favored Glycine 0 CA--C 1.526 0.737 0 C-N-CA 123.613 0.625 . . . . 0.88 112.313 -179.956 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 59.9 ttt180 -97.33 -7.13 32.71 Favored 'General case' 0 N--CA 1.452 -0.361 0 CA-C-N 117.965 0.883 . . . . 4.1399999999999997 111.561 174.46 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 61' ' ' THR . . . . . 0.457 HG23 ' N ' ' A' ' 62' ' ' ASN . 1.6 t -63.53 -167.24 0.02 OUTLIER 'General case' 0 CA--C 1.53 0.18 0 CA-C-O 121.574 0.702 . . . . 3.4300000000000002 110.233 166.908 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 62' ' ' ASN . . . . . 0.457 ' N ' HG23 ' A' ' 61' ' ' THR . 2.3 m120 -46.71 150.56 0.69 Allowed 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 121.279 0.561 . . . . 2.5899999999999999 111.166 170.344 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 12.6 tm-20 -53.87 -24.38 15.7 Favored 'General case' 0 CA--C 1.537 0.451 0 C-N-CA 124.098 0.959 . . . . 4.2800000000000002 111.667 -177.877 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -47.11 -57.46 5.06 Favored 'General case' 0 N--CA 1.45 -0.465 0 C-N-CA 125.215 1.406 . . . . 0.83999999999999997 113.738 169.763 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 3.3 mt-10 -85.55 -19.49 31.04 Favored 'General case' 0 CA--C 1.514 -0.434 0 C-N-CA 118.01 -1.476 . . . . 3.1699999999999999 110.798 -175.824 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 66' ' ' PHE . . . . . 0.445 ' CD1' ' HA2' ' A' ' 52' ' ' GLY . 68.3 t80 -55.35 -51.56 66.39 Favored 'General case' 0 N--CA 1.449 -0.497 0 CA-C-N 118.277 0.49 . . . . 0.51000000000000001 110.117 166.883 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 87.7 t80 -69.24 -47.17 65.49 Favored 'General case' 0 N--CA 1.445 -0.692 0 C-N-CA 123.58 0.752 . . . . 0.52000000000000002 110.188 -176.981 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -65.18 -45.93 82.85 Favored 'General case' 0 CA--C 1.538 0.493 0 O-C-N 121.757 -0.589 . . . . 0.53000000000000003 111.575 -175.747 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 9.4 mm-40 -61.37 -42.21 98.34 Favored 'General case' 0 N--CA 1.462 0.151 0 O-C-N 121.175 -0.953 . . . . 4.7599999999999998 110.541 171.442 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -57.36 -41.16 79.59 Favored 'General case' 0 C--O 1.224 -0.285 0 O-C-N 121.25 -0.906 . . . . 0.45000000000000001 110.23 -179.715 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 51.1 t80 -59.66 -50.13 75.06 Favored 'General case' 0 C--O 1.231 0.083 0 CA-C-N 118.777 0.717 . . . . 3.5499999999999998 111.0 174.769 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 34.4 ttt180 -47.63 -58.23 4.52 Favored 'General case' 0 N--CA 1.465 0.292 0 O-C-N 121.755 -0.59 . . . . 2.2599999999999998 109.902 176.281 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 73' ' ' LEU . . . . . 0.606 ' CB ' HG21 ' A' ' 85' ' ' VAL . 0.1 OUTLIER -64.23 -27.45 69.06 Favored 'General case' 0 C--N 1.329 -0.325 0 C-N-CA 125.376 1.471 . . . . 0.62 110.923 -177.101 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild core ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 1.7 ttp -58.99 -42.97 91.31 Favored 'General case' 0 N--CA 1.452 -0.365 0 C-N-CA 123.12 0.568 . . . . 2.5299999999999998 110.772 -178.358 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 17.0 p80 -93.55 -37.56 11.84 Favored 'General case' 0 C--O 1.225 -0.23 0 CA-C-O 115.576 -2.154 . . . . 1.6399999999999999 112.34 179.792 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 2.6 m 4.19 112.22 0.0 OUTLIER 'General case' 0 N--CA 1.471 0.579 0 C-N-CA 128.285 2.634 . . . . 1.1499999999999999 115.099 -176.238 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 2.0 p -43.65 -44.32 6.3 Favored 'General case' 0 N--CA 1.452 -0.354 0 C-N-CA 125.628 1.571 . . . . 1.4399999999999999 111.571 177.576 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 56.9 t0 -73.98 105.36 5.19 Favored 'General case' 0 N--CA 1.454 -0.264 0 C-N-CA 117.495 -1.682 . . . . 2.3300000000000001 108.827 166.639 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 4.1 p-80 -39.91 -39.12 0.78 Allowed 'General case' 0 CA--C 1.531 0.231 0 C-N-CA 124.355 1.062 . . . . 5.2800000000000002 112.665 170.616 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -60.86 -44.61 96.8 Favored 'General case' 0 N--CA 1.449 -0.497 0 CA-C-O 118.983 -0.532 . . . . 1.0800000000000001 110.752 -177.582 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -52.44 -38.83 60.12 Favored 'General case' 0 CA--C 1.518 -0.251 0 CA-C-O 121.222 0.534 . . . . 3.8900000000000001 110.522 177.83 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -64.82 -48.52 74.07 Favored 'General case' 0 N--CA 1.451 -0.381 0 N-CA-C 108.595 -0.891 . . . . 3.2999999999999998 108.595 179.799 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 1.6 mm? -62.69 -25.72 68.3 Favored 'General case' 0 N--CA 1.454 -0.233 0 CA-C-O 118.132 -0.937 . . . . 1.24 112.724 175.99 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 14.8 mttt -65.18 -44.09 89.58 Favored 'General case' 0 CA--C 1.518 -0.261 0 CA-C-N 120.528 1.513 . . . . 1.45 108.084 174.256 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 85' ' ' VAL . . . . . 0.606 HG21 ' CB ' ' A' ' 73' ' ' LEU . 96.6 t -63.19 -60.18 3.18 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.544 0 CA-C-O 117.295 -1.336 . . . . 0.51000000000000001 111.191 173.605 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 24.1 mt-30 -49.91 -51.11 43.32 Favored 'General case' 0 N--CA 1.463 0.189 0 CA-C-N 121.425 1.921 . . . . 2.3399999999999999 111.827 -177.277 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.92 -37.65 88.36 Favored 'General case' 0 CA--C 1.531 0.234 0 O-C-N 121.545 -0.722 . . . . 2.4199999999999999 110.933 -175.656 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 83.0 m-20 -85.45 -5.78 59.26 Favored 'General case' 0 CA--C 1.531 0.237 0 CA-C-N 118.091 0.405 . . . . 1.1299999999999999 111.134 179.869 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -159.93 74.34 3.07 Favored Pre-proline 0 N--CA 1.446 -0.629 0 C-N-CA 125.016 1.326 . . . . 0.34999999999999998 109.482 -173.903 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 85.3 Cg_endo -82.05 50.78 3.57 Favored 'Trans proline' 0 CA--C 1.536 0.582 0 C-N-CA 124.294 3.329 . . . . 1.6499999999999999 110.96 -175.479 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 91' ' ' LYS . . . . . 0.507 ' HE2' HD13 ' A' ' 47' ' ' ILE . 0.1 OUTLIER -169.1 -57.57 0.02 OUTLIER 'General case' 0 N--CA 1.451 -0.393 0 C-N-CA 126.777 2.031 . . . . 2.3100000000000001 108.28 -174.189 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild core ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 3.9 m -50.15 -45.5 53.27 Favored 'General case' 0 N--CA 1.464 0.226 0 C-N-CA 123.835 0.854 . . . . 0.47999999999999998 112.276 178.02 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 16.6 t80 -57.31 -50.75 71.94 Favored 'General case' 0 CA--C 1.512 -0.507 0 CA-C-O 121.843 0.83 . . . . 2.5699999999999998 110.712 179.03 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 23.2 tt0 -60.19 -28.33 67.88 Favored 'General case' 0 N--CA 1.441 -0.908 0 CA-C-N 114.221 -1.354 . . . . 2.8300000000000001 110.007 -179.083 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 4.5 t80 -65.73 -55.75 15.69 Favored 'General case' 0 N--CA 1.452 -0.354 0 C-N-CA 124.364 1.065 . . . . 1.1699999999999999 110.205 -177.754 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 2.8 mp -56.67 -45.1 82.54 Favored 'Isoleucine or valine' 0 C--O 1.228 -0.068 0 N-CA-C 107.961 -1.125 . . . . 0.82999999999999996 107.961 176.34 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 5.3 t30 -58.24 -33.08 68.97 Favored 'General case' 0 CA--C 1.538 0.516 0 N-CA-C 111.962 0.356 . . . . 1.6200000000000001 111.962 -178.891 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 28.8 t70 . . . . . 0 CA--C 1.517 -0.306 0 C-N-CA 125.203 1.401 . . . . 1.97 110.777 178.459 . . . . . . . . 0 0 . 1 . 025 nuclear nobuild core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 3.2 t80 . . . . . 0 C--O 1.227 -0.12 0 CA-C-O 121.081 0.467 . . . . 3.0800000000000001 111.24 . . . . . . . . . 0 0 . 1 . 025 nuclear nobuild core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 0.5 OUTLIER -66.17 -34.37 69.74 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.501 0 O-C-N 121.567 -0.708 . . . . 0.62 112.159 -177.907 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 5.3 t60 -63.38 -53.0 59.33 Favored 'General case' 0 N--CA 1.453 -0.295 0 N-CA-C 107.832 -1.173 . . . . 0.96999999999999997 107.832 179.916 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 17.2 mt-10 -58.63 -38.66 78.54 Favored 'General case' 0 N--CA 1.449 -0.477 0 C-N-CA 127.398 2.279 . . . . 2.9199999999999999 110.004 179.683 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -51.56 -47.05 63.6 Favored 'General case' 0 CA--C 1.519 -0.225 0 C-N-CA 123.709 0.804 . . . . 2.3300000000000001 109.689 170.829 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -48.77 -49.26 28.57 Favored Glycine 0 CA--C 1.527 0.841 0 CA-C-O 119.728 -0.484 . . . . 0.57999999999999996 111.912 171.851 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 60.4 m-70 -60.62 -45.4 94.17 Favored 'General case' 0 C--O 1.223 -0.299 0 CA-C-N 119.338 1.569 . . . . 3.5499999999999998 111.422 176.115 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -62.19 -24.42 67.19 Favored 'General case' 0 CA--C 1.534 0.339 0 O-C-N 121.019 -1.051 . . . . 1.0800000000000001 111.159 -179.474 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 78.3 t -78.26 -35.7 20.02 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.183 0 O-C-N 121.197 -0.94 . . . . 1.4399999999999999 110.938 173.44 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 15.1 t0 . . . . . 0 C--N 1.333 -0.109 0 C-N-CA 124.37 1.068 . . . . 2.7000000000000002 109.716 171.278 . . . . . . . . 0 0 . 1 . 025 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 21.5 t70 . . . . . 0 N--CA 1.47 0.56 0 CA-C-O 120.617 0.246 . . . . 2.25 110.823 . . . . . . . . . 0 0 . 1 . 025 nuclear nobuild core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 5.2 mm -46.92 -52.13 4.37 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.622 0 C-N-CA 125.244 1.418 . . . . 0.95999999999999996 108.839 174.175 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 33.9 t80 -63.97 -28.01 69.52 Favored 'General case' 0 N--CA 1.453 -0.287 0 O-C-N 120.785 -1.197 . . . . 0.44 113.288 179.322 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . 0.497 ' HA ' ' HE2' ' A' ' 49' ' ' LYS . 10.5 mmpt? -68.97 -48.76 62.35 Favored 'General case' 0 C--N 1.329 -0.323 0 O-C-N 119.908 -1.745 . . . . 0.97999999999999998 110.834 -177.838 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 4.2 tp10 -84.88 -58.48 2.69 Favored 'General case' 0 N--CA 1.453 -0.322 0 N-CA-C 108.743 -0.836 . . . . 2.21 108.743 -174.232 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 20.7 mp0 -74.56 -31.74 62.19 Favored 'General case' 0 C--O 1.235 0.3 0 O-C-N 121.052 -1.03 . . . . 2.6800000000000002 110.982 -174.844 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . 0.403 ' HA2' ' CD1' ' A' ' 66' ' ' PHE . . . -72.39 42.98 0.85 Allowed Glycine 0 CA--C 1.531 1.091 0 C-N-CA 125.097 1.332 . . . . 0.40000000000000002 114.336 174.354 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 27.9 t -155.03 35.15 0.39 Allowed 'General case' 0 N--CA 1.451 -0.409 0 O-C-N 121.048 -1.266 . . . . 1.8799999999999999 108.614 153.332 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 42.9 t30 -140.52 -40.56 0.42 Allowed 'General case' 0 C--N 1.341 0.197 0 N-CA-C 112.728 0.64 . . . . 1.9399999999999999 112.728 -164.997 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 30.9 mt -64.31 -38.68 91.91 Favored 'General case' 0 C--N 1.332 -0.177 0 O-C-N 121.85 -0.531 . . . . 0.64000000000000001 110.754 178.209 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 1.4 t 177.57 171.6 0.6 Allowed 'General case' 0 CA--C 1.531 0.241 0 C-N-CA 125.513 1.525 . . . . 0.67000000000000004 107.612 -175.372 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 8.5 m -59.82 -31.32 69.62 Favored 'General case' 0 N--CA 1.455 -0.216 0 O-C-N 121.717 -0.614 . . . . 1.04 110.634 168.421 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -66.28 -19.05 65.71 Favored 'General case' 0 N--CA 1.463 0.183 0 N-CA-C 112.045 0.387 . . . . 1.3100000000000001 112.045 174.735 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -83.04 -8.44 85.69 Favored Glycine 0 N--CA 1.439 -1.102 0 CA-C-O 118.579 -1.123 . . . . 0.42999999999999999 110.546 175.792 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -110.77 -18.99 13.0 Favored 'General case' 0 C--O 1.232 0.166 0 CA-C-N 119.357 1.579 . . . . 2.71 112.527 -176.347 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 3.4 p -62.77 -163.57 0.01 OUTLIER 'General case' 0 CA--C 1.538 0.483 0 C-N-CA 124.177 0.991 . . . . 0.94999999999999996 109.447 168.282 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 78.1 m-20 -53.29 148.33 8.84 Favored 'General case' 0 CA--C 1.53 0.175 0 O-C-N 120.449 -1.407 . . . . 2.7799999999999998 110.445 -174.14 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 30.7 tt0 -59.77 -26.94 66.11 Favored 'General case' 0 CA--C 1.537 0.477 0 C-N-CA 123.226 0.61 . . . . 2.8700000000000001 111.168 -176.07 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -62.38 -39.27 92.64 Favored 'General case' 0 N--CA 1.458 -0.063 0 O-C-N 121.367 -0.833 . . . . 0.58999999999999997 112.509 171.63 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 13.9 mt-10 -69.2 -44.35 72.31 Favored 'General case' 0 CA--C 1.514 -0.439 0 O-C-N 121.041 -1.037 . . . . 2.21 110.435 177.45 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 66' ' ' PHE . . . . . 0.403 ' CD1' ' HA2' ' A' ' 52' ' ' GLY . 51.7 t80 -53.04 -46.03 68.3 Favored 'General case' 0 CA--C 1.534 0.328 0 C-N-CA 125.308 1.443 . . . . 0.34000000000000002 111.296 173.485 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 62.3 t80 -64.01 -48.48 76.21 Favored 'General case' 0 CA--C 1.534 0.33 0 CA-C-O 122.217 1.008 . . . . 0.68999999999999995 109.973 177.379 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -64.44 -41.96 96.26 Favored 'General case' 0 N--CA 1.446 -0.648 0 O-C-N 121.203 -0.936 . . . . 0.44 113.226 -174.564 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -68.67 -35.77 77.66 Favored 'General case' 0 C--N 1.332 -0.154 0 O-C-N 121.054 -1.029 . . . . 3.6299999999999999 109.848 175.006 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -54.24 -41.27 68.56 Favored 'General case' 0 C--O 1.223 -0.315 0 CA-C-N 118.949 0.795 . . . . 0.38 110.327 171.101 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 19.7 t80 -58.48 -49.97 75.44 Favored 'General case' 0 N--CA 1.464 0.241 0 CA-C-N 120.027 1.285 . . . . 3.3999999999999999 111.635 173.45 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -51.44 -54.38 27.46 Favored 'General case' 0 CA--C 1.531 0.239 0 O-C-N 121.709 -0.62 . . . . 4.1200000000000001 110.506 179.035 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 73' ' ' LEU . . . . . 0.608 ' HB3' HG21 ' A' ' 85' ' ' VAL . 0.1 OUTLIER -66.65 -32.77 74.31 Favored 'General case' 0 C--N 1.324 -0.543 0 C-N-CA 124.377 1.071 . . . . 0.41999999999999998 109.96 -174.468 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild core ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 1.8 tmt? -61.58 -39.32 90.75 Favored 'General case' 0 N--CA 1.447 -0.606 0 C-N-CA 123.676 0.79 . . . . 2.52 112.124 -177.774 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 13.0 p80 -94.59 -8.93 36.68 Favored 'General case' 0 C--O 1.232 0.133 0 CA-C-O 117.3 -1.333 . . . . 1.24 113.187 -179.655 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 9.7 m -40.03 127.37 2.16 Favored 'General case' 0 N--CA 1.45 -0.434 0 CA-C-O 123.24 1.495 . . . . 1.05 110.81 -168.459 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 1.4 p -52.63 -42.77 64.93 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 112.692 -2.049 . . . . 1.3 108.892 -178.315 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 78' ' ' ASP . . . . . 0.439 ' OD2' ' HB3' ' A' ' 80' ' ' ALA . 14.4 t0 -70.62 114.19 8.48 Favored 'General case' 0 N--CA 1.444 -0.739 0 CA-C-O 121.98 0.895 . . . . 1.9199999999999999 108.916 169.548 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 52.5 m80 -57.72 -32.39 67.36 Favored 'General case' 0 N--CA 1.455 -0.194 0 O-C-N 121.639 -0.663 . . . . 5.3300000000000001 110.615 174.597 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 80' ' ' ALA . . . . . 0.439 ' HB3' ' OD2' ' A' ' 78' ' ' ASP . . . -61.85 -50.83 70.68 Favored 'General case' 0 N--CA 1.451 -0.381 0 CA-C-O 118.401 -0.809 . . . . 0.84999999999999998 110.313 179.722 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 4.2 mt-10 -43.17 -45.45 5.57 Favored 'General case' 0 C--N 1.339 0.138 0 C-N-CA 124.725 1.21 . . . . 2.7799999999999998 110.204 176.648 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 1.9 mtp180 -63.91 -52.75 58.42 Favored 'General case' 0 N--CA 1.453 -0.32 0 CA-C-N 115.828 -0.623 . . . . 2.9199999999999999 109.778 -178.497 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 1.3 mm? -63.67 -21.08 66.2 Favored 'General case' 0 N--CA 1.452 -0.33 0 CA-C-O 117.651 -1.166 . . . . 0.70999999999999996 112.701 178.042 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 2.5 mptm? -64.12 -44.55 91.89 Favored 'General case' 0 C--O 1.225 -0.221 0 CA-C-N 121.324 1.875 . . . . 1.48 107.639 171.2 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 85' ' ' VAL . . . . . 0.608 HG21 ' HB3' ' A' ' 73' ' ' LEU . 84.4 t -62.11 -60.82 2.11 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.489 0 CA-C-O 118.144 -0.931 . . . . 0.40000000000000002 110.368 175.324 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -51.13 -48.14 61.87 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 119.765 1.166 . . . . 2.0899999999999999 111.197 -174.493 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 37.4 tttm -56.85 -48.54 77.84 Favored 'General case' 0 N--CA 1.449 -0.519 0 C-N-CA 123.769 0.828 . . . . 3.2200000000000002 111.754 176.457 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 47.4 m-20 -79.29 -7.81 58.58 Favored 'General case' 0 CA--C 1.532 0.261 0 C-N-CA 123.231 0.612 . . . . 1.1399999999999999 111.556 -177.244 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -165.8 73.19 1.3 Allowed Pre-proline 0 N--CA 1.448 -0.558 0 C-N-CA 125.488 1.515 . . . . 0.73999999999999999 110.345 -167.72 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 74.4 Cg_endo -73.31 8.14 1.91 Allowed 'Trans proline' 0 N--CA 1.457 -0.62 0 C-N-CA 123.099 2.532 . . . . 1.95 112.875 -175.093 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -122.43 -47.93 2.09 Favored 'General case' 0 N--CA 1.45 -0.431 0 C-N-CA 125.221 1.408 . . . . 2.29 109.638 -177.625 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 2.7 m -53.92 -46.87 71.61 Favored 'General case' 0 C--N 1.334 -0.081 0 C-N-CA 123.706 0.803 . . . . 0.81000000000000005 111.132 177.568 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 10.3 t80 -60.27 -47.45 85.94 Favored 'General case' 0 CA--C 1.508 -0.635 0 CA-C-O 121.355 0.598 . . . . 2.4900000000000002 110.567 178.499 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 24.2 tt0 -56.58 -33.76 66.5 Favored 'General case' 0 N--CA 1.441 -0.912 0 CA-C-N 114.693 -1.139 . . . . 2.0499999999999998 109.882 -179.914 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 3.2 t80 -63.33 -57.94 8.73 Favored 'General case' 0 N--CA 1.455 -0.221 0 C-N-CA 124.443 1.097 . . . . 1.1599999999999999 109.633 -175.891 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 47.0 mm -51.9 -46.72 41.18 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.14 0 C-N-CA 123.345 0.658 . . . . 1.8799999999999999 109.67 175.575 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 40.3 t30 -63.75 -32.99 74.67 Favored 'General case' 0 CA--C 1.53 0.205 0 N-CA-C 111.714 0.264 . . . . 2.0299999999999998 111.714 -176.559 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 CA--C 1.523 -0.075 0 C-N-CA 124.304 1.042 . . . . 2.1699999999999999 108.639 176.778 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 CA--C 1.522 -0.097 0 CA-C-O 121.161 0.505 . . . . 4.1299999999999999 109.853 . . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER -62.36 -33.65 60.24 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.313 0 N-CA-C 112.617 0.599 . . . . 0.54000000000000004 112.617 178.838 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 10.1 t60 -61.62 -52.33 64.8 Favored 'General case' 0 CA--C 1.531 0.213 0 N-CA-C 106.684 -1.599 . . . . 0.67000000000000004 106.684 178.349 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 36.7 mt-10 -57.21 -36.84 71.37 Favored 'General case' 0 CA--C 1.53 0.207 0 O-C-N 121.473 -0.767 . . . . 2.6299999999999999 111.337 176.946 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 1.1 t80 -56.9 -41.73 78.63 Favored 'General case' 0 C--N 1.33 -0.25 0 O-C-N 121.511 -0.743 . . . . 2.1400000000000001 110.881 175.398 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -52.88 -45.11 61.59 Favored Glycine 0 CA--C 1.53 0.97 0 N-CA-C 111.249 -0.74 . . . . 0.72999999999999998 111.249 172.631 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 71.6 m-70 -59.7 -49.02 79.35 Favored 'General case' 0 C--O 1.227 -0.105 0 CA-C-N 118.216 1.008 . . . . 3.6200000000000001 111.279 175.403 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -58.69 -29.29 66.52 Favored 'General case' 0 CA--C 1.533 0.291 0 O-C-N 122.018 -0.426 . . . . 0.59999999999999998 110.982 -179.185 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 49.3 t -66.57 -42.21 89.59 Favored 'Isoleucine or valine' 0 C--O 1.233 0.223 0 O-C-N 121.08 -1.012 . . . . 1.0 111.053 176.27 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 65.0 m-20 . . . . . 0 C--O 1.232 0.146 0 CA-C-N 117.904 0.32 . . . . 2.1699999999999999 111.648 175.777 . . . . . . . . 0 0 . 1 . 026 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 1.6 t70 . . . . . 0 N--CA 1.468 0.432 0 N-CA-C 109.612 -0.514 . . . . 2.1899999999999999 109.612 . . . . . . . . . 0 0 . 1 . 026 nuclear nobuild core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 4.4 mm -50.3 -53.25 12.52 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.26 0 C-N-CA 123.988 0.915 . . . . 0.46999999999999997 109.383 178.262 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 20.2 t80 -60.11 -32.22 70.78 Favored 'General case' 0 N--CA 1.452 -0.338 0 C-N-CA 123.504 0.722 . . . . 0.40000000000000002 112.243 178.465 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . 0.501 ' HA ' ' HE2' ' A' ' 49' ' ' LYS . 0.6 OUTLIER -63.38 -51.14 67.09 Favored 'General case' 0 CA--C 1.519 -0.22 0 O-C-N 120.336 -1.478 . . . . 0.91000000000000003 110.502 -179.331 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 3.1 tp10 -79.44 -65.98 0.93 Allowed 'General case' 0 N--CA 1.452 -0.338 0 CA-C-O 122.27 1.033 . . . . 2.1299999999999999 108.559 -175.368 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 3.8 mm-40 -72.14 -30.23 64.82 Favored 'General case' 0 N--CA 1.453 -0.316 0 C-N-CA 124.006 0.923 . . . . 2.2999999999999998 109.956 -167.336 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . 0.413 ' HA2' ' CD1' ' A' ' 66' ' ' PHE . . . -68.99 41.68 0.34 Allowed Glycine 0 CA--C 1.527 0.815 0 C-N-CA 125.706 1.622 . . . . 0.33000000000000002 113.838 169.036 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 65.3 p -145.77 22.42 1.44 Allowed 'General case' 0 N--CA 1.448 -0.55 0 O-C-N 120.871 -1.37 . . . . 1.98 111.49 159.681 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 47.9 t-20 -135.44 -44.32 0.69 Allowed 'General case' 0 C--O 1.226 -0.16 0 N-CA-C 111.906 0.336 . . . . 1.5800000000000001 111.906 -165.529 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 28.7 mt -58.55 -38.55 78.07 Favored 'General case' 0 N--CA 1.462 0.163 0 CA-C-O 120.985 0.421 . . . . 0.40000000000000002 111.142 -174.987 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER 178.16 172.03 0.68 Allowed 'General case' 0 CA--C 1.531 0.22 0 C-N-CA 125.468 1.507 . . . . 0.53000000000000003 107.591 -178.244 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 14.4 m -56.89 -35.55 69.08 Favored 'General case' 0 N--CA 1.453 -0.283 0 O-C-N 121.572 -0.705 . . . . 1.0 110.319 166.7 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -64.67 -21.43 66.73 Favored 'General case' 0 CA--C 1.534 0.343 0 CA-C-O 121.085 0.469 . . . . 1.3100000000000001 111.858 175.969 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -80.73 -12.49 82.76 Favored Glycine 0 N--CA 1.444 -0.791 0 N-CA-C 111.125 -0.79 . . . . 0.45000000000000001 111.125 176.372 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 36.4 ttt-85 -110.98 -11.59 14.31 Favored 'General case' 0 CA--C 1.529 0.171 0 CA-C-N 118.758 1.279 . . . . 2.3199999999999998 112.151 -179.15 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 2.2 p -63.9 -161.63 0.01 OUTLIER 'General case' 0 CA--C 1.54 0.568 0 C-N-CA 123.616 0.766 . . . . 0.98999999999999999 109.9 167.059 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 16.3 t-20 -52.34 151.83 3.78 Favored 'General case' 0 CA--C 1.532 0.287 0 O-C-N 120.907 -1.121 . . . . 2.1400000000000001 110.709 -177.574 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 35.7 tt0 -59.91 -36.37 76.85 Favored 'General case' 0 CA--C 1.53 0.182 0 CA-C-N 118.915 0.78 . . . . 2.4700000000000002 110.349 -176.527 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -55.37 -30.14 59.78 Favored 'General case' 0 C--N 1.331 -0.198 0 O-C-N 121.522 -0.736 . . . . 0.41999999999999998 112.813 176.924 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 1.6 mm-40 -82.16 -38.67 24.34 Favored 'General case' 0 N--CA 1.447 -0.589 0 CA-C-O 118.612 -0.709 . . . . 2.6499999999999999 110.362 -179.177 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 66' ' ' PHE . . . . . 0.413 ' CD1' ' HA2' ' A' ' 52' ' ' GLY . 59.0 t80 -55.16 -47.29 75.36 Favored 'General case' 0 N--CA 1.452 -0.361 0 C-N-CA 124.267 1.027 . . . . 0.35999999999999999 111.43 170.73 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 56.9 t80 -65.03 -48.11 75.02 Favored 'General case' 0 CA--C 1.538 0.501 0 O-C-N 121.061 -1.024 . . . . 0.48999999999999999 109.819 176.141 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -58.82 -55.69 31.92 Favored 'General case' 0 CA--C 1.536 0.44 0 N-CA-C 113.252 0.834 . . . . 0.27000000000000002 113.252 -174.7 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -55.4 -39.56 70.34 Favored 'General case' 0 C--N 1.331 -0.218 0 O-C-N 121.027 -1.045 . . . . 3.8700000000000001 111.355 171.264 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -60.17 -32.95 71.54 Favored 'General case' 0 CA--C 1.533 0.311 0 CA-C-N 119.737 1.153 . . . . 0.41999999999999998 110.872 175.516 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -59.17 -49.71 76.83 Favored 'General case' 0 N--CA 1.464 0.229 0 CA-C-N 119.127 0.876 . . . . 3.3700000000000001 111.901 168.681 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 72' ' ' ARG . . . . . 0.494 ' HE ' ' CD2' ' A' ' 73' ' ' LEU . 10.7 ttp180 -51.92 -61.61 2.15 Favored 'General case' 0 CA--C 1.534 0.352 0 O-C-N 121.392 -0.818 . . . . 2.0899999999999999 110.82 174.905 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 73' ' ' LEU . . . . . 0.494 ' CD2' ' HE ' ' A' ' 72' ' ' ARG . 0.1 OUTLIER -62.25 -45.89 91.3 Favored 'General case' 0 C--O 1.221 -0.436 0 C-N-CA 125.56 1.544 . . . . 0.48999999999999999 110.649 -170.94 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild core ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -63.61 -25.96 68.46 Favored 'General case' 0 C--N 1.331 -0.216 0 O-C-N 120.276 -1.515 . . . . 4.5700000000000003 111.808 -179.867 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -91.96 -12.11 34.28 Favored 'General case' 0 C--O 1.232 0.169 0 CA-C-O 117.063 -1.446 . . . . 1.03 112.327 175.214 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 80.3 p -48.9 122.66 5.99 Favored 'General case' 0 N--CA 1.446 -0.642 0 CA-C-N 119.8 1.182 . . . . 2.25 108.31 -167.436 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 2.2 p -51.21 -39.36 56.36 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 114.646 -1.161 . . . . 1.1100000000000001 109.641 177.102 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 13.5 t0 -63.98 104.35 0.7 Allowed 'General case' 0 N--CA 1.448 -0.528 0 CA-C-O 121.641 0.734 . . . . 2.0600000000000001 109.846 166.685 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 39.3 p-80 -50.17 -35.23 25.28 Favored 'General case' 0 C--N 1.332 -0.171 0 C-N-CA 122.991 0.517 . . . . 4.54 111.994 174.268 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -61.12 -51.24 69.93 Favored 'General case' 0 N--CA 1.449 -0.512 0 CA-C-O 118.516 -0.754 . . . . 0.63 110.736 -178.072 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 1.2 mt-10 -50.42 -39.52 47.53 Favored 'General case' 0 C--O 1.233 0.198 0 CA-C-N 119.132 0.878 . . . . 3.25 110.478 177.759 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -62.97 -52.96 60.98 Favored 'General case' 0 N--CA 1.453 -0.312 0 C-N-CA 119.218 -0.993 . . . . 3.0299999999999998 108.891 -178.588 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 1.2 mm? -65.64 -18.1 65.08 Favored 'General case' 0 N--CA 1.451 -0.423 0 CA-C-O 117.866 -1.064 . . . . 0.55000000000000004 112.114 178.851 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 6.0 mttt -65.83 -44.65 84.91 Favored 'General case' 0 CA--C 1.516 -0.335 0 CA-C-N 120.824 1.647 . . . . 1.23 108.299 169.371 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 95.8 t -58.2 -60.28 2.44 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.497 0 CA-C-N 118.757 0.708 . . . . 0.5 110.051 171.254 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -57.37 -45.54 84.34 Favored 'General case' 0 CA--C 1.53 0.202 0 CA-C-N 119.512 1.051 . . . . 2.3500000000000001 111.812 -169.721 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 56.6 tttt -58.09 -53.44 58.25 Favored 'General case' 0 N--CA 1.451 -0.404 0 C-N-CA 123.723 0.809 . . . . 2.1600000000000001 109.712 177.03 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 4.3 m-20 -77.23 -6.5 53.27 Favored 'General case' 0 N--CA 1.453 -0.283 0 CA-C-O 118.825 -0.607 . . . . 0.92000000000000004 111.229 -173.927 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -164.46 72.9 1.61 Allowed Pre-proline 0 N--CA 1.447 -0.609 0 C-N-CA 124.952 1.301 . . . . 0.39000000000000001 110.587 -171.75 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 72.9 Cg_endo -74.27 16.89 0.55 Allowed 'Trans proline' 0 CA--C 1.536 0.584 0 C-N-CA 123.461 2.774 . . . . 1.47 113.283 -173.861 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -133.75 -41.82 0.84 Allowed 'General case' 0 N--CA 1.454 -0.252 0 C-N-CA 125.385 1.474 . . . . 2.6899999999999999 109.29 -177.635 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 5.7 m -54.55 -48.1 72.4 Favored 'General case' 0 CA--C 1.521 -0.154 0 O-C-N 121.159 -0.963 . . . . 0.38 110.615 171.517 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 2.7 t80 -59.12 -46.67 87.72 Favored 'General case' 0 CA--C 1.506 -0.733 0 C-N-CA 119.849 -0.741 . . . . 2.4500000000000002 110.492 179.342 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 50.2 tt0 -54.09 -37.13 63.93 Favored 'General case' 0 N--CA 1.442 -0.85 0 O-C-N 123.964 0.79 . . . . 2.4100000000000001 110.319 177.708 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 4.4 t80 -60.66 -57.63 11.9 Favored 'General case' 0 N--CA 1.457 -0.078 0 CA-C-N 118.549 0.613 . . . . 0.93999999999999995 109.568 -174.557 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 3.2 mp -60.9 -39.01 80.58 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.284 0 N-CA-C 109.588 -0.523 . . . . 0.75 109.588 177.598 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 9.3 t-20 -62.0 -35.41 78.43 Favored 'General case' 0 N--CA 1.455 -0.198 0 O-C-N 121.597 -0.689 . . . . 2.4500000000000002 111.443 -174.789 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 C--O 1.231 0.11 0 C-N-CA 125.679 1.592 . . . . 2.1000000000000001 108.303 174.904 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 34.0 t80 . . . . . 0 C--O 1.227 -0.117 0 CA-C-O 122.173 0.987 . . . . 3.3900000000000001 109.344 . . . . . . . . . 0 0 . 1 . 027 nuclear nobuild core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 0.7 OUTLIER -63.1 -33.97 63.94 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.469 0 O-C-N 121.625 -0.672 . . . . 0.5 111.956 179.694 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 2.2 t-160 -60.29 -53.69 54.63 Favored 'General case' 0 CA--C 1.533 0.32 0 N-CA-C 106.7 -1.592 . . . . 0.56999999999999995 106.7 176.554 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 86.4 mt-10 -51.54 -44.7 62.75 Favored 'General case' 0 C--O 1.223 -0.32 0 C-N-CA 124.455 1.102 . . . . 2.4700000000000002 110.05 177.669 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -53.37 -56.98 12.3 Favored 'General case' 0 CA--C 1.519 -0.25 0 C-N-CA 124.476 1.11 . . . . 2.4100000000000001 110.892 177.987 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -48.03 -46.66 26.6 Favored Glycine 0 CA--C 1.523 0.537 0 N-CA-C 110.466 -1.054 . . . . 0.5 110.466 175.652 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 20' ' ' HIS . . . . . 0.64 ' CE1' ' HB1' ' A' ' 64' ' ' ALA . 2.6 t-160 -60.68 -46.35 90.67 Favored 'General case' 0 N--CA 1.45 -0.428 0 O-C-N 122.052 -0.675 . . . . 1.79 112.028 -179.525 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -60.38 -31.46 70.37 Favored 'General case' 0 N--CA 1.447 -0.575 0 N-CA-C 109.428 -0.582 . . . . 0.67000000000000004 109.428 -179.214 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 26.3 t -66.47 -41.54 88.77 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.182 0 C-N-CA 118.567 -1.253 . . . . 0.85999999999999999 111.682 175.44 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 33.3 t0 . . . . . 0 N--CA 1.464 0.243 0 CA-C-O 122.098 0.952 . . . . 2.0600000000000001 111.114 174.925 . . . . . . . . 0 0 . 1 . 027 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 42.2 t0 . . . . . 0 N--CA 1.467 0.41 0 CA-C-O 121.185 0.517 . . . . 2.2799999999999998 110.335 . . . . . . . . . 0 0 . 1 . 027 nuclear nobuild core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 5.4 mm -51.94 -54.74 12.18 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.397 0 C-N-CA 124.74 1.216 . . . . 0.53000000000000003 109.523 172.673 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 48' ' ' PHE . . . . . 0.474 ' CD2' ' HE3' ' A' ' 49' ' ' LYS . 22.1 t80 -57.77 -28.62 64.14 Favored 'General case' 0 N--CA 1.452 -0.325 0 O-C-N 120.414 -1.429 . . . . 0.46999999999999997 112.148 176.538 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . 0.474 ' HE3' ' CD2' ' A' ' 48' ' ' PHE . 0.2 OUTLIER -69.17 -46.21 68.08 Favored 'General case' 0 N--CA 1.45 -0.431 0 O-C-N 120.353 -1.467 . . . . 1.1100000000000001 111.251 -178.317 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 52.3 tp10 -83.68 -66.01 0.94 Allowed 'General case' 0 C--N 1.33 -0.264 0 N-CA-C 109.009 -0.738 . . . . 2.8199999999999998 109.009 -179.688 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 29.9 mp0 -69.19 -32.6 72.0 Favored 'General case' 0 C--O 1.236 0.384 0 O-C-N 121.384 -0.823 . . . . 2.6899999999999999 111.35 -172.082 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -72.14 42.27 0.78 Allowed Glycine 0 CA--C 1.529 0.913 0 C-N-CA 124.652 1.12 . . . . 0.39000000000000001 113.949 172.5 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 22.9 t -146.38 24.43 1.26 Allowed 'General case' 0 N--CA 1.447 -0.584 0 O-C-N 121.246 -1.149 . . . . 1.5800000000000001 109.511 159.257 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -138.06 -27.99 0.88 Allowed 'General case' 0 C--N 1.342 0.273 0 N-CA-C 113.778 1.029 . . . . 2.2799999999999998 113.778 -169.979 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . 0.624 HD22 HG22 ' A' ' 85' ' ' VAL . 32.0 mt -68.28 -40.02 81.96 Favored 'General case' 0 C--N 1.333 -0.151 0 CA-C-N 119.06 0.845 . . . . 0.45000000000000001 110.793 -179.441 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER 177.71 165.42 0.65 Allowed 'General case' 0 C--N 1.33 -0.253 0 C-N-CA 125.511 1.524 . . . . 0.44 106.961 -173.477 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 7.2 m -59.8 -35.18 74.14 Favored 'General case' 0 N--CA 1.453 -0.278 0 C-N-CA 123.027 0.531 . . . . 1.05 110.637 170.262 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -71.18 -6.09 36.84 Favored 'General case' 0 CA--C 1.533 0.306 0 C-N-CA 122.88 0.472 . . . . 1.01 112.032 176.127 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -101.85 4.23 52.97 Favored Glycine 0 CA--C 1.524 0.606 0 C-N-CA 124.524 1.059 . . . . 0.54000000000000004 111.196 172.853 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -114.1 -17.89 11.81 Favored 'General case' 0 CA--C 1.527 0.064 0 C-N-CA 124.356 1.062 . . . . 3.5899999999999999 111.514 177.274 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 13.9 p -61.74 -160.13 0.01 OUTLIER 'General case' 0 CA--C 1.541 0.607 0 C-N-CA 125.443 1.497 . . . . 0.84999999999999998 109.691 168.069 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 3.7 m120 -50.49 146.62 5.26 Favored 'General case' 0 CA--C 1.535 0.373 0 O-C-N 119.983 -1.698 . . . . 2.1600000000000001 111.469 -177.081 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 38.8 tt0 -56.52 -30.62 63.24 Favored 'General case' 0 N--CA 1.467 0.398 0 CA-C-O 121.443 0.64 . . . . 2.6499999999999999 110.493 179.095 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 64' ' ' ALA . . . . . 0.64 ' HB1' ' CE1' ' A' ' 20' ' ' HIS . . . -53.69 -45.05 70.24 Favored 'General case' 0 N--CA 1.452 -0.367 0 C-N-CA 123.841 0.857 . . . . 0.57999999999999996 112.183 172.643 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 8.7 mt-10 -72.75 -39.26 66.99 Favored 'General case' 0 C--O 1.221 -0.397 0 O-C-N 121.562 -0.712 . . . . 2.29 110.756 178.484 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 55.4 t80 -51.45 -52.93 42.2 Favored 'General case' 0 C--N 1.332 -0.159 0 C-N-CA 123.337 0.655 . . . . 0.31 111.18 173.99 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 73.4 t80 -66.61 -45.54 78.83 Favored 'General case' 0 N--CA 1.449 -0.492 0 C-N-CA 123.711 0.804 . . . . 0.40999999999999998 110.579 -178.567 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -60.12 -47.6 85.22 Favored 'General case' 0 CA--C 1.539 0.537 0 O-C-N 121.198 -0.939 . . . . 0.25 111.963 -178.666 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 48.1 mm-40 -55.41 -44.79 76.55 Favored 'General case' 0 CA--C 1.517 -0.292 0 C-N-CA 125.011 1.324 . . . . 4.2300000000000004 109.975 169.36 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -55.7 -45.94 77.77 Favored 'General case' 0 N--CA 1.446 -0.632 0 CA-C-O 118.06 -0.971 . . . . 0.39000000000000001 109.508 -175.869 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 73.9 t80 -56.82 -50.8 71.3 Favored 'General case' 0 N--CA 1.464 0.271 0 CA-C-N 119.343 0.974 . . . . 2.6600000000000001 111.913 172.799 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 18.3 ttp180 -46.15 -58.02 4.0 Favored 'General case' 0 CA--C 1.531 0.25 0 CA-C-N 118.283 0.492 . . . . 2.6099999999999999 110.826 178.103 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 73' ' ' LEU . . . . . 0.611 HD12 HG23 ' A' ' 85' ' ' VAL . 0.1 OUTLIER -65.14 -32.51 74.23 Favored 'General case' 0 C--N 1.324 -0.528 0 C-N-CA 125.332 1.453 . . . . 0.40999999999999998 110.92 -178.428 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild core ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -59.48 -39.57 84.14 Favored 'General case' 0 CA--C 1.517 -0.315 0 C-N-CA 123.701 0.8 . . . . 2.52 110.012 -178.047 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 22.9 p80 -90.52 -36.45 14.48 Favored 'General case' 0 N--CA 1.45 -0.443 0 CA-C-O 115.723 -2.084 . . . . 0.95999999999999996 110.867 -176.948 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 15.9 m -8.14 111.32 0.01 OUTLIER 'General case' 0 C--N 1.348 0.53 0 C-N-CA 127.883 2.473 . . . . 1.03 113.342 -171.765 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 4.1 p -46.56 -42.62 16.19 Favored 'General case' 0 N--CA 1.45 -0.465 0 C-N-CA 125.186 1.394 . . . . 0.97999999999999998 110.567 -177.013 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 78' ' ' ASP . . . . . 0.419 ' OD2' ' HB3' ' A' ' 80' ' ' ALA . 14.6 t0 -70.13 105.63 2.99 Favored 'General case' 0 N--CA 1.447 -0.586 0 C-N-CA 118.073 -1.451 . . . . 2.2599999999999998 110.162 164.333 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 5.9 p-80 -39.38 -43.36 1.19 Allowed 'General case' 0 N--CA 1.45 -0.464 0 CA-C-N 114.457 -1.247 . . . . 4.3399999999999999 113.039 169.657 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 80' ' ' ALA . . . . . 0.419 ' HB3' ' OD2' ' A' ' 78' ' ' ASP . . . -66.98 -40.1 87.35 Favored 'General case' 0 N--CA 1.453 -0.291 0 O-C-N 121.872 -0.517 . . . . 0.91000000000000003 110.195 -172.549 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 81' ' ' GLU . . . . . 0.472 ' OE1' HD13 ' A' ' 73' ' ' LEU . 1.1 tm-20 -50.94 -41.79 59.24 Favored 'General case' 0 C--N 1.328 -0.327 0 C-N-CA 124.604 1.161 . . . . 3.3300000000000001 110.097 172.625 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -63.53 -47.18 82.68 Favored 'General case' 0 CA--C 1.519 -0.234 0 C-N-CA 119.327 -0.949 . . . . 3.2599999999999998 108.795 176.926 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . 0.403 HD13 ' HA ' ' A' ' 83' ' ' LEU . 2.1 mm? -56.57 -25.11 51.52 Favored 'General case' 0 N--CA 1.456 -0.129 0 CA-C-O 118.042 -0.98 . . . . 0.62 113.308 174.061 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 14.9 mptt -64.64 -48.33 75.23 Favored 'General case' 0 CA--C 1.52 -0.21 0 CA-C-N 121.082 1.764 . . . . 3.04 108.956 172.337 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 85' ' ' VAL . . . . . 0.624 HG22 HD22 ' A' ' 55' ' ' LEU . 2.4 t -57.87 -60.51 2.1 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.5 0 CA-C-N 118.608 0.64 . . . . 0.68999999999999995 109.921 173.488 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 86' ' ' GLN . . . . . 0.436 ' HG2' ' CG ' ' A' ' 93' ' ' PHE . 36.0 mt-30 -52.48 -50.44 62.73 Favored 'General case' 0 N--CA 1.453 -0.32 0 CA-C-N 118.909 0.777 . . . . 4.5899999999999999 111.091 -171.064 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 8.5 pttp -65.02 -41.09 95.61 Favored 'General case' 0 N--CA 1.455 -0.214 0 O-C-N 121.623 -0.673 . . . . 3.3999999999999999 110.842 -179.249 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 89.9 m-20 -79.75 -8.5 59.29 Favored 'General case' 0 CA--C 1.529 0.16 0 O-C-N 122.077 -0.389 . . . . 1.0700000000000001 110.891 -177.27 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 89' ' ' ALA . . . . . 0.542 ' HB2' HD21 ' A' ' 55' ' ' LEU . . . -160.9 62.52 1.63 Allowed Pre-proline 0 N--CA 1.446 -0.648 0 C-N-CA 123.606 0.763 . . . . 0.51000000000000001 110.769 -169.416 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 28.5 Cg_endo -59.99 -35.9 91.61 Favored 'Trans proline' 0 N--CA 1.452 -0.929 0 C-N-CA 122.018 1.812 . . . . 2.1600000000000001 110.56 -174.153 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 3.4 tttt -77.56 -44.23 29.23 Favored 'General case' 0 N--CA 1.453 -0.285 0 C-N-CA 123.496 0.718 . . . . 4.6600000000000001 111.219 -177.038 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 12.0 m -58.21 -42.47 86.26 Favored 'General case' 0 CA--C 1.518 -0.288 0 O-C-N 121.22 -0.925 . . . . 0.53000000000000003 110.394 177.734 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 93' ' ' PHE . . . . . 0.436 ' CG ' ' HG2' ' A' ' 86' ' ' GLN . 56.3 t80 -54.9 -51.38 66.2 Favored 'General case' 0 CA--C 1.502 -0.893 0 C-N-CA 120.07 -0.652 . . . . 2.7400000000000002 111.161 178.144 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 36.6 tt0 -50.94 -35.61 34.24 Favored 'General case' 0 N--CA 1.445 -0.701 0 O-C-N 124.374 1.046 . . . . 2.0299999999999998 111.016 178.74 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 4.1 t80 -58.75 -58.95 6.32 Favored 'General case' 0 CA--C 1.532 0.288 0 C-N-CA 123.268 0.627 . . . . 0.97999999999999998 110.102 -177.55 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 3.9 mp -62.89 -35.29 70.55 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.128 0 O-C-N 121.419 -0.801 . . . . 0.88 109.59 178.781 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -63.23 -29.81 71.08 Favored 'General case' 0 N--CA 1.452 -0.328 0 C-N-CA 122.693 0.397 . . . . 2.0 110.206 -179.012 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 10.7 t70 . . . . . 0 C--N 1.333 -0.116 0 CA-C-O 121.546 0.689 . . . . 2.5600000000000001 109.734 174.57 . . . . . . . . 0 0 . 1 . 028 nuclear nobuild core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 79.4 t80 . . . . . 0 C--O 1.224 -0.256 0 CA-C-O 120.58 0.228 . . . . 3.1200000000000001 111.28 . . . . . . . . . 0 0 . 1 . 028 nuclear nobuild core ' A' A ' 15' ' ' ILE . . . . . 0.425 HD12 ' CE1' ' A' ' 75' ' ' HIS . 0.9 OUTLIER -66.69 -31.0 51.54 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.192 0 O-C-N 121.457 -0.777 . . . . 0.5 112.632 -179.199 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild core ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 5.7 t60 -59.65 -57.2 13.97 Favored 'General case' 0 C--N 1.341 0.228 0 N-CA-C 106.406 -1.702 . . . . 0.62 106.406 176.359 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 44.0 mt-10 -54.11 -39.51 66.47 Favored 'General case' 0 N--CA 1.452 -0.343 0 C-N-CA 124.607 1.163 . . . . 2.1000000000000001 110.713 178.384 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 4.0 t80 -58.78 -48.08 82.5 Favored 'General case' 0 CA--C 1.521 -0.16 0 C-N-CA 124.054 0.942 . . . . 2.02 110.488 178.625 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -51.15 -45.44 51.74 Favored Glycine 0 CA--C 1.525 0.67 0 N-CA-C 110.322 -1.111 . . . . 0.41999999999999998 110.322 172.983 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 20' ' ' HIS . . . . . 0.544 ' CE1' ' HB1' ' A' ' 64' ' ' ALA . 2.3 t-160 -60.81 -48.68 80.72 Favored 'General case' 0 N--CA 1.45 -0.426 0 O-C-N 122.109 -0.642 . . . . 1.8799999999999999 111.32 179.434 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -60.3 -30.89 69.77 Favored 'General case' 0 N--CA 1.453 -0.319 0 O-C-N 121.696 -0.628 . . . . 0.67000000000000004 110.169 179.846 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 74.2 t -69.95 -39.47 77.52 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.163 0 O-C-N 121.338 -0.851 . . . . 0.83999999999999997 110.633 176.8 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 9.5 t0 . . . . . 0 C--N 1.331 -0.204 0 CA-C-O 121.364 0.602 . . . . 2.1400000000000001 110.698 172.242 . . . . . . . . 0 0 . 1 . 028 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 14.8 t70 . . . . . 0 N--CA 1.465 0.31 0 CA-C-O 121.033 0.444 . . . . 2.1200000000000001 110.396 . . . . . . . . . 0 0 . 1 . 028 nuclear nobuild core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 5.7 mm -53.31 -50.08 49.38 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.19 0 N-CA-C 108.339 -0.986 . . . . 0.46000000000000002 108.339 172.052 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 19.6 t80 -63.61 -25.76 68.38 Favored 'General case' 0 N--CA 1.454 -0.225 0 O-C-N 121.906 -0.496 . . . . 0.41999999999999998 112.008 177.667 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . 0.545 ' HA ' ' CE ' ' A' ' 49' ' ' LYS . 0.6 OUTLIER -71.22 -48.37 51.75 Favored 'General case' 0 N--CA 1.45 -0.43 0 O-C-N 119.774 -1.829 . . . . 1.49 110.888 -178.192 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 22.8 tp10 -85.63 -63.53 1.31 Allowed 'General case' 0 C--N 1.328 -0.331 0 N-CA-C 108.582 -0.896 . . . . 2.6000000000000001 108.582 -176.927 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 3.4 mm-40 -67.22 -32.86 74.2 Favored 'General case' 0 CA--C 1.536 0.407 0 C-N-CA 123.833 0.853 . . . . 2.73 109.789 -170.175 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . 0.446 ' HA2' ' CD1' ' A' ' 66' ' ' PHE . . . -68.05 43.9 0.3 Allowed Glycine 0 CA--C 1.53 1.028 0 C-N-CA 126.917 2.199 . . . . 0.34000000000000002 114.587 171.132 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 33.1 p -154.2 32.25 0.43 Allowed 'General case' 0 N--CA 1.448 -0.536 0 O-C-N 121.104 -1.233 . . . . 1.96 109.869 160.274 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -137.35 -43.94 0.55 Allowed 'General case' 0 CA--C 1.517 -0.296 0 N-CA-C 112.908 0.707 . . . . 1.8100000000000001 112.908 -168.719 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . 0.5 HD22 HG22 ' A' ' 85' ' ' VAL . 15.3 mt -63.11 -36.48 83.74 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 120.872 0.367 . . . . 0.38 110.749 -175.926 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 1.1 t 176.53 171.01 0.45 Allowed 'General case' 0 CA--C 1.531 0.234 0 C-N-CA 125.835 1.654 . . . . 0.45000000000000001 107.501 -177.919 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 20.8 m -57.38 -33.71 68.1 Favored 'General case' 0 N--CA 1.453 -0.306 0 O-C-N 121.713 -0.617 . . . . 0.91000000000000003 110.555 168.016 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -61.15 -30.89 70.66 Favored 'General case' 0 CA--C 1.53 0.199 0 CA-C-N 118.475 0.58 . . . . 1.0800000000000001 110.894 174.207 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -71.8 -11.56 73.69 Favored Glycine 0 C--O 1.221 -0.663 0 O-C-N 121.354 -0.841 . . . . 0.37 111.729 176.524 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 32.1 ttt180 -105.14 -12.54 16.07 Favored 'General case' 0 CA--C 1.533 0.294 0 CA-C-N 118.817 1.308 . . . . 2.7799999999999998 112.473 177.224 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 41.4 p -66.39 -134.9 0.0 OUTLIER 'General case' 0 N--CA 1.47 0.573 0 CA-C-N 118.833 0.742 . . . . 0.77000000000000002 111.211 178.204 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 6.7 t-20 -69.07 152.91 44.62 Favored 'General case' 0 N--CA 1.453 -0.307 0 O-C-N 119.465 -2.022 . . . . 2.8999999999999999 107.943 179.871 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 5.3 tm-20 -60.7 -33.1 72.36 Favored 'General case' 0 CA--C 1.531 0.246 0 CA-C-N 118.72 0.691 . . . . 3.3999999999999999 109.625 177.487 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 64' ' ' ALA . . . . . 0.544 ' HB1' ' CE1' ' A' ' 20' ' ' HIS . . . -61.0 -30.73 70.46 Favored 'General case' 0 N--CA 1.45 -0.435 0 N-CA-C 113.246 0.832 . . . . 0.52000000000000002 113.246 174.848 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 2.4 mt-10 -80.13 -42.31 23.76 Favored 'General case' 0 CA--C 1.51 -0.567 0 CA-C-O 118.392 -0.813 . . . . 2.3599999999999999 110.592 176.5 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 66' ' ' PHE . . . . . 0.446 ' CD1' ' HA2' ' A' ' 52' ' ' GLY . 54.7 t80 -48.99 -49.0 42.92 Favored 'General case' 0 N--CA 1.453 -0.309 0 C-N-CA 123.596 0.758 . . . . 0.33000000000000002 111.164 172.816 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 82.7 t80 -63.29 -44.42 95.11 Favored 'General case' 0 CA--C 1.539 0.53 0 O-C-N 121.319 -0.863 . . . . 0.38 110.772 177.074 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -62.21 -56.44 18.66 Favored 'General case' 0 CA--C 1.54 0.586 0 O-C-N 121.296 -0.878 . . . . 0.31 113.021 -175.594 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 1.1 pp20? -56.19 -38.45 70.98 Favored 'General case' 0 C--N 1.333 -0.123 0 O-C-N 120.962 -1.086 . . . . 3.73 111.204 171.376 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -57.91 -42.55 84.99 Favored 'General case' 0 N--CA 1.45 -0.438 0 CA-C-O 118.493 -0.765 . . . . 0.37 110.562 175.347 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 55.7 t80 -59.98 -50.08 75.16 Favored 'General case' 0 N--CA 1.464 0.268 0 CA-C-N 120.37 1.441 . . . . 2.7999999999999998 111.544 174.453 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 6.9 ttt180 -44.71 -62.22 1.29 Allowed 'General case' 0 N--CA 1.465 0.294 0 N-CA-C 109.097 -0.705 . . . . 2.2799999999999998 109.097 178.08 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 73' ' ' LEU . . . . . 0.528 HD12 HG23 ' A' ' 85' ' ' VAL . 0.1 OUTLIER -60.43 -37.93 82.47 Favored 'General case' 0 CA--C 1.515 -0.372 0 C-N-CA 125.651 1.58 . . . . 0.41999999999999998 111.107 -177.253 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild core ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 1.6 tmt? -65.81 -33.01 74.86 Favored 'General case' 0 N--CA 1.451 -0.393 0 O-C-N 122.189 -0.319 . . . . 2.8100000000000001 111.263 -174.593 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 75' ' ' HIS . . . . . 0.425 ' CE1' HD12 ' A' ' 15' ' ' ILE . 5.2 p80 -92.8 -20.43 20.74 Favored 'General case' 0 CA--C 1.527 0.096 0 CA-C-O 117.159 -1.4 . . . . 0.87 112.708 177.35 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 76' ' ' SER . . . . . 0.425 ' O ' ' HD2' ' A' ' 82' ' ' ARG . 32.0 m -33.77 114.43 0.19 Allowed 'General case' 0 C--O 1.22 -0.491 0 C-N-CA 125.981 1.712 . . . . 1.1899999999999999 112.446 -169.547 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 1.4 p -46.11 -39.96 10.24 Favored 'General case' 0 C--N 1.326 -0.441 0 C-N-CA 124.863 1.265 . . . . 1.4299999999999999 110.832 -178.968 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 11.5 t0 -65.03 103.42 0.74 Allowed 'General case' 0 N--CA 1.451 -0.407 0 CA-C-O 121.823 0.821 . . . . 1.8700000000000001 110.238 165.486 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 11.7 p80 -46.15 -37.7 7.32 Favored 'General case' 0 N--CA 1.455 -0.212 0 C-N-CA 123.574 0.75 . . . . 4.4699999999999998 112.13 173.316 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -61.1 -47.05 88.09 Favored 'General case' 0 N--CA 1.451 -0.394 0 CA-C-N 118.378 0.535 . . . . 0.75 110.292 -178.555 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 2.9 mt-10 -52.8 -40.22 63.04 Favored 'General case' 0 CA--C 1.512 -0.484 0 CA-C-O 121.116 0.484 . . . . 3.1299999999999999 111.365 177.348 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 82' ' ' ARG . . . . . 0.425 ' HD2' ' O ' ' A' ' 76' ' ' SER . 15.3 mtp180 -64.77 -56.49 13.25 Favored 'General case' 0 N--CA 1.45 -0.468 0 C-N-CA 119.173 -1.011 . . . . 2.46 108.343 178.762 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . 0.418 HD13 ' HA ' ' A' ' 83' ' ' LEU . 0.9 OUTLIER -56.34 -23.77 39.48 Favored 'General case' 0 C--O 1.223 -0.291 0 N-CA-C 113.28 0.844 . . . . 0.56999999999999995 113.28 178.883 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild core ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 32.1 mttt -67.66 -45.3 75.68 Favored 'General case' 0 CA--C 1.517 -0.31 0 CA-C-N 120.242 1.383 . . . . 1.6499999999999999 108.777 173.64 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 85' ' ' VAL . . . . . 0.528 HG23 HD12 ' A' ' 73' ' ' LEU . 39.8 t -60.11 -53.48 48.0 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.614 0 CA-C-O 118.661 -0.685 . . . . 0.41999999999999998 110.671 170.95 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 60.1 mt-30 -60.6 -44.59 96.11 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 120.394 1.452 . . . . 4.3099999999999996 110.965 -171.125 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 22.4 tttt -59.87 -51.32 70.24 Favored 'General case' 0 N--CA 1.452 -0.362 0 C-N-CA 123.948 0.899 . . . . 2.2200000000000002 110.6 175.751 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 38.9 m-20 -78.41 -8.24 58.26 Favored 'General case' 0 C--N 1.331 -0.212 0 C-N-CA 122.944 0.498 . . . . 1.1499999999999999 111.474 -174.144 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 89' ' ' ALA . . . . . 0.462 ' HB2' HD21 ' A' ' 55' ' ' LEU . . . -159.37 69.61 3.29 Favored Pre-proline 0 N--CA 1.447 -0.598 0 C-N-CA 125.013 1.325 . . . . 0.42999999999999999 109.305 -173.144 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 36.2 Cg_endo -61.36 -25.76 80.61 Favored 'Trans proline' 0 N--CA 1.453 -0.907 0 C-N-CA 122.454 2.103 . . . . 1.74 110.759 -176.462 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 7.1 mttp -81.62 -52.96 6.64 Favored 'General case' 0 N--CA 1.449 -0.493 0 C-N-CA 123.211 0.604 . . . . 4.79 110.557 177.902 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 2.3 m -55.51 -39.9 71.1 Favored 'General case' 0 N--CA 1.467 0.385 0 CA-C-N 119.28 0.946 . . . . 0.59999999999999998 111.296 -175.67 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 3.2 t80 -48.96 -65.67 0.53 Allowed 'General case' 0 CA--C 1.503 -0.836 0 CA-C-O 121.423 0.63 . . . . 4.6399999999999997 112.562 175.261 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 44.7 tt0 -54.2 -31.98 54.44 Favored 'General case' 0 N--CA 1.44 -0.965 0 CA-C-N 113.926 -1.488 . . . . 1.51 109.727 -178.162 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 4.7 t80 -68.9 -58.53 4.01 Favored 'General case' 0 N--CA 1.451 -0.398 0 C-N-CA 122.87 0.468 . . . . 2.0299999999999998 110.442 -173.102 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 35.5 mm -48.27 -46.41 13.75 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.139 0 C-N-CA 123.9 0.88 . . . . 1.55 109.961 172.279 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 12.4 t-20 -64.82 -32.7 74.52 Favored 'General case' 0 CA--C 1.535 0.373 0 CA-C-N 117.853 0.297 . . . . 1.73 111.631 -176.153 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 12.5 t70 . . . . . 0 N--CA 1.464 0.236 0 CA-C-O 121.61 0.719 . . . . 2.0600000000000001 109.404 174.723 . . . . . . . . 0 0 . 1 . 029 nuclear nobuild core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 15.3 t80 . . . . . 0 CA--C 1.517 -0.29 0 N-CA-C 108.481 -0.933 . . . . 2.5099999999999998 108.481 . . . . . . . . . 0 0 . 1 . 029 nuclear nobuild core ' A' A ' 15' ' ' ILE . . . . . 0.432 HD12 ' CE1' ' A' ' 75' ' ' HIS . 0.6 OUTLIER -61.43 -34.5 61.57 Favored 'Isoleucine or valine' 0 CA--C 1.528 0.113 0 CA-C-O 118.864 -0.589 . . . . 0.52000000000000002 112.579 175.547 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild core ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 4.6 t60 -56.44 -55.09 37.92 Favored 'General case' 0 C--N 1.341 0.211 0 N-CA-C 106.916 -1.513 . . . . 0.52000000000000002 106.916 177.309 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 48.3 mt-10 -62.41 -32.11 72.9 Favored 'General case' 0 N--CA 1.452 -0.367 0 CA-C-O 118.709 -0.662 . . . . 2.6299999999999999 111.802 179.608 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 17.7 t80 -59.19 -50.21 74.9 Favored 'General case' 0 N--CA 1.452 -0.326 0 CA-C-N 118.999 0.818 . . . . 2.1699999999999999 109.618 177.34 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -51.87 -43.08 54.49 Favored Glycine 0 CA--C 1.529 0.909 0 N-CA-C 111.011 -0.836 . . . . 0.55000000000000004 111.011 173.889 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 20' ' ' HIS . . . . . 0.523 ' CE1' ' HB1' ' A' ' 64' ' ' ALA . 3.4 t60 -63.28 -53.04 59.04 Favored 'General case' 0 N--CA 1.453 -0.307 0 O-C-N 121.82 -0.812 . . . . 1.7 111.593 -177.738 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -63.65 -27.56 69.31 Favored 'General case' 0 N--CA 1.451 -0.388 0 C-N-CA 123.094 0.558 . . . . 1.02 110.172 -179.352 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 25.1 t -68.28 -42.39 84.44 Favored 'Isoleucine or valine' 0 C--O 1.235 0.307 0 O-C-N 121.342 -0.848 . . . . 1.25 109.646 177.049 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 2.8 t70 . . . . . 0 N--CA 1.451 -0.381 0 C-N-CA 120.204 -0.599 . . . . 2.7999999999999998 111.837 176.209 . . . . . . . . 0 0 . 1 . 029 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 50.8 t0 . . . . . 0 N--CA 1.465 0.322 0 CA-C-O 122.335 1.064 . . . . 2.1899999999999999 108.4 . . . . . . . . . 0 0 . 1 . 029 nuclear nobuild core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 2.0 mm -52.71 -51.6 34.34 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.29 0 C-N-CA 124.781 1.232 . . . . 0.56999999999999995 110.211 -179.203 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 37.5 t80 -57.71 -31.54 66.52 Favored 'General case' 0 N--CA 1.454 -0.254 0 N-CA-C 113.044 0.757 . . . . 0.40999999999999998 113.044 178.305 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . 0.447 ' HA ' ' HE2' ' A' ' 49' ' ' LYS . 1.0 OUTLIER -62.19 -44.8 95.79 Favored 'General case' 0 C--N 1.331 -0.216 0 O-C-N 120.967 -1.083 . . . . 1.0900000000000001 111.091 -178.255 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 17.8 tp10 -90.62 -61.61 1.64 Allowed 'General case' 0 CA--C 1.531 0.25 0 CA-C-O 122.442 1.115 . . . . 2.5800000000000001 109.625 -177.141 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . 0.479 ' OE2' ' HE3' ' A' ' 91' ' ' LYS . 28.3 mm-40 -71.41 -34.23 70.16 Favored 'General case' 0 C--N 1.329 -0.305 0 C-N-CA 123.773 0.829 . . . . 2.4300000000000002 109.889 -169.785 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . 0.427 ' HA2' ' CD1' ' A' ' 66' ' ' PHE . . . -69.84 38.8 0.4 Allowed Glycine 0 CA--C 1.528 0.889 0 C-N-CA 125.705 1.621 . . . . 0.40000000000000002 113.894 168.162 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 34.3 t -153.37 37.82 0.48 Allowed 'General case' 0 N--CA 1.446 -0.656 0 O-C-N 121.133 -1.216 . . . . 1.6799999999999999 108.191 159.371 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -141.18 -47.63 0.4 Allowed 'General case' 0 CA--C 1.518 -0.251 0 N-CA-C 112.384 0.513 . . . . 1.9099999999999999 112.384 -169.203 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . 0.44 HD22 HG22 ' A' ' 85' ' ' VAL . 37.7 mt -63.31 -36.76 84.77 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 120.808 0.337 . . . . 0.51000000000000001 110.911 -176.361 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER 177.09 166.5 0.55 Allowed 'General case' 0 CA--C 1.529 0.172 0 C-N-CA 124.673 1.189 . . . . 0.46000000000000002 108.289 -173.602 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 9.3 m -60.04 -35.07 74.31 Favored 'General case' 0 N--CA 1.454 -0.253 0 C-N-CA 123.212 0.605 . . . . 0.91000000000000003 110.608 168.73 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -67.59 -10.75 54.83 Favored 'General case' 0 CA--C 1.533 0.324 0 C-N-CA 123.126 0.57 . . . . 1.6799999999999999 111.716 175.359 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -93.05 -8.62 61.49 Favored Glycine 0 N--CA 1.445 -0.721 0 C-N-CA 124.887 1.232 . . . . 0.42999999999999999 110.982 174.895 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 37.0 ttt180 -108.88 -11.58 14.99 Favored 'General case' 0 CA--C 1.528 0.118 0 CA-C-N 118.598 1.199 . . . . 2.6800000000000002 111.88 177.725 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 31.9 p -65.33 -156.1 0.01 OUTLIER 'General case' 0 CA--C 1.541 0.611 0 N-CA-C 109.361 -0.607 . . . . 0.87 109.361 170.098 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 1.3 m-20 -52.82 145.84 11.7 Favored 'General case' 0 CA--C 1.53 0.188 0 O-C-N 120.119 -1.613 . . . . 1.72 110.312 -178.01 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 31.4 tt0 -60.97 -27.91 68.61 Favored 'General case' 0 CA--C 1.537 0.461 0 CA-C-O 122.118 0.961 . . . . 3.1699999999999999 111.083 -177.595 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 64' ' ' ALA . . . . . 0.523 ' HB1' ' CE1' ' A' ' 20' ' ' HIS . . . -58.62 -41.45 85.93 Favored 'General case' 0 N--CA 1.452 -0.351 0 C-N-CA 124.848 1.259 . . . . 0.51000000000000001 112.447 170.626 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 6.0 mt-10 -71.73 -42.03 67.8 Favored 'General case' 0 C--O 1.219 -0.534 0 CA-C-O 118.163 -0.922 . . . . 1.79 110.323 176.405 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 66' ' ' PHE . . . . . 0.427 ' CD1' ' HA2' ' A' ' 52' ' ' GLY . 52.7 t80 -50.33 -52.92 32.65 Favored 'General case' 0 N--CA 1.456 -0.143 0 C-N-CA 123.377 0.671 . . . . 0.38 111.077 175.488 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 52.2 t80 -59.64 -42.98 93.98 Favored 'General case' 0 CA--C 1.539 0.555 0 O-C-N 121.712 -0.617 . . . . 0.56999999999999995 110.53 177.003 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -64.1 -54.28 36.48 Favored 'General case' 0 CA--C 1.538 0.505 0 O-C-N 121.278 -0.889 . . . . 0.37 113.054 -175.124 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 1.4 pp20? -61.56 -37.48 83.98 Favored 'General case' 0 C--N 1.332 -0.195 0 O-C-N 120.97 -1.081 . . . . 3.8999999999999999 110.174 175.523 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -58.73 -36.27 74.03 Favored 'General case' 0 N--CA 1.451 -0.409 0 CA-C-N 118.377 0.535 . . . . 0.5 110.938 173.761 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 41.6 t80 -63.68 -51.04 66.84 Favored 'General case' 0 CA--C 1.531 0.221 0 CA-C-N 119.758 1.163 . . . . 3.23 111.359 171.627 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 6.2 ttp180 -45.15 -54.14 7.22 Favored 'General case' 0 N--CA 1.468 0.426 0 C-N-CA 123.244 0.618 . . . . 2.3100000000000001 109.463 177.311 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -67.25 -55.26 14.72 Favored 'General case' 0 C--N 1.329 -0.325 0 C-N-CA 126.615 1.966 . . . . 0.76000000000000001 110.793 -174.24 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -56.82 -31.73 65.03 Favored 'General case' 0 N--CA 1.464 0.268 0 CA-C-N 119.576 1.08 . . . . 2.7799999999999998 111.416 -177.622 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 75' ' ' HIS . . . . . 0.432 ' CE1' HD12 ' A' ' 15' ' ' ILE . 0.0 OUTLIER -90.72 -19.92 23.02 Favored 'General case' 0 N--CA 1.454 -0.233 0 CA-C-O 117.342 -1.313 . . . . 0.90000000000000002 111.748 179.284 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 3.1 m -47.01 115.94 1.22 Allowed 'General case' 0 CA--C 1.507 -0.705 0 CA-C-N 119.953 1.251 . . . . 1.5600000000000001 108.031 -174.815 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -46.12 -39.45 9.49 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 114.793 -1.094 . . . . 1.9099999999999999 110.306 -179.533 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 18.0 t0 -57.3 104.78 0.18 Allowed 'General case' 0 N--CA 1.452 -0.337 0 CA-C-O 122.7 1.238 . . . . 2.04 111.556 168.562 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 1.9 p80 -46.73 -38.25 9.66 Favored 'General case' 0 N--CA 1.45 -0.428 0 CA-C-N 114.664 -1.153 . . . . 5.2599999999999998 112.612 171.539 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -61.2 -58.76 6.98 Favored 'General case' 0 N--CA 1.45 -0.454 0 CA-C-N 119.276 0.944 . . . . 1.1200000000000001 109.245 -176.346 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -48.27 -39.9 23.06 Favored 'General case' 0 N--CA 1.453 -0.275 0 C-N-CA 123.595 0.758 . . . . 3.6800000000000002 112.101 179.125 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 12.8 mtt180 -64.23 -53.93 41.49 Favored 'General case' 0 C--N 1.328 -0.362 0 C-N-CA 120.441 -0.504 . . . . 3.2000000000000002 110.904 178.6 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . 0.413 HD13 ' HA ' ' A' ' 83' ' ' LEU . 1.1 mm? -62.06 -23.26 66.37 Favored 'General case' 0 N--CA 1.449 -0.486 0 CA-C-O 117.883 -1.056 . . . . 0.67000000000000004 111.57 177.654 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 1.7 mptm? -64.57 -42.46 95.62 Favored 'General case' 0 C--O 1.224 -0.281 0 CA-C-N 120.857 1.662 . . . . 1.6399999999999999 108.283 171.867 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 85' ' ' VAL . . . . . 0.44 HG22 HD22 ' A' ' 55' ' ' LEU . 69.6 t -61.99 -63.45 0.81 Allowed 'Isoleucine or valine' 0 C--O 1.218 -0.557 0 CA-C-O 118.13 -0.938 . . . . 0.40000000000000002 110.107 172.928 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -48.96 -47.47 43.89 Favored 'General case' 0 CA--C 1.536 0.412 0 CA-C-N 120.328 1.422 . . . . 1.95 111.704 -173.619 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 32.7 tttm -63.0 -50.53 70.39 Favored 'General case' 0 N--CA 1.452 -0.353 0 C-N-CA 124.449 1.1 . . . . 2.1299999999999999 111.784 179.102 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 25.3 m-20 -86.78 5.16 37.86 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 119.038 -0.506 . . . . 1.0700000000000001 110.997 -175.006 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 89' ' ' ALA . . . . . 0.422 ' HB2' HD21 ' A' ' 55' ' ' LEU . . . -162.28 69.36 2.16 Favored Pre-proline 0 N--CA 1.447 -0.575 0 C-N-CA 125.54 1.536 . . . . 0.37 109.277 -176.112 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 90.3 Cg_endo -79.45 59.86 7.57 Favored 'Trans proline' 0 N--CA 1.458 -0.566 0 C-N-CA 124.214 3.276 . . . . 1.96 110.801 -173.659 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 91' ' ' LYS . . . . . 0.479 ' HE3' ' OE2' ' A' ' 51' ' ' GLU . 0.0 OUTLIER 175.89 -48.4 0.01 OUTLIER 'General case' 0 CA--C 1.531 0.232 0 C-N-CA 127.046 2.139 . . . . 2.3500000000000001 109.713 -172.574 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild core ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 8.6 m -57.74 -43.55 85.46 Favored 'General case' 0 CA--C 1.516 -0.333 0 O-C-N 121.101 -0.999 . . . . 0.46000000000000002 111.445 179.991 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 3.7 t80 -54.28 -48.43 71.24 Favored 'General case' 0 CA--C 1.515 -0.402 0 C-N-CA 120.114 -0.635 . . . . 2.23 110.021 176.251 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 30.0 tt0 -60.82 -29.72 69.65 Favored 'General case' 0 N--CA 1.441 -0.888 0 CA-C-N 115.025 -0.989 . . . . 1.5600000000000001 111.118 -179.799 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -63.41 -61.97 1.99 Allowed 'General case' 0 N--CA 1.463 0.205 0 C-N-CA 124.427 1.091 . . . . 1.6200000000000001 108.919 -177.223 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 3.8 mp -53.35 -45.06 56.17 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.323 0 N-CA-C 108.48 -0.933 . . . . 0.98999999999999999 108.48 177.246 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -57.69 -35.35 70.48 Favored 'General case' 0 C--O 1.225 -0.197 0 N-CA-C 112.352 0.501 . . . . 1.8700000000000001 112.352 -179.655 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--N 1.334 -0.1 0 C-N-CA 124.845 1.258 . . . . 2.3500000000000001 109.203 178.636 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 11.2 t80 . . . . . 0 CA--C 1.519 -0.236 0 CA-C-O 120.654 0.264 . . . . 2.6699999999999999 110.677 . . . . . . . . . 0 0 . 1 . 030 nuclear nobuild core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 0.6 OUTLIER -69.46 -32.85 54.63 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.328 0 CA-C-O 118.809 -0.615 . . . . 0.44 112.571 178.894 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 9.3 t60 -59.94 -58.51 8.23 Favored 'General case' 0 CA--C 1.53 0.21 0 N-CA-C 107.227 -1.397 . . . . 0.64000000000000001 107.227 175.775 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 1.5 mp0 -51.37 -44.55 62.16 Favored 'General case' 0 C--O 1.226 -0.135 0 C-N-CA 124.154 0.982 . . . . 4.04 110.634 176.697 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 18' ' ' PHE . . . . . 0.453 ' O ' HG23 ' A' ' 22' ' ' VAL . 0.2 OUTLIER -54.2 -52.17 62.09 Favored 'General case' 0 CA--C 1.517 -0.322 0 C-N-CA 123.582 0.753 . . . . 2.6099999999999999 109.505 179.884 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -45.97 -49.05 13.88 Favored Glycine 0 CA--C 1.524 0.646 0 N-CA-C 110.808 -0.917 . . . . 0.47999999999999998 110.808 174.435 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 20' ' ' HIS . . . . . 0.494 ' CE1' ' HB1' ' A' ' 64' ' ' ALA . 2.1 t-160 -59.16 -47.06 86.68 Favored 'General case' 0 N--CA 1.452 -0.346 0 O-C-N 122.015 -0.697 . . . . 1.8300000000000001 111.393 179.209 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -61.03 -32.66 72.27 Favored 'General case' 0 N--CA 1.453 -0.294 0 O-C-N 121.635 -0.666 . . . . 0.81999999999999995 110.47 178.438 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . 0.453 HG23 ' O ' ' A' ' 18' ' ' PHE . 40.4 t -67.63 -35.28 72.39 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.267 0 O-C-N 121.235 -0.915 . . . . 0.93000000000000005 110.393 178.271 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 8.0 t0 . . . . . 0 N--CA 1.451 -0.391 0 CA-C-O 121.506 0.669 . . . . 1.8999999999999999 110.983 176.611 . . . . . . . . 0 0 . 1 . 030 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 16.2 t70 . . . . . 0 N--CA 1.468 0.456 0 N-CA-C 109.112 -0.699 . . . . 2.2000000000000002 109.112 . . . . . . . . . 0 0 . 1 . 030 nuclear nobuild core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 2.8 mm -54.69 -49.46 67.86 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.449 0 C-N-CA 125.338 1.455 . . . . 0.52000000000000002 108.548 178.304 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 38.4 t80 -59.85 -26.35 65.76 Favored 'General case' 0 N--CA 1.453 -0.319 0 O-C-N 120.596 -1.315 . . . . 0.81999999999999995 113.462 177.683 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . 0.628 ' HA ' ' HE2' ' A' ' 49' ' ' LYS . 9.0 mmpt? -70.04 -48.0 59.72 Favored 'General case' 0 CA--C 1.516 -0.339 0 O-C-N 120.095 -1.628 . . . . 1.51 110.859 -179.482 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 4.4 tp10 -87.51 -56.64 3.27 Favored 'General case' 0 CA--C 1.533 0.314 0 N-CA-C 109.039 -0.726 . . . . 2.1099999999999999 109.039 -173.622 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . 0.465 ' OE1' ' HE3' ' A' ' 91' ' ' LYS . 19.0 mp0 -76.81 -31.87 57.25 Favored 'General case' 0 C--O 1.235 0.321 0 O-C-N 121.024 -1.048 . . . . 2.7999999999999998 111.452 -175.952 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . 0.42 ' HA2' ' CD1' ' A' ' 66' ' ' PHE . . . -70.04 38.76 0.42 Allowed Glycine 0 CA--C 1.532 1.124 0 C-N-CA 124.997 1.284 . . . . 0.39000000000000001 114.343 171.595 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 39.2 t -154.21 49.37 0.63 Allowed 'General case' 0 N--CA 1.448 -0.537 0 N-CA-C 107.234 -1.395 . . . . 1.96 107.234 153.692 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -145.34 -49.7 0.24 Allowed 'General case' 0 CA--C 1.516 -0.339 0 N-CA-C 112.644 0.609 . . . . 2.0600000000000001 112.644 -177.306 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . 0.537 HD21 ' HB2' ' A' ' 89' ' ' ALA . 17.5 mt -60.46 -35.54 76.12 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-O 120.891 0.377 . . . . 0.34999999999999998 111.047 -172.962 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER 178.28 169.58 0.78 Allowed 'General case' 0 CA--C 1.53 0.209 0 C-N-CA 125.752 1.621 . . . . 0.45000000000000001 107.487 -179.307 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 26.4 m -59.16 -33.36 70.82 Favored 'General case' 0 N--CA 1.454 -0.233 0 O-C-N 121.673 -0.642 . . . . 1.04 110.633 169.93 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -59.58 -34.19 72.4 Favored 'General case' 0 C--N 1.34 0.189 0 CA-C-N 118.31 0.505 . . . . 1.3500000000000001 109.992 173.114 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -67.95 -9.91 57.67 Favored Glycine 0 C--O 1.22 -0.741 0 CA-C-O 119.074 -0.848 . . . . 0.41999999999999998 111.836 178.184 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 41.3 ttt180 -107.77 -8.92 15.9 Favored 'General case' 0 N--CA 1.454 -0.237 0 CA-C-N 119.082 1.441 . . . . 3.5 112.582 178.084 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 68.7 p -69.45 -126.34 0.0 OUTLIER 'General case' 0 CA--C 1.537 0.461 0 CA-C-N 118.404 0.547 . . . . 1.0800000000000001 111.196 179.456 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 4.2 t-20 -75.13 148.65 39.49 Favored 'General case' 0 N--CA 1.45 -0.43 0 O-C-N 120.081 -1.637 . . . . 1.8300000000000001 107.497 176.156 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 30.7 tt0 -60.61 -31.98 71.12 Favored 'General case' 0 CA--C 1.538 0.5 0 CA-C-O 121.828 0.823 . . . . 3.2599999999999998 110.37 179.425 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 64' ' ' ALA . . . . . 0.494 ' HB1' ' CE1' ' A' ' 20' ' ' HIS . . . -61.36 -34.45 75.32 Favored 'General case' 0 CA--C 1.53 0.192 0 O-C-N 121.172 -0.955 . . . . 0.55000000000000004 113.105 173.542 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 4.6 mt-10 -77.55 -39.27 46.48 Favored 'General case' 0 C--O 1.222 -0.378 0 O-C-N 121.016 -1.053 . . . . 2.0699999999999998 110.137 179.246 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 66' ' ' PHE . . . . . 0.42 ' CD1' ' HA2' ' A' ' 52' ' ' GLY . 43.7 t80 -50.34 -45.66 55.16 Favored 'General case' 0 CA--C 1.532 0.253 0 C-N-CA 124.775 1.23 . . . . 0.40999999999999998 110.959 170.434 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 72.1 t80 -65.86 -43.96 86.85 Favored 'General case' 0 CA--C 1.533 0.309 0 O-C-N 120.994 -1.067 . . . . 0.47999999999999998 111.758 175.311 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -62.96 -53.98 45.63 Favored 'General case' 0 CA--C 1.537 0.449 0 O-C-N 121.381 -0.824 . . . . 0.40999999999999998 112.002 -174.369 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -55.94 -40.97 73.94 Favored 'General case' 0 C--N 1.332 -0.182 0 O-C-N 120.92 -1.112 . . . . 3.8900000000000001 111.299 169.868 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -55.99 -40.17 72.93 Favored 'General case' 0 C--O 1.223 -0.297 0 CA-C-N 119.122 0.874 . . . . 0.40000000000000002 110.844 177.471 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 56.9 t80 -58.06 -49.93 75.19 Favored 'General case' 0 C--O 1.233 0.224 0 CA-C-N 119.683 1.129 . . . . 3.3199999999999998 111.504 174.316 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 48.3 ttt180 -49.56 -53.8 21.66 Favored 'General case' 0 N--CA 1.467 0.377 0 N-CA-C 109.322 -0.621 . . . . 2.0800000000000001 109.322 177.605 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 73' ' ' LEU . . . . . 0.553 ' CB ' HG21 ' A' ' 85' ' ' VAL . 0.1 OUTLIER -65.38 -34.24 77.84 Favored 'General case' 0 C--N 1.327 -0.392 0 C-N-CA 124.187 0.995 . . . . 0.42999999999999999 110.289 -175.851 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild core ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER -60.04 -42.37 94.3 Favored 'General case' 0 C--N 1.333 -0.139 0 C-N-CA 123.77 0.828 . . . . 2.3599999999999999 110.939 -176.341 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 9.3 p80 -95.13 -4.99 45.14 Favored 'General case' 0 N--CA 1.457 -0.113 0 CA-C-O 116.964 -1.493 . . . . 0.85999999999999999 113.365 -178.306 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 12.4 m -40.92 126.29 2.48 Favored 'General case' 0 N--CA 1.452 -0.34 0 CA-C-O 123.222 1.487 . . . . 1.04 110.806 -168.349 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 1.1 p -52.82 -42.19 64.89 Favored 'General case' 0 N--CA 1.447 -0.584 0 CA-C-N 112.642 -2.072 . . . . 0.94999999999999996 108.8 179.481 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 62.3 t0 -72.55 111.68 7.94 Favored 'General case' 0 N--CA 1.451 -0.414 0 CA-C-O 122.089 0.947 . . . . 2.0699999999999998 108.673 168.885 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 4.2 t-160 -54.3 -33.05 57.91 Favored 'General case' 0 CA--C 1.532 0.268 0 CA-C-N 115.738 -0.665 . . . . 5.6200000000000001 109.802 176.899 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -56.87 -52.19 66.1 Favored 'General case' 0 N--CA 1.451 -0.4 0 CA-C-N 117.904 0.32 . . . . 0.65000000000000002 110.708 176.672 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 5.2 mt-10 -52.12 -39.57 60.06 Favored 'General case' 0 CA--C 1.514 -0.428 0 C-N-CA 123.365 0.666 . . . . 2.8599999999999999 110.966 -177.59 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 2.4 mtp180 -61.92 -53.54 54.36 Favored 'General case' 0 N--CA 1.448 -0.546 0 C-N-CA 119.971 -0.692 . . . . 2.7000000000000002 109.738 176.864 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 1.3 mm? -61.01 -24.53 66.23 Favored 'General case' 0 N--CA 1.453 -0.294 0 CA-C-O 117.421 -1.276 . . . . 0.53000000000000003 112.936 177.655 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 2.0 mptm? -63.73 -43.11 97.5 Favored 'General case' 0 CA--C 1.522 -0.131 0 CA-C-N 121.499 1.954 . . . . 1.1699999999999999 107.981 173.882 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 85' ' ' VAL . . . . . 0.553 HG21 ' CB ' ' A' ' 73' ' ' LEU . 99.7 t -64.13 -63.3 0.89 Allowed 'Isoleucine or valine' 0 C--O 1.214 -0.808 0 CA-C-O 118.437 -0.792 . . . . 0.45000000000000001 110.009 173.233 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -49.44 -38.57 29.88 Favored 'General case' 0 CA--C 1.532 0.256 0 CA-C-N 120.325 1.42 . . . . 2.0499999999999998 112.277 -172.492 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 22.7 tttt -64.52 -58.98 4.88 Favored 'General case' 0 N--CA 1.45 -0.439 0 C-N-CA 124.81 1.244 . . . . 2.02 110.833 174.025 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 61.6 m-20 -80.48 2.37 25.54 Favored 'General case' 0 CA--C 1.535 0.373 0 C-N-CA 123.505 0.722 . . . . 1.1100000000000001 111.815 -173.733 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 89' ' ' ALA . . . . . 0.537 ' HB2' HD21 ' A' ' 55' ' ' LEU . . . -156.66 73.63 4.74 Favored Pre-proline 0 N--CA 1.446 -0.639 0 C-N-CA 126.802 2.041 . . . . 0.5 108.012 -175.387 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 62.1 Cg_endo -80.69 60.81 8.01 Favored 'Trans proline' 0 N--CA 1.454 -0.824 0 C-N-CA 124.057 3.171 . . . . 1.96 109.351 -179.837 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 91' ' ' LYS . . . . . 0.465 ' HE3' ' OE1' ' A' ' 51' ' ' GLU . 0.0 OUTLIER 171.28 -56.81 0.01 OUTLIER 'General case' 0 C--O 1.224 -0.269 0 C-N-CA 126.411 1.884 . . . . 2.3599999999999999 110.466 -170.345 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild core ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 1.4 m -53.69 -46.01 70.56 Favored 'General case' 0 N--CA 1.466 0.373 0 CA-C-N 119.95 1.25 . . . . 0.42999999999999999 110.75 -179.534 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 8.6 t80 -61.21 -46.34 90.87 Favored 'General case' 0 CA--C 1.509 -0.599 0 CA-C-O 121.653 0.74 . . . . 2.46 110.187 178.852 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 8.1 tt0 -58.53 -30.95 67.48 Favored 'General case' 0 N--CA 1.441 -0.902 0 CA-C-N 114.482 -1.236 . . . . 1.8100000000000001 110.126 -178.538 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -63.99 -68.74 0.32 Allowed 'General case' 0 N--CA 1.452 -0.349 0 C-N-CA 124.634 1.174 . . . . 1.02 108.753 -177.666 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 96' ' ' ILE . . . . . 0.447 HD12 ' H ' ' A' ' 96' ' ' ILE . 3.8 mp -49.86 -43.38 19.59 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.217 0 C-N-CA 123.457 0.703 . . . . 0.85999999999999999 109.743 176.653 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 13.0 t30 -61.03 -35.42 76.83 Favored 'General case' 0 CA--C 1.531 0.241 0 O-C-N 121.961 -0.462 . . . . 1.3700000000000001 111.94 -177.418 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 23.1 t70 . . . . . 0 CA--C 1.516 -0.362 0 C-N-CA 123.499 0.719 . . . . 2.1200000000000001 109.624 173.777 . . . . . . . . 0 0 . 1 . 031 nuclear nobuild core ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 49.7 t80 . . . . . 0 N--CA 1.463 0.204 0 CA-C-O 121.38 0.61 . . . . 4.1200000000000001 110.685 . . . . . . . . . 0 0 . 1 . 031 nuclear nobuild core ' A' A ' 15' ' ' ILE . . . . . 0.412 HD12 ' CE1' ' A' ' 75' ' ' HIS . 1.2 pt -63.05 -33.18 59.27 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.449 0 O-C-N 121.151 -0.968 . . . . 0.60999999999999999 112.093 -178.488 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 2.6 t-160 -58.49 -49.27 77.98 Favored 'General case' 0 CA--C 1.532 0.268 0 N-CA-C 107.69 -1.226 . . . . 0.83999999999999997 107.69 174.903 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 40.1 mt-10 -61.01 -36.56 79.82 Favored 'General case' 0 C--O 1.218 -0.554 0 C-N-CA 124.168 0.987 . . . . 2.73 109.752 -178.195 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 4.1 t80 -55.04 -50.23 69.61 Favored 'General case' 0 CA--C 1.522 -0.099 0 CA-C-N 119.354 0.979 . . . . 3.7799999999999998 110.284 171.827 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -48.35 -50.23 23.98 Favored Glycine 0 CA--C 1.524 0.615 0 N-CA-C 111.454 -0.658 . . . . 0.57999999999999996 111.454 172.768 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 20' ' ' HIS . . . . . 0.658 ' CE1' ' HB1' ' A' ' 64' ' ' ALA . 2.0 t-160 -63.89 -44.93 91.51 Favored 'General case' 0 N--CA 1.45 -0.443 0 O-C-N 121.846 -0.796 . . . . 1.97 111.408 -177.533 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -55.86 -34.1 65.14 Favored 'General case' 0 N--CA 1.448 -0.536 0 C-N-CA 123.575 0.75 . . . . 0.95999999999999996 109.125 -178.318 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 98.5 t -68.37 -42.37 84.13 Favored 'Isoleucine or valine' 0 N--CA 1.457 -0.101 0 C-N-CA 119.782 -0.767 . . . . 1.05 111.986 174.474 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 3.7 t70 . . . . . 0 N--CA 1.465 0.312 0 CA-C-O 122.284 1.04 . . . . 2.3399999999999999 111.428 173.262 . . . . . . . . 0 0 . 1 . 031 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 45.9 t0 . . . . . 0 N--CA 1.461 0.097 0 N-CA-C 108.817 -0.809 . . . . 2.48 108.817 . . . . . . . . . 0 0 . 1 . 031 nuclear nobuild core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 7.1 mm -50.2 -54.44 8.44 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.523 0 C-N-CA 125.32 1.448 . . . . 0.44 109.202 174.387 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 30.4 t80 -61.83 -26.5 68.16 Favored 'General case' 0 CA--C 1.531 0.245 0 O-C-N 120.927 -1.108 . . . . 0.38 113.232 179.578 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 49' ' ' LYS . . . . . 0.573 ' HA ' ' HE2' ' A' ' 49' ' ' LYS . 9.6 mmpt? -72.24 -45.01 62.01 Favored 'General case' 0 CA--C 1.516 -0.347 0 O-C-N 119.675 -1.891 . . . . 1.21 111.684 -175.513 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -86.72 -64.68 1.11 Allowed 'General case' 0 C--N 1.328 -0.349 0 N-CA-C 106.774 -1.565 . . . . 3.71 106.774 -177.701 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 15.0 mm-40 -65.09 -36.05 83.09 Favored 'General case' 0 N--CA 1.452 -0.367 0 CA-C-N 115.677 -0.692 . . . . 2.1600000000000001 110.165 -170.925 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . 0.452 ' HA2' ' CD1' ' A' ' 66' ' ' PHE . . . -69.07 37.6 0.3 Allowed Glycine 0 CA--C 1.527 0.82 0 C-N-CA 125.582 1.563 . . . . 0.28999999999999998 114.44 171.761 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 11.2 t -147.71 23.4 1.11 Allowed 'General case' 0 N--CA 1.451 -0.401 0 O-C-N 121.047 -1.267 . . . . 1.8200000000000001 110.47 155.592 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 13.7 t30 -134.11 -23.13 1.75 Allowed 'General case' 0 C--N 1.342 0.28 0 N-CA-C 113.958 1.096 . . . . 1.78 113.958 -164.1 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . 0.563 HD22 HG22 ' A' ' 85' ' ' VAL . 14.6 mt -76.91 -37.02 56.21 Favored 'General case' 0 C--O 1.226 -0.144 0 O-C-N 121.891 -0.505 . . . . 0.45000000000000001 110.571 176.124 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER 178.2 169.91 0.76 Allowed 'General case' 0 CA--C 1.532 0.273 0 C-N-CA 125.795 1.638 . . . . 0.60999999999999999 107.096 -175.796 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 7.2 m -60.11 -33.88 72.72 Favored 'General case' 0 N--CA 1.454 -0.266 0 O-C-N 121.708 -0.62 . . . . 1.2 110.721 168.596 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -67.77 -9.11 41.27 Favored 'General case' 0 N--CA 1.467 0.41 0 N-CA-C 112.328 0.492 . . . . 1.47 112.328 174.498 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -87.83 -3.91 79.67 Favored Glycine 0 C--O 1.221 -0.683 0 CA-C-O 118.472 -1.182 . . . . 0.44 111.09 173.366 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 3.6 ttp85 -118.0 -7.97 10.8 Favored 'General case' 0 CA--C 1.53 0.183 0 CA-C-N 119.292 1.546 . . . . 3.5299999999999998 112.253 -177.155 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 25.4 p -67.39 -148.13 0.01 OUTLIER 'General case' 0 CA--C 1.537 0.477 0 C-N-CA 124.958 1.303 . . . . 0.89000000000000001 109.079 172.165 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 3.7 m120 -56.7 143.77 35.12 Favored 'General case' 0 N--CA 1.455 -0.176 0 O-C-N 119.753 -1.842 . . . . 2.5299999999999998 109.176 176.049 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 15.6 tm-20 -57.04 -32.86 66.62 Favored 'General case' 0 C--O 1.223 -0.338 0 CA-C-O 121.538 0.685 . . . . 3.5800000000000001 110.078 178.086 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 64' ' ' ALA . . . . . 0.658 ' HB1' ' CE1' ' A' ' 20' ' ' HIS . . . -56.62 -35.37 68.22 Favored 'General case' 0 N--CA 1.45 -0.466 0 O-C-N 121.357 -0.839 . . . . 0.63 112.676 176.332 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 8.9 mt-10 -75.62 -42.18 52.38 Favored 'General case' 0 CA--C 1.512 -0.485 0 O-C-N 121.4 -0.812 . . . . 2.0899999999999999 110.834 175.184 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 66' ' ' PHE . . . . . 0.452 ' CD1' ' HA2' ' A' ' 52' ' ' GLY . 37.4 t80 -49.47 -56.49 9.57 Favored 'General case' 0 N--CA 1.454 -0.275 0 C-N-CA 123.782 0.833 . . . . 0.35999999999999999 110.818 175.104 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 90.5 t80 -62.14 -48.37 80.43 Favored 'General case' 0 N--CA 1.451 -0.424 0 C-N-CA 123.19 0.596 . . . . 0.46000000000000002 110.686 179.697 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -59.02 -39.4 81.81 Favored 'General case' 0 CA--C 1.544 0.737 0 O-C-N 121.112 -0.992 . . . . 0.29999999999999999 112.54 -178.113 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 37.4 mm-40 -64.37 -42.21 96.31 Favored 'General case' 0 CA--C 1.518 -0.288 0 C-N-CA 124.563 1.145 . . . . 4.5800000000000001 109.901 172.314 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -53.69 -43.05 68.6 Favored 'General case' 0 N--CA 1.449 -0.477 0 CA-C-O 118.282 -0.866 . . . . 0.41999999999999998 109.694 178.485 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 10.8 t80 -59.15 -49.48 77.7 Favored 'General case' 0 N--CA 1.463 0.211 0 CA-C-N 119.437 1.017 . . . . 2.2000000000000002 111.898 173.13 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -50.27 -55.95 13.26 Favored 'General case' 0 CA--C 1.531 0.223 0 O-C-N 121.588 -0.695 . . . . 2.4700000000000002 110.408 179.301 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' A' A ' 73' ' ' LEU . . . . . 0.722 HD12 HG23 ' A' ' 85' ' ' VAL . 0.2 OUTLIER -63.66 -30.56 71.65 Favored 'General case' 0 C--N 1.325 -0.495 0 C-N-CA 125.819 1.648 . . . . 0.41999999999999998 110.846 -179.756 . . . . . . . . 3 3 . 1 . 031 nuclear nobuild core ' A' A ' 74' ' ' MET . . . . . 0.452 ' HA ' ' CE2' ' A' ' 93' ' ' PHE . 1.1 tmt? -61.97 -39.92 93.82 Favored 'General case' 0 N--CA 1.451 -0.378 0 C-N-CA 123.281 0.632 . . . . 2.5800000000000001 111.976 -177.364 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' A' A ' 75' ' ' HIS . . . . . 0.412 ' CE1' HD12 ' A' ' 15' ' ' ILE . 27.6 p80 -90.06 -45.97 8.8 Favored 'General case' 0 C--O 1.225 -0.225 0 CA-C-O 116.758 -1.592 . . . . 1.1100000000000001 110.064 179.992 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 14.8 m 5.4 111.1 0.0 OUTLIER 'General case' 0 N--CA 1.469 0.492 0 C-N-CA 129.09 2.956 . . . . 1.0600000000000001 114.719 -174.514 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 3.1 p -46.47 -44.58 17.63 Favored 'General case' 0 C--O 1.235 0.325 0 C-N-CA 125.38 1.472 . . . . 1.0700000000000001 110.837 179.417 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 11.3 t0 -66.17 104.31 1.15 Allowed 'General case' 0 N--CA 1.449 -0.482 0 N-CA-C 108.673 -0.862 . . . . 2.1800000000000002 108.673 167.279 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 41.4 m80 -55.86 -30.96 62.32 Favored 'General case' 0 N--CA 1.454 -0.26 0 CA-C-O 118.994 -0.527 . . . . 5.4199999999999999 111.084 176.747 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -58.13 -50.95 71.69 Favored 'General case' 0 N--CA 1.446 -0.668 0 CA-C-O 117.937 -1.03 . . . . 0.59999999999999998 109.767 176.708 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 1.9 mt-10 -46.89 -41.2 15.47 Favored 'General case' 0 N--CA 1.464 0.236 0 CA-C-N 119.583 1.083 . . . . 3.1000000000000001 111.083 179.128 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -62.94 -51.66 66.06 Favored 'General case' 0 C--N 1.327 -0.383 0 N-CA-C 109.359 -0.608 . . . . 3.0099999999999998 109.359 179.149 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 1.7 mm? -66.56 -18.97 65.66 Favored 'General case' 0 N--CA 1.453 -0.301 0 CA-C-O 118.11 -0.948 . . . . 0.46999999999999997 113.261 176.922 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 2.0 mptm? -65.56 -48.51 72.14 Favored 'General case' 0 CA--C 1.518 -0.279 0 CA-C-N 120.629 1.559 . . . . 1.26 106.805 169.346 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 85' ' ' VAL . . . . . 0.722 HG23 HD12 ' A' ' 73' ' ' LEU . 45.6 t -63.9 -46.57 93.8 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.663 0 CA-C-O 117.482 -1.247 . . . . 0.45000000000000001 111.809 177.955 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 30.3 mt-30 -60.9 -52.23 65.91 Favored 'General case' 0 N--CA 1.462 0.126 0 CA-C-N 122.114 2.233 . . . . 2.1400000000000001 111.261 179.61 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -65.13 -40.46 94.5 Favored 'General case' 0 CA--C 1.532 0.254 0 O-C-N 121.654 -0.653 . . . . 2.3900000000000001 110.463 -172.717 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 6.9 m-20 -75.32 -21.75 58.18 Favored 'General case' 0 C--O 1.226 -0.172 0 CA-C-O 118.772 -0.632 . . . . 0.90000000000000002 110.771 177.948 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 89' ' ' ALA . . . . . 0.442 ' HB2' HD21 ' A' ' 55' ' ' LEU . . . -143.54 77.29 15.41 Favored Pre-proline 0 C--O 1.237 0.444 0 C-N-CA 124.15 0.98 . . . . 0.33000000000000002 110.217 -173.238 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 94.2 Cg_endo -79.75 66.67 8.77 Favored 'Trans proline' 0 N--CA 1.453 -0.856 0 C-N-CA 124.024 3.15 . . . . 1.9399999999999999 109.8 -173.27 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER 168.34 -53.07 0.01 OUTLIER 'General case' 0 C--O 1.224 -0.273 0 C-N-CA 126.923 2.089 . . . . 2.2200000000000002 111.234 -171.718 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 4.3 m -55.38 -47.02 76.47 Favored 'General case' 0 N--CA 1.466 0.338 0 CA-C-N 120.19 1.359 . . . . 0.46000000000000002 110.567 -177.525 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 93' ' ' PHE . . . . . 0.452 ' CE2' ' HA ' ' A' ' 74' ' ' MET . 8.2 t80 -59.92 -48.11 83.03 Favored 'General case' 0 CA--C 1.511 -0.528 0 CA-C-O 121.552 0.691 . . . . 1.8700000000000001 110.163 178.278 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 8.3 tt0 -56.76 -31.31 64.47 Favored 'General case' 0 N--CA 1.441 -0.875 0 CA-C-N 114.602 -1.181 . . . . 1.9099999999999999 110.163 -178.019 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 7.1 t80 -64.86 -56.25 14.54 Favored 'General case' 0 N--CA 1.453 -0.319 0 C-N-CA 124.02 0.928 . . . . 1.1200000000000001 109.798 -176.362 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 2.9 mp -57.93 -44.62 87.04 Favored 'Isoleucine or valine' 0 N--CA 1.457 -0.119 0 N-CA-C 108.44 -0.948 . . . . 0.84999999999999998 108.44 177.321 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 24.3 t30 -60.61 -31.8 70.95 Favored 'General case' 0 CA--C 1.532 0.273 0 C-N-CA 122.285 0.234 . . . . 1.45 111.544 -177.427 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 CA--C 1.521 -0.145 0 C-N-CA 124.552 1.141 . . . . 2.6400000000000001 109.17 176.086 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.474 1.229 0 N-CA-C 110.194 -1.163 . . . . 10.82 110.194 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . 0.451 ' O ' ' HE2' ' A' ' 3' ' ' LYS . 59.9 m 69.15 68.42 0.27 Allowed 'General case' 0 N--CA 1.453 -0.298 0 N-CA-C 115.652 1.723 . . . . 11.24 115.652 139.595 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . 0.451 ' HE2' ' O ' ' A' ' 2' ' ' SER . 0.0 OUTLIER -139.65 154.85 47.63 Favored 'General case' 0 C--N 1.334 -0.093 0 N-CA-C 107.197 -1.408 . . . . 13.99 107.197 158.523 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -102.74 -100.54 2.56 Favored Glycine 0 CA--C 1.506 -0.508 0 N-CA-C 106.721 -2.552 . . . . 10.529999999999999 106.721 -1.177 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 33.2 m -73.52 -166.94 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.439 -0.979 0 N-CA-C 108.016 -1.105 . . . . 11.25 108.016 150.771 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 3.1 pt-20 -87.05 70.5 10.26 Favored 'General case' 0 N--CA 1.445 -0.713 0 CA-C-O 122.818 1.294 . . . . 8.7300000000000004 112.856 175.578 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . 0.522 HD13 ' H ' ' A' ' 7' ' ' LEU . 0.0 OUTLIER -73.75 23.51 0.08 Allowed 'General case' 0 CA--C 1.543 0.678 0 CA-C-N 112.988 -1.915 . . . . 7.3899999999999997 111.803 137.252 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . 0.348 0.3 OUTLIER 81.39 -36.87 0.12 Allowed 'General case' 0 N--CA 1.454 -0.267 0 C-N-CA 129.402 3.081 . . . . 6.4500000000000002 113.189 161.241 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 6.6 m-20 -43.21 -41.51 3.85 Favored 'General case' 0 CA--C 1.516 -0.347 0 N-CA-C 113.47 0.915 . . . . 2.4399999999999999 113.47 170.659 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . 0.428 ' HA ' ' HA ' ' A' ' 2' ' ' SER . 0.0 OUTLIER -57.19 -53.14 61.48 Favored 'General case' 0 N--CA 1.45 -0.435 0 C-N-CA 120.272 -0.571 . . . . 3.1699999999999999 110.181 -177.162 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 2.6 m -77.71 -48.58 16.35 Favored 'General case' 0 N--CA 1.44 -0.964 0 N-CA-C 108.309 -0.997 . . . . 1.5 108.309 -166.305 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . 0.476 ' HA ' HD11 ' A' ' 15' ' ' ILE . 7.4 pt-20 -74.28 -27.4 60.71 Favored 'General case' 0 N--CA 1.449 -0.483 0 CA-C-N 115.298 -0.864 . . . . 2.98 110.198 -175.025 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -66.68 -56.39 13.29 Favored Glycine 0 N--CA 1.446 -0.651 0 N-CA-C 108.855 -1.698 . . . . 0.68999999999999995 108.855 168.772 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 1.8 t80 -54.27 -46.21 72.61 Favored 'General case' 0 C--O 1.224 -0.271 0 CA-C-N 118.544 1.172 . . . . 2.3199999999999998 110.755 -173.855 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . 0.476 HD11 ' HA ' ' A' ' 12' ' ' GLU . 1.8 pt -71.94 -29.91 35.0 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.299 0 N-CA-C 113.349 0.87 . . . . 0.57999999999999996 113.349 176.666 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 4.9 t60 -59.67 -57.65 12.02 Favored 'General case' 0 CA--C 1.533 0.297 0 N-CA-C 106.6 -1.63 . . . . 0.55000000000000004 106.6 174.662 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 28.1 mt-10 -48.1 -45.09 32.41 Favored 'General case' 0 C--O 1.223 -0.311 0 C-N-CA 126.631 1.972 . . . . 2.6499999999999999 110.368 174.55 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 1.4 t80 -59.23 -48.15 82.69 Favored 'General case' 0 CA--C 1.519 -0.239 0 C-N-CA 123.421 0.688 . . . . 2.0299999999999998 110.184 179.857 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -51.34 -45.18 52.93 Favored Glycine 0 CA--C 1.523 0.553 0 N-CA-C 110.476 -1.05 . . . . 0.44 110.476 171.835 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' HIS . . . . . 0.463 ' CE1' ' HB1' ' A' ' 64' ' ' ALA . 3.9 t60 -64.42 -34.05 77.29 Favored 'General case' 0 N--CA 1.45 -0.451 0 O-C-N 121.628 -0.925 . . . . 1.8999999999999999 111.826 179.689 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -71.29 -30.09 65.84 Favored 'General case' 0 N--CA 1.454 -0.267 0 O-C-N 121.505 -0.747 . . . . 0.56999999999999995 109.884 174.594 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 60.5 t -67.25 -39.94 83.98 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.299 0 O-C-N 120.951 -1.093 . . . . 0.76000000000000001 109.641 174.55 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 15.3 t0 -62.31 -26.79 68.61 Favored 'General case' 0 C--N 1.327 -0.376 0 C-N-CA 123.669 0.788 . . . . 2.02 111.468 175.465 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 6.6 t70 -73.72 -54.92 6.98 Favored 'General case' 0 N--CA 1.452 -0.353 0 N-CA-C 108.122 -1.066 . . . . 1.8400000000000001 108.122 -175.893 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 61.0 t80 -63.47 -43.3 97.7 Favored 'General case' 0 CA--C 1.52 -0.187 0 N-CA-C 109.012 -0.736 . . . . 2.4500000000000002 109.012 -179.296 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -56.35 -38.2 71.05 Favored 'General case' 0 N--CA 1.445 -0.705 0 CA-C-O 118.154 -0.927 . . . . 1.01 110.877 176.381 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -75.74 -31.28 56.46 Favored Glycine 0 CA--C 1.526 0.759 0 CA-C-N 119.721 1.146 . . . . 1.0600000000000001 111.935 -179.429 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 1.0 OUTLIER -69.0 -43.2 75.29 Favored 'General case' 0 CA--C 1.532 0.264 0 O-C-N 121.295 -1.121 . . . . 1.97 109.525 179.918 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -83.81 -33.88 24.84 Favored 'General case' 0 N--CA 1.45 -0.438 0 C-N-CA 125.615 1.566 . . . . 1.4099999999999999 113.361 -177.658 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 21.2 mt -131.28 149.98 52.34 Favored 'General case' 0 N--CA 1.45 -0.456 0 N-CA-C 108.016 -1.105 . . . . 2.1000000000000001 108.016 -168.263 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 2.1 t70 77.73 -161.14 0.03 OUTLIER 'General case' 0 C--N 1.327 -0.375 0 N-CA-C 107.41 -1.329 . . . . 4.7000000000000002 107.41 -154.748 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 1.3 mmpt? -162.1 -36.82 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.366 0 O-C-N 121.532 -0.73 . . . . 6.8200000000000003 111.284 -135.292 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 31.4 t30 -128.09 154.79 45.32 Favored 'General case' 0 C--O 1.221 -0.435 0 N-CA-C 108.889 -0.782 . . . . 5.8700000000000001 108.889 -170.205 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 41.1 tt0 2.43 -47.35 0.0 OUTLIER 'General case' 0 N--CA 1.472 0.632 0 C-N-CA 130.087 3.355 . . . . 7.4000000000000004 116.584 151.669 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 4.9 m -53.19 109.5 0.44 Allowed 'General case' 0 CA--C 1.536 0.436 0 C-N-CA 124.717 1.207 . . . . 5.4699999999999998 109.923 175.904 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 27.3 t70 -79.48 -19.22 50.31 Favored 'General case' 0 CA--C 1.538 0.491 0 N-CA-C 114.567 1.321 . . . . 5.9699999999999998 114.567 -145.426 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 8.3 mp -129.47 161.57 30.1 Favored 'General case' 0 CA--C 1.538 0.495 0 C-N-CA 126.077 1.751 . . . . 1.8899999999999999 107.763 -170.115 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 1.9 p -73.99 -12.14 15.07 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.657 0 CA-C-N 120.233 1.378 . . . . 2.0600000000000001 111.807 -179.212 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 12.0 t -44.44 146.1 0.75 Allowed 'General case' 0 CA--C 1.532 0.27 0 C-N-CA 124.102 0.961 . . . . 3.1400000000000001 111.082 167.313 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 49.8 t30 50.56 44.54 27.23 Favored 'General case' 0 N--CA 1.453 -0.318 0 C-N-CA 125.097 1.359 . . . . 5.3200000000000003 112.263 178.269 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 12.1 t -120.78 -170.4 1.99 Allowed 'General case' 0 N--CA 1.447 -0.607 0 N-CA-C 106.726 -1.583 . . . . 2.9399999999999999 106.726 160.586 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 9.5 tttm 71.91 -68.81 0.21 Allowed 'General case' 0 N--CA 1.465 0.324 0 C-N-CA 124.862 1.265 . . . . 5.9500000000000002 111.942 178.197 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 15.6 tttm -141.71 58.73 1.5 Allowed 'General case' 0 CA--C 1.529 0.154 0 C-N-CA 123.934 0.894 . . . . 5.96 108.848 -171.529 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 18.4 m-30 9.13 92.42 0.01 OUTLIER 'General case' 0 N--CA 1.466 0.36 0 C-N-CA 127.978 2.511 . . . . 4.75 113.849 178.594 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 45' ' ' ILE . . . . . 0.401 HD11 ' HE3' ' A' ' 49' ' ' LYS 0.336 3.6 tt 53.57 12.81 0.05 OUTLIER 'Isoleucine or valine' 0 CA--C 1.554 1.103 0 C-N-CA 125.858 1.663 . . . . 2.3599999999999999 115.297 161.046 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 3.3 t0 -58.36 -61.65 2.42 Favored 'General case' 0 N--CA 1.47 0.567 0 C-N-CA 126.291 1.837 . . . . 2.5099999999999998 110.518 176.071 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 3.9 mm -54.5 -47.43 71.17 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.301 0 C-N-CA 125.372 1.469 . . . . 0.45000000000000001 108.616 -172.099 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 26.0 t80 -65.98 -37.1 85.11 Favored 'General case' 0 N--CA 1.449 -0.511 0 O-C-N 121.7 -0.625 . . . . 0.42999999999999999 112.315 176.792 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . 0.488 ' CA ' ' HE2' ' A' ' 49' ' ' LYS . 0.0 OUTLIER -64.27 -45.74 86.75 Favored 'General case' 0 CA--C 1.514 -0.432 0 C-N-CA 118.007 -1.477 . . . . 1.3799999999999999 111.244 -172.735 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 5.4 tp10 -84.31 -66.22 0.92 Allowed 'General case' 0 N--CA 1.446 -0.626 0 N-CA-C 108.242 -1.022 . . . . 2.0499999999999998 108.242 -177.919 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 9.2 mm-40 -69.94 -32.13 70.24 Favored 'General case' 0 CA--C 1.533 0.29 0 O-C-N 121.439 -0.788 . . . . 2.04 110.555 -169.052 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -68.89 37.04 0.29 Allowed Glycine 0 CA--C 1.529 0.931 0 C-N-CA 125.992 1.758 . . . . 0.29999999999999999 114.546 172.154 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 76.7 p -140.03 17.71 2.46 Favored 'General case' 0 N--CA 1.448 -0.546 0 O-C-N 121.224 -1.162 . . . . 2.0899999999999999 111.401 160.093 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 30.4 t-20 -131.67 -39.3 1.12 Allowed 'General case' 0 C--N 1.339 0.146 0 N-CA-C 112.099 0.407 . . . . 1.5600000000000001 112.099 -162.533 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 24.6 mt -63.05 -35.87 81.68 Favored 'General case' 0 CA--C 1.533 0.299 0 O-C-N 121.745 -0.597 . . . . 0.37 110.972 -176.257 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 4.4 t 168.32 175.55 0.04 OUTLIER 'General case' 0 CA--C 1.534 0.351 0 C-N-CA 127.463 2.305 . . . . 0.91000000000000003 107.673 -179.052 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 6.9 m -59.69 -37.57 79.2 Favored 'General case' 0 N--CA 1.454 -0.249 0 C-N-CA 124.425 1.09 . . . . 0.91000000000000003 111.378 176.348 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -63.97 -28.41 69.8 Favored 'General case' 0 N--CA 1.463 0.204 0 C-N-CA 122.938 0.495 . . . . 1.04 111.258 173.233 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -68.01 -3.71 31.11 Favored Glycine 0 CA--C 1.523 0.592 0 O-C-N 121.39 -0.819 . . . . 0.40000000000000002 111.715 172.707 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 1.8 ttt180 -129.87 6.11 5.05 Favored 'General case' 0 N--CA 1.451 -0.402 0 CA-C-N 118.574 1.187 . . . . 2.1800000000000002 112.231 -174.994 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 58.2 p -75.05 -132.03 0.01 OUTLIER 'General case' 0 CA--C 1.536 0.41 0 N-CA-C 108.123 -1.066 . . . . 0.89000000000000001 108.123 169.59 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 1.5 m-20 -73.05 155.94 39.26 Favored 'General case' 0 CA--C 1.527 0.079 0 O-C-N 120.283 -1.511 . . . . 1.5800000000000001 108.447 176.238 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 35.8 tt0 -62.09 -33.48 74.51 Favored 'General case' 0 CA--C 1.534 0.345 0 C-N-CA 119.512 -0.875 . . . . 2.5600000000000001 110.463 178.531 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 64' ' ' ALA . . . . . 0.463 ' HB1' ' CE1' ' A' ' 20' ' ' HIS . . . -60.82 -21.08 62.79 Favored 'General case' 0 C--N 1.331 -0.236 0 O-C-N 121.117 -0.989 . . . . 0.64000000000000001 113.596 176.9 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 4.9 mt-10 -85.49 -49.57 7.97 Favored 'General case' 0 CA--C 1.509 -0.615 0 O-C-N 121.331 -0.856 . . . . 1.8999999999999999 110.919 171.254 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 49.8 t80 -41.11 -49.85 3.45 Favored 'General case' 0 CA--C 1.535 0.376 0 C-N-CA 123.874 0.87 . . . . 0.31 111.666 171.869 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 77.9 t80 -62.59 -47.54 83.36 Favored 'General case' 0 CA--C 1.533 0.3 0 C-N-CA 123.509 0.724 . . . . 0.38 111.314 175.674 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -59.93 -53.46 57.61 Favored 'General case' 0 CA--C 1.535 0.386 0 C-N-CA 124.15 0.98 . . . . 0.28000000000000003 112.264 -175.672 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 8.0 pt-20 -66.06 -31.07 71.73 Favored 'General case' 0 N--CA 1.451 -0.412 0 O-C-N 120.575 -1.328 . . . . 3.2400000000000002 112.079 173.527 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -59.33 -40.57 86.74 Favored 'General case' 0 N--CA 1.451 -0.391 0 CA-C-N 119.749 1.159 . . . . 0.34999999999999998 109.122 174.452 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 23.1 t80 -58.6 -51.4 70.08 Favored 'General case' 0 C--O 1.23 0.055 0 C-N-CA 124.546 1.138 . . . . 2.3100000000000001 110.92 175.002 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 26.0 ttt180 -46.39 -66.87 0.34 Allowed 'General case' 0 N--CA 1.464 0.247 0 C-N-CA 123.4 0.68 . . . . 1.8799999999999999 109.548 175.147 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . 0.515 ' HB3' HG21 ' A' ' 85' ' ' VAL . 0.1 OUTLIER -55.89 -35.77 66.9 Favored 'General case' 0 N--CA 1.45 -0.458 0 C-N-CA 126.19 1.796 . . . . 0.40999999999999998 109.491 -173.271 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 2.1 ttp -59.64 -37.96 80.09 Favored 'General case' 0 C--O 1.234 0.242 0 N-CA-C 112.283 0.475 . . . . 2.3999999999999999 112.283 -176.489 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 11.0 p80 -100.01 2.14 43.16 Favored 'General case' 0 CA--C 1.53 0.208 0 N-CA-C 114.459 1.281 . . . . 1.05 114.459 -177.566 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 70.3 m -49.51 128.51 17.56 Favored 'General case' 0 N--CA 1.448 -0.54 0 CA-C-N 120.43 1.468 . . . . 1.1100000000000001 112.797 -168.518 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 4.1 p -50.96 -45.51 60.79 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 112.97 -1.923 . . . . 0.97999999999999998 108.88 172.9 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 22.5 t0 -69.22 99.02 1.09 Allowed 'General case' 0 N--CA 1.449 -0.493 0 N-CA-C 107.241 -1.392 . . . . 2.2200000000000002 107.241 162.951 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 36.8 p-80 -62.86 -30.18 71.31 Favored 'General case' 0 N--CA 1.45 -0.444 0 CA-C-N 115.342 -0.845 . . . . 3.8100000000000001 112.241 -178.346 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -59.32 -39.42 83.04 Favored 'General case' 0 C--N 1.326 -0.453 0 O-C-N 121.83 -0.543 . . . . 0.68999999999999995 110.189 174.402 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 2.6 tt0 -52.91 -35.92 58.83 Favored 'General case' 0 N--CA 1.466 0.326 0 CA-C-O 121.643 0.735 . . . . 2.9900000000000002 110.483 176.817 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 18.6 mtp180 -67.57 -48.19 67.59 Favored 'General case' 0 CA--C 1.519 -0.248 0 N-CA-C 109.262 -0.644 . . . . 2.2799999999999998 109.262 179.561 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 1.5 mm? -62.89 -23.82 67.52 Favored 'General case' 0 N--CA 1.452 -0.338 0 CA-C-O 117.702 -1.142 . . . . 0.5 112.31 177.848 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 2.5 mptm? -62.09 -44.43 96.68 Favored 'General case' 0 C--O 1.225 -0.234 0 CA-C-N 120.822 1.646 . . . . 1.1899999999999999 108.349 170.282 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 85' ' ' VAL . . . . . 0.515 HG21 ' HB3' ' A' ' 73' ' ' LEU . 96.7 t -61.29 -57.94 9.84 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.486 0 CA-C-O 117.467 -1.254 . . . . 0.35999999999999999 110.962 176.107 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 57.0 mt-30 -55.51 -49.24 73.11 Favored 'General case' 0 N--CA 1.466 0.36 0 CA-C-N 121.603 2.001 . . . . 2.3700000000000001 111.7 -176.355 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 76.6 tttt -53.92 -49.69 68.08 Favored 'General case' 0 N--CA 1.446 -0.645 0 C-N-CA 123.74 0.816 . . . . 1.95 110.92 179.963 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 3.0 m-20 -83.54 -9.0 59.23 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 118.918 -0.563 . . . . 1.04 111.727 -175.327 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -160.87 73.95 2.7 Favored Pre-proline 0 C--O 1.238 0.466 0 C-N-CA 124.991 1.317 . . . . 0.31 109.669 -170.628 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 84.9 Cg_endo -77.08 22.48 0.56 Allowed 'Trans proline' 0 CA--C 1.537 0.647 0 C-N-CA 123.521 2.814 . . . . 1.4399999999999999 112.707 -173.41 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 4.7 ptmt -141.61 -43.15 0.36 Allowed 'General case' 0 N--CA 1.451 -0.423 0 C-N-CA 125.799 1.64 . . . . 2.5899999999999999 109.397 -175.829 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 4.4 m -57.61 -46.09 84.52 Favored 'General case' 0 CA--C 1.517 -0.306 0 CA-C-N 119.924 1.238 . . . . 0.33000000000000002 111.265 172.247 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 22.5 t80 -56.85 -49.25 76.04 Favored 'General case' 0 CA--C 1.505 -0.78 0 C-N-CA 119.835 -0.746 . . . . 1.79 109.55 177.432 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 55.3 tt0 -58.76 -28.59 66.05 Favored 'General case' 0 N--CA 1.439 -1.0 0 CA-C-N 114.9 -1.045 . . . . 1.3999999999999999 110.844 178.721 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 18.4 t80 -67.13 -53.31 31.81 Favored 'General case' 0 N--CA 1.454 -0.231 0 CA-C-N 119.367 0.985 . . . . 0.95999999999999996 109.615 -178.812 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 2.0 mp -63.99 -30.27 49.56 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.246 0 N-CA-C 108.315 -0.994 . . . . 0.80000000000000004 108.315 177.284 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -73.73 -25.17 60.06 Favored 'General case' 0 CA--C 1.538 0.509 0 O-C-N 121.735 -0.603 . . . . 1.52 111.196 179.642 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 34.2 t0 -69.29 -49.92 51.51 Favored 'General case' 0 CA--C 1.507 -0.674 0 N-CA-C 106.335 -1.728 . . . . 2.7599999999999998 106.335 172.45 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 87.2 mm-40 -80.57 31.03 0.29 Allowed 'General case' 0 N--CA 1.435 -1.192 0 CA-C-N 113.895 -1.502 . . . . 2.3799999999999999 111.021 172.923 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 4.7 tp -60.69 109.95 0.53 Allowed 'Isoleucine or valine' 0 CA--C 1.514 -0.43 0 N-CA-C 105.365 -2.087 . . . . 4.1699999999999999 105.365 165.484 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 101' ' ' LYS . . . . . 0.722 ' HA ' ' HE2' ' A' ' 101' ' ' LYS 0.314 0.0 OUTLIER -142.77 -151.67 0.37 Allowed 'General case' 0 N--CA 1.442 -0.831 0 C-N-CA 117.558 -1.657 . . . . 7.6799999999999997 112.03 177.719 . . . . . . . . 4 4 . 1 . 001 nuclear nobuild full ' A' A ' 102' ' ' PHE . . . . . . . . . . . . . 2.6 t80 -156.22 35.57 0.33 Allowed 'General case' 0 N--CA 1.446 -0.647 0 N-CA-C 106.755 -1.572 . . . . 6.3300000000000001 106.755 -143.565 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 3.6 tp -71.23 114.71 9.92 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.66 0 N-CA-C 106.727 -1.583 . . . . 3.3500000000000001 106.727 177.124 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 104' ' ' ILE . . . . . 0.574 ' HA ' ' HB2' ' A' ' 105' ' ' ASN 0.265 0.9 OUTLIER 70.31 172.22 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.55 0.953 0 O-C-N 124.117 0.886 . . . . 6.04 109.691 167.705 . . . . . . . . 4 4 . 1 . 001 nuclear nobuild full ' A' A ' 105' ' ' ASN . . . . . 0.574 ' HB2' ' HA ' ' A' ' 104' ' ' ILE 0.314 16.0 m120 101.35 105.85 0.01 OUTLIER 'General case' 0 N--CA 1.469 0.522 2 C-N-CA 137.631 6.373 . . . . 6.7000000000000002 112.707 -13.268 . . . . . . . . 4 3 . 1 . 001 nuclear nobuild full ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 13.1 t . . . . . 0 C--O 1.247 0.956 0 C-N-CA 131.581 3.952 . . . . 7.8799999999999999 112.005 14.592 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.471 0.989 0 N-CA-C 109.302 -1.519 . . . . 23.859999999999999 109.302 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -176.04 -85.48 0.0 OUTLIER 'General case' 0 C--O 1.226 -0.173 0 N-CA-C 107.919 -1.141 . . . . 24.829999999999998 107.919 173.974 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 6.6 ptpp? -163.9 170.66 16.45 Favored 'General case' 0 N--CA 1.455 -0.215 0 N-CA-C 108.194 -1.039 . . . . 28.0 108.194 -176.897 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 102.21 140.51 11.1 Favored Glycine 0 C--N 1.332 0.321 0 N-CA-C 108.63 -1.788 . . . . 19.699999999999999 108.63 -173.473 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 33.1 m -104.87 -162.35 0.14 Allowed 'Isoleucine or valine' 0 N--CA 1.442 -0.835 0 N-CA-C 108.271 -1.011 . . . . 18.149999999999999 108.271 175.553 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 1.3 pp20? -79.77 129.11 34.2 Favored 'General case' 0 N--CA 1.448 -0.531 0 N-CA-C 108.835 -0.802 . . . . 12.1 108.835 170.923 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . 0.462 HD22 ' N ' ' A' ' 7' ' ' LEU . 0.0 OUTLIER -160.61 36.14 0.16 Allowed 'General case' 0 N--CA 1.446 -0.667 0 C-N-CA 124.756 1.222 . . . . 10.970000000000001 109.087 173.191 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 3.3 mmm180 -143.19 98.24 3.23 Favored 'General case' 0 N--CA 1.453 -0.301 0 C-N-CA 123.563 0.745 . . . . 9.7699999999999996 109.156 -175.013 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 2.4 m120 -52.21 -33.51 41.38 Favored 'General case' 0 CA--C 1.516 -0.343 0 N-CA-C 112.47 0.545 . . . . 2.7999999999999998 112.47 173.482 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 4.8 t70 -58.85 -54.69 44.23 Favored 'General case' 0 N--CA 1.448 -0.532 0 C-N-CA 123.21 0.604 . . . . 2.4199999999999999 110.81 176.406 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 15.1 m -69.32 -48.02 62.74 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 121.899 0.857 . . . . 1.5700000000000001 110.794 -175.944 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . 0.431 ' OE2' ' HD3' ' A' ' 72' ' ' ARG . 20.9 tp10 -67.01 -30.67 70.84 Favored 'General case' 0 CA--C 1.534 0.359 0 C-N-CA 126.387 1.875 . . . . 4.96 109.751 -176.359 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -71.59 -43.0 53.75 Favored Glycine 0 N--CA 1.448 -0.557 0 N-CA-C 110.322 -1.111 . . . . 0.71999999999999997 110.322 170.314 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -55.45 -52.85 62.27 Favored 'General case' 0 C--O 1.227 -0.127 0 CA-C-N 118.369 1.084 . . . . 3.46 110.297 -174.941 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER -63.58 -36.01 74.79 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.488 0 N-CA-C 112.838 0.681 . . . . 0.5 112.838 177.664 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 2.5 t60 -57.23 -57.34 13.04 Favored 'General case' 0 C--N 1.341 0.235 0 N-CA-C 107.115 -1.439 . . . . 0.48999999999999999 107.115 177.659 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 38.7 mt-10 -59.67 -40.37 87.55 Favored 'General case' 0 N--CA 1.452 -0.362 0 C-N-CA 123.712 0.805 . . . . 2.1699999999999999 110.479 -178.248 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -53.15 -48.74 67.7 Favored 'General case' 0 CA--C 1.518 -0.26 0 CA-C-N 118.849 0.749 . . . . 3.3599999999999999 110.319 175.842 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -48.72 -47.09 30.89 Favored Glycine 0 CA--C 1.525 0.7 0 N-CA-C 110.715 -0.954 . . . . 0.51000000000000001 110.715 174.913 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 20' ' ' HIS . . . . . 0.53 ' CE1' ' HB1' ' A' ' 64' ' ' ALA . 2.3 t-160 -65.05 -44.5 88.84 Favored 'General case' 0 C--O 1.224 -0.282 0 O-C-N 122.149 -0.618 . . . . 1.8300000000000001 111.682 179.493 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -61.72 -32.76 73.0 Favored 'General case' 0 N--CA 1.453 -0.302 0 O-C-N 120.915 -1.116 . . . . 0.96999999999999997 109.933 -179.385 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 78.8 t -71.91 -36.35 57.59 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.306 0 O-C-N 121.519 -0.738 . . . . 1.3100000000000001 109.292 176.267 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 8.9 t0 -57.52 -27.21 62.38 Favored 'General case' 0 N--CA 1.453 -0.288 0 C-N-CA 123.491 0.717 . . . . 2.0299999999999998 111.401 173.793 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 14.7 t70 -71.74 -55.78 7.02 Favored 'General case' 0 N--CA 1.451 -0.423 0 N-CA-C 109.053 -0.721 . . . . 1.98 109.053 -178.127 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 60.7 t80 -64.39 -54.78 27.35 Favored 'General case' 0 CA--C 1.518 -0.262 0 CA-C-N 115.957 -0.565 . . . . 2.3999999999999999 109.5 -176.896 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -55.06 -33.8 63.03 Favored 'General case' 0 N--CA 1.448 -0.564 0 CA-C-O 118.59 -0.719 . . . . 1.6899999999999999 111.222 176.507 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -68.31 -38.54 87.5 Favored Glycine 0 CA--C 1.522 0.531 0 CA-C-N 119.59 1.086 . . . . 1.46 111.485 178.314 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -69.83 -45.79 67.06 Favored 'General case' 0 N--CA 1.453 -0.279 0 O-C-N 122.338 -0.507 . . . . 3.21 110.185 -177.795 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -79.84 -32.18 40.53 Favored 'General case' 0 N--CA 1.451 -0.381 0 C-N-CA 124.772 1.229 . . . . 1.6399999999999999 112.986 -175.82 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 12.8 mt -127.27 103.36 7.36 Favored 'General case' 0 N--CA 1.451 -0.423 0 N-CA-C 107.243 -1.392 . . . . 2.8599999999999999 107.243 -169.06 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -126.13 153.1 45.04 Favored 'General case' 0 N--CA 1.454 -0.238 0 N-CA-C 109.219 -0.66 . . . . 5.3300000000000001 109.219 -176.167 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -164.99 98.12 0.74 Allowed 'General case' 0 N--CA 1.452 -0.375 0 N-CA-C 108.524 -0.917 . . . . 9.4499999999999993 108.524 173.349 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 6.9 t-20 62.39 135.27 0.01 OUTLIER 'General case' 0 C--O 1.222 -0.376 0 C-N-CA 128.567 2.747 . . . . 10.75 111.299 -171.357 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 13.6 tt0 47.0 60.91 3.12 Favored 'General case' 0 CA--C 1.532 0.278 0 C-N-CA 124.338 1.055 . . . . 11.01 110.124 -179.564 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 22.2 p -57.9 84.95 0.01 OUTLIER 'General case' 0 N--CA 1.454 -0.232 0 C-N-CA 126.639 1.976 . . . . 7.04 112.284 -170.258 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -156.0 106.47 2.43 Favored 'General case' 0 N--CA 1.449 -0.502 0 N-CA-C 106.691 -1.596 . . . . 5.3499999999999996 106.691 -179.333 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 5.4 mp 66.88 150.94 0.06 Allowed 'General case' 0 CA--C 1.539 0.52 0 C-N-CA 125.377 1.471 . . . . 2.3500000000000001 112.166 177.844 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 7.8 p -87.27 35.94 0.06 OUTLIER 'Isoleucine or valine' 0 CA--C 1.538 0.489 0 O-C-N 119.674 -1.891 . . . . 3.54 110.855 -179.448 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 5.0 t -112.14 -41.01 4.04 Favored 'General case' 0 C--O 1.23 0.064 0 O-C-N 121.153 -0.967 . . . . 4.0999999999999996 109.901 175.651 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 9.5 m120 -74.36 68.94 1.58 Allowed 'General case' 0 CA--C 1.531 0.218 0 C-N-CA 123.628 0.771 . . . . 6.0 110.436 -177.419 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -163.29 70.49 0.24 Allowed 'General case' 0 N--CA 1.451 -0.408 0 O-C-N 120.771 -1.206 . . . . 3.4500000000000002 108.966 -178.31 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -151.61 68.05 0.9 Allowed 'General case' 0 CA--C 1.521 -0.17 0 O-C-N 121.05 -1.031 . . . . 9.1099999999999994 108.754 174.843 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER 68.18 -75.05 0.07 Allowed 'General case' 0 C--O 1.225 -0.226 0 C-N-CA 125.244 1.418 . . . . 6.8799999999999999 110.218 -174.889 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 23.7 p90 -156.4 87.72 1.05 Allowed 'General case' 0 C--O 1.222 -0.343 0 CA-C-N 119.43 1.014 . . . . 9.2300000000000004 108.521 172.107 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 27.9 pt 37.93 57.78 0.19 Allowed 'Isoleucine or valine' 0 N--CA 1.47 0.54 0 C-N-CA 124.422 1.089 . . . . 2.48 112.107 177.524 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 4.9 t0 -86.23 -56.76 3.3 Favored 'General case' 0 C--N 1.33 -0.248 0 C-N-CA 124.591 1.156 . . . . 2.3900000000000001 109.935 -173.044 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 7.6 mm -48.92 -57.83 1.47 Allowed 'Isoleucine or valine' 0 CA--C 1.531 0.216 0 C-N-CA 125.897 1.679 . . . . 0.42999999999999999 110.079 179.499 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 21.6 t80 -60.0 -29.76 68.69 Favored 'General case' 0 N--CA 1.451 -0.41 0 C-N-CA 124.038 0.935 . . . . 0.45000000000000001 111.962 179.82 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . 0.402 ' HA ' ' HE2' ' A' ' 49' ' ' LYS . 0.1 OUTLIER -69.14 -45.09 70.98 Favored 'General case' 0 N--CA 1.453 -0.315 0 O-C-N 120.289 -1.507 . . . . 1.22 110.956 -175.597 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 3.9 tp10 -86.84 -60.62 1.93 Allowed 'General case' 0 CA--C 1.532 0.266 0 CA-C-O 122.253 1.025 . . . . 2.3999999999999999 109.349 -178.088 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 22.1 mm-40 -72.6 -28.79 62.99 Favored 'General case' 0 C--O 1.235 0.313 0 O-C-N 121.519 -0.738 . . . . 2.5499999999999998 110.358 -171.348 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -70.89 39.92 0.53 Allowed Glycine 0 CA--C 1.534 1.234 0 C-N-CA 124.838 1.209 . . . . 0.37 113.743 169.829 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 24.3 m -151.82 36.47 0.56 Allowed 'General case' 0 CA--C 1.529 0.161 0 C-N-CA 125.638 1.575 . . . . 1.8899999999999999 108.746 159.779 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 1.3 m-80 -141.65 -47.25 0.37 Allowed 'General case' 0 CA--C 1.515 -0.381 0 O-C-N 122.052 -0.405 . . . . 1.8600000000000001 112.074 -172.893 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . 0.544 HD22 HG22 ' A' ' 85' ' ' VAL . 23.7 mt -63.81 -34.04 77.03 Favored 'General case' 0 C--N 1.332 -0.156 0 C-N-CA 120.294 -0.562 . . . . 0.52000000000000002 111.227 -172.201 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER 177.82 169.43 0.7 Allowed 'General case' 0 C--N 1.331 -0.208 0 C-N-CA 124.937 1.295 . . . . 0.81000000000000005 107.775 -173.575 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 39.4 m -61.56 -36.8 81.66 Favored 'General case' 0 N--CA 1.456 -0.146 0 O-C-N 121.81 -0.556 . . . . 0.90000000000000002 110.677 168.767 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 4.7 m-85 -67.36 -7.58 25.98 Favored 'General case' 0 N--CA 1.465 0.316 0 CA-C-N 118.359 0.527 . . . . 1.6100000000000001 112.164 172.87 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -82.59 -8.82 85.59 Favored Glycine 0 N--CA 1.441 -1.024 0 CA-C-O 118.024 -1.431 . . . . 0.42999999999999999 110.934 173.569 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 4.8 ttt-85 -116.39 -9.15 11.54 Favored 'General case' 0 CA--C 1.529 0.166 0 CA-C-N 119.897 1.849 . . . . 2.8300000000000001 112.283 -177.3 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 22.3 p -72.35 -136.51 0.01 OUTLIER 'General case' 0 CA--C 1.536 0.437 0 C-N-CA 123.366 0.666 . . . . 0.92000000000000004 109.376 177.601 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -65.87 146.47 54.7 Favored 'General case' 0 N--CA 1.454 -0.264 0 O-C-N 119.784 -1.822 . . . . 1.6000000000000001 108.187 178.182 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 61.6 tt0 -55.7 -34.28 64.94 Favored 'General case' 0 CA--C 1.533 0.301 0 CA-C-O 121.651 0.739 . . . . 2.9199999999999999 110.564 178.21 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 64' ' ' ALA . . . . . 0.53 ' HB1' ' CE1' ' A' ' 20' ' ' HIS . . . -59.44 -36.76 76.53 Favored 'General case' 0 N--CA 1.452 -0.36 0 C-N-CA 123.334 0.654 . . . . 0.42999999999999999 112.523 176.45 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 9.1 mt-10 -72.27 -43.53 64.16 Favored 'General case' 0 N--CA 1.455 -0.224 0 O-C-N 121.402 -0.811 . . . . 2.4500000000000002 109.989 177.461 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 43.6 t80 -50.58 -50.91 52.5 Favored 'General case' 0 N--CA 1.454 -0.257 0 C-N-CA 124.089 0.955 . . . . 0.29999999999999999 111.086 173.543 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 63.2 t80 -61.56 -46.78 88.43 Favored 'General case' 0 N--CA 1.454 -0.249 0 C-N-CA 123.308 0.643 . . . . 0.52000000000000002 110.521 178.3 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -59.42 -48.45 81.61 Favored 'General case' 0 CA--C 1.536 0.418 0 O-C-N 121.615 -0.678 . . . . 0.28999999999999998 111.36 -176.646 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 5.6 mm-40 -58.23 -45.35 87.85 Favored 'General case' 0 CA--C 1.52 -0.191 0 C-N-CA 123.324 0.65 . . . . 4.0300000000000002 110.406 172.737 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -56.21 -39.66 72.83 Favored 'General case' 0 N--CA 1.453 -0.281 0 CA-C-N 118.927 0.785 . . . . 0.42999999999999999 109.97 -179.555 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 1.4 t80 -60.58 -48.79 80.22 Favored 'General case' 0 CA--C 1.531 0.246 0 C-N-CA 124.475 1.11 . . . . 2.79 110.716 174.187 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 72' ' ' ARG . . . . . 0.431 ' HD3' ' OE2' ' A' ' 12' ' ' GLU . 3.3 tmm_? -51.98 -54.51 28.87 Favored 'General case' 0 CA--C 1.535 0.388 0 C-N-CA 124.669 1.188 . . . . 2.3999999999999999 110.595 178.042 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . 0.663 HD12 HG23 ' A' ' 85' ' ' VAL . 0.1 OUTLIER -62.77 -33.83 75.99 Favored 'General case' 0 C--N 1.326 -0.431 0 C-N-CA 126.463 1.905 . . . . 0.47999999999999998 110.665 179.659 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -53.37 -45.94 69.43 Favored 'General case' 0 C--N 1.331 -0.217 0 C-N-CA 123.556 0.742 . . . . 2.4500000000000002 111.888 -175.671 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 14.8 p80 -96.97 -19.03 19.07 Favored 'General case' 0 C--O 1.225 -0.201 0 CA-C-O 116.341 -1.79 . . . . 1.95 114.481 -179.778 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 10.0 m -18.9 117.42 0.02 OUTLIER 'General case' 0 C--N 1.345 0.376 0 C-N-CA 126.962 2.105 . . . . 1.1699999999999999 113.237 -176.856 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 1.8 p -45.46 -44.32 12.19 Favored 'General case' 0 N--CA 1.45 -0.467 0 C-N-CA 126.097 1.759 . . . . 1.3200000000000001 110.06 -178.808 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 59.1 t0 -75.68 107.46 7.86 Favored 'General case' 0 N--CA 1.451 -0.376 0 C-N-CA 118.097 -1.441 . . . . 1.9099999999999999 109.161 169.182 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 3.4 p-80 -41.31 -36.97 0.89 Allowed 'General case' 0 CA--C 1.531 0.244 0 C-N-CA 124.202 1.001 . . . . 4.4699999999999998 112.821 170.493 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -58.24 -45.88 86.95 Favored 'General case' 0 N--CA 1.45 -0.468 0 C-N-CA 122.841 0.456 . . . . 0.64000000000000001 110.985 -178.822 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 9.2 mt-10 -59.49 -35.28 73.83 Favored 'General case' 0 N--CA 1.455 -0.219 0 CA-C-N 118.396 0.544 . . . . 2.52 110.921 -179.532 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 5.6 mtp180 -64.57 -50.52 66.94 Favored 'General case' 0 C--N 1.328 -0.346 0 N-CA-C 108.651 -0.87 . . . . 2.8100000000000001 108.651 178.575 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . 0.408 HD13 ' HA ' ' A' ' 83' ' ' LEU . 1.4 mm? -62.05 -25.11 67.49 Favored 'General case' 0 N--CA 1.449 -0.485 0 CA-C-O 118.113 -0.946 . . . . 0.54000000000000004 111.836 174.715 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 21.5 mmtp -68.26 -39.44 82.21 Favored 'General case' 0 CA--C 1.514 -0.416 0 CA-C-N 121.071 1.759 . . . . 2.7999999999999998 109.221 176.528 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 85' ' ' VAL . . . . . 0.663 HG23 HD12 ' A' ' 73' ' ' LEU . 72.0 t -61.41 -65.97 0.45 Allowed 'Isoleucine or valine' 0 C--O 1.218 -0.57 0 CA-C-O 117.39 -1.29 . . . . 0.53000000000000003 109.656 168.616 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 2.0 mt-30 -48.03 -45.64 32.31 Favored 'General case' 0 N--CA 1.469 0.494 0 CA-C-N 121.281 1.855 . . . . 2.1499999999999999 112.531 -173.906 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 11.4 tttt -60.67 -59.58 5.17 Favored 'General case' 0 N--CA 1.45 -0.459 0 C-N-CA 125.111 1.365 . . . . 3.3900000000000001 110.428 177.812 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 64.8 m-20 -84.85 14.56 4.68 Favored 'General case' 0 CA--C 1.532 0.287 0 CA-C-O 118.791 -0.623 . . . . 1.25 110.951 -175.559 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 89' ' ' ALA . . . . . 0.474 ' HB2' HD21 ' A' ' 55' ' ' LEU . . . -170.1 71.45 0.62 Allowed Pre-proline 0 N--CA 1.448 -0.552 0 C-N-CA 126.011 1.725 . . . . 0.34000000000000002 109.024 -178.473 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 94.2 Cg_endo -81.56 52.51 4.29 Favored 'Trans proline' 0 N--CA 1.459 -0.541 0 C-N-CA 124.001 3.134 . . . . 1.8200000000000001 110.721 -175.756 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -170.47 -44.81 0.02 OUTLIER 'General case' 0 CA--C 1.534 0.365 0 C-N-CA 126.55 1.94 . . . . 3.2000000000000002 109.376 174.646 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 5.6 m -52.17 -47.91 65.26 Favored 'General case' 0 N--CA 1.467 0.406 0 CA-C-N 119.082 0.856 . . . . 0.38 111.862 177.951 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 13.0 t80 -57.69 -47.6 81.89 Favored 'General case' 0 CA--C 1.513 -0.462 0 O-C-N 121.684 -0.635 . . . . 1.8899999999999999 110.643 177.451 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 2.3 tt0 -57.55 -29.01 64.05 Favored 'General case' 0 N--CA 1.443 -0.794 0 CA-C-N 114.874 -1.057 . . . . 1.49 110.6 -178.512 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 1.9 t80 -60.83 -60.81 3.21 Favored 'General case' 0 N--CA 1.456 -0.14 0 C-N-CA 124.558 1.143 . . . . 1.0800000000000001 110.078 -178.562 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 3.6 mp -58.88 -42.19 85.06 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.227 0 N-CA-C 108.501 -0.926 . . . . 0.93999999999999995 108.501 178.07 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 1.1 m-20 -56.54 -40.02 74.39 Favored 'General case' 0 CA--C 1.534 0.35 0 CA-C-N 117.812 0.278 . . . . 1.6799999999999999 111.577 -179.833 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -63.84 -49.78 71.48 Favored 'General case' 0 C--O 1.231 0.099 0 C-N-CA 125.416 1.486 . . . . 2.6499999999999999 108.796 -178.5 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 23.0 mm100 -75.85 79.86 2.76 Favored 'General case' 0 N--CA 1.453 -0.304 0 N-CA-C 109.489 -0.56 . . . . 2.8399999999999999 109.489 173.376 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 6.8 pt -48.41 113.52 0.22 Allowed 'Isoleucine or valine' 0 N--CA 1.453 -0.293 0 C-N-CA 123.084 0.554 . . . . 5.9699999999999998 109.523 176.884 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 52.8 pttt -43.03 -46.54 5.61 Favored 'General case' 0 C--O 1.224 -0.258 0 C-N-CA 124.278 1.031 . . . . 10.43 111.978 -173.63 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 102' ' ' PHE . . . . . . . . . . . . . 24.6 t80 33.69 49.61 0.26 Allowed 'General case' 0 CA--C 1.532 0.277 0 C-N-CA 127.238 2.215 . . . . 6.8300000000000001 112.367 173.492 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -134.34 129.94 53.64 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.693 0 N-CA-C 103.547 -2.76 . . . . 4.5499999999999998 103.547 179.379 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 104' ' ' ILE . . . . . . . . . . . . . 15.2 tt -140.85 145.09 25.87 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.557 0 N-CA-C 105.878 -1.897 . . . . 8.3399999999999999 105.878 -179.35 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 10.2 p-10 -147.63 171.62 15.32 Favored 'General case' 0 C--N 1.327 -0.389 0 N-CA-C 108.527 -0.916 . . . . 7.7400000000000002 108.527 -171.378 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--O 1.248 0.975 0 N-CA-C 105.591 -2.003 . . . . 9.6099999999999994 105.591 165.056 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . 0.47 ' HA3' ' OE1' ' A' ' 17' ' ' GLU . . . . . . . . 0 N--CA 1.471 1.026 0 N-CA-C 109.691 -1.364 . . . . 11.67 109.691 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 8.1 t -59.54 178.35 0.16 Allowed 'General case' 0 CA--C 1.532 0.285 0 C-N-CA 124.583 1.153 . . . . 11.69 111.017 173.774 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -152.71 139.34 18.77 Favored 'General case' 0 N--CA 1.453 -0.284 0 N-CA-C 107.916 -1.142 . . . . 15.18 107.916 -178.18 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 155.98 -165.32 32.64 Favored Glycine 0 N--CA 1.451 -0.366 0 N-CA-C 108.592 -1.803 . . . . 11.039999999999999 108.592 -179.473 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 34.5 m -103.99 -161.81 0.13 Allowed 'Isoleucine or valine' 0 N--CA 1.44 -0.934 0 N-CA-C 106.98 -1.489 . . . . 11.59 106.98 159.727 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 8.3 pt-20 -79.18 119.13 21.84 Favored 'General case' 0 N--CA 1.448 -0.528 0 CA-C-O 122.016 0.912 . . . . 9.3000000000000007 111.024 173.986 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -156.49 43.02 0.38 Allowed 'General case' 0 N--CA 1.449 -0.52 0 C-N-CA 124.299 1.04 . . . . 7.3399999999999999 110.26 177.765 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 21.2 mmm180 73.77 -69.52 0.18 Allowed 'General case' 0 N--CA 1.467 0.402 0 C-N-CA 124.976 1.31 . . . . 8.5700000000000003 109.868 -179.794 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 3.2 m120 -45.74 -37.37 5.85 Favored 'General case' 0 CA--C 1.517 -0.324 0 C-N-CA 125.541 1.537 . . . . 3.1000000000000001 113.889 179.17 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 14.3 t70 -64.55 -51.14 64.35 Favored 'General case' 0 N--CA 1.448 -0.558 0 CA-C-N 117.67 0.214 . . . . 2.5 110.805 177.39 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 9.2 m -65.3 -51.45 60.6 Favored 'General case' 0 N--CA 1.454 -0.272 0 CA-C-O 121.805 0.812 . . . . 1.7 110.231 -175.807 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . 0.47 ' HA ' HD11 ' A' ' 15' ' ' ILE . 9.3 pt-20 -72.12 -26.64 62.2 Favored 'General case' 0 N--CA 1.451 -0.417 0 CA-C-N 115.773 -0.649 . . . . 3.0099999999999998 110.538 -175.651 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -65.62 -47.67 75.02 Favored Glycine 0 CA--C 1.527 0.806 0 N-CA-C 110.742 -0.943 . . . . 0.90000000000000002 110.742 169.335 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 17.3 t80 -60.98 -49.19 78.44 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 118.09 0.945 . . . . 3.0099999999999998 109.779 -175.061 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . 0.47 HD11 ' HA ' ' A' ' 12' ' ' GLU . 1.7 pt -67.86 -32.19 55.4 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.208 0 O-C-N 121.269 -0.894 . . . . 0.60999999999999999 112.833 175.624 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER -57.18 -54.36 47.65 Favored 'General case' 0 C--N 1.341 0.206 0 N-CA-C 106.693 -1.595 . . . . 0.55000000000000004 106.693 175.752 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . 0.47 ' OE1' ' HA3' ' A' ' 1' ' ' GLY . 33.3 mt-10 -52.2 -47.64 65.48 Favored 'General case' 0 N--CA 1.454 -0.27 0 C-N-CA 125.278 1.431 . . . . 2.6000000000000001 109.766 -179.555 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -52.8 -50.84 62.8 Favored 'General case' 0 C--O 1.227 -0.107 0 C-N-CA 123.344 0.658 . . . . 3.29 111.558 174.824 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -49.13 -46.17 33.9 Favored Glycine 0 CA--C 1.526 0.732 0 N-CA-C 110.632 -0.987 . . . . 0.42999999999999999 110.632 176.676 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 2.0 t-160 -62.59 -46.47 88.13 Favored 'General case' 0 N--CA 1.45 -0.45 0 O-C-N 122.061 -0.67 . . . . 1.8300000000000001 111.028 178.316 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -61.25 -28.97 69.55 Favored 'General case' 0 N--CA 1.455 -0.224 0 C-N-CA 123.376 0.67 . . . . 0.66000000000000003 110.856 -178.636 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 80.4 t -65.92 -41.26 89.57 Favored 'Isoleucine or valine' 0 C--O 1.234 0.264 0 O-C-N 121.037 -1.039 . . . . 0.73999999999999999 110.069 176.61 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -65.81 -20.73 66.36 Favored 'General case' 0 N--CA 1.453 -0.302 0 CA-C-N 116.715 -0.221 . . . . 2.4700000000000002 111.591 178.232 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 13.0 t70 -73.04 -52.26 15.04 Favored 'General case' 0 N--CA 1.454 -0.235 0 CA-C-O 122.086 0.946 . . . . 2.3599999999999999 108.483 -175.868 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 61.9 t80 -57.34 -45.41 84.32 Favored 'General case' 0 N--CA 1.455 -0.223 0 CA-C-N 115.581 -0.736 . . . . 2.3999999999999999 109.763 175.297 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -59.65 -30.16 68.55 Favored 'General case' 0 CA--C 1.535 0.373 0 O-C-N 121.654 -0.654 . . . . 1.1299999999999999 112.199 176.416 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -74.46 -21.86 78.22 Favored Glycine 0 CA--C 1.524 0.611 0 CA-C-N 119.231 0.923 . . . . 1.51 112.575 179.964 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 1.1 t80 -88.67 -46.4 9.06 Favored 'General case' 0 N--CA 1.456 -0.168 0 CA-C-N 117.569 0.684 . . . . 2.25 110.146 178.34 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -75.73 -35.56 60.2 Favored 'General case' 0 CA--C 1.514 -0.424 0 C-N-CA 124.224 1.009 . . . . 1.74 112.546 -176.369 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 9.1 mt -113.97 -163.01 0.84 Allowed 'General case' 0 N--CA 1.448 -0.574 0 N-CA-C 105.987 -1.857 . . . . 2.8100000000000001 105.987 -176.874 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 15.6 t0 48.23 74.68 0.16 Allowed 'General case' 0 CA--C 1.539 0.546 0 CA-C-O 122.641 1.21 . . . . 4.4199999999999999 114.2 169.688 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -72.59 -39.06 67.64 Favored 'General case' 0 N--CA 1.465 0.275 0 O-C-N 120.508 -1.37 . . . . 8.5500000000000007 112.826 -166.979 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 50.4 t30 -86.61 134.56 33.62 Favored 'General case' 0 C--O 1.224 -0.26 0 N-CA-C 106.895 -1.521 . . . . 6.9500000000000002 106.895 179.328 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 34.3 tp60 49.7 50.89 17.52 Favored 'General case' 0 CA--C 1.539 0.552 0 C-N-CA 123.034 0.533 . . . . 7.2400000000000002 110.452 -170.597 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 49.1 m -54.93 102.47 0.07 Allowed 'General case' 0 C--N 1.342 0.273 0 CA-C-N 118.182 0.447 . . . . 8.8800000000000008 110.075 174.675 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 39.8 t0 -145.72 -77.27 0.2 Allowed 'General case' 0 N--CA 1.452 -0.366 0 N-CA-C 107.1 -1.444 . . . . 5.2000000000000002 107.1 -172.739 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 4.5 mp -142.51 140.56 31.88 Favored 'General case' 0 C--N 1.339 0.132 0 N-CA-C 107.233 -1.395 . . . . 1.8 107.233 171.194 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 9.6 p -62.31 -12.55 8.72 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.54 0 N-CA-C 112.759 0.651 . . . . 2.3799999999999999 112.759 -170.892 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 8.1 t -47.21 -36.38 8.74 Favored 'General case' 0 N--CA 1.454 -0.244 0 C-N-CA 125.629 1.572 . . . . 2.8900000000000001 113.496 179.992 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 37.1 t-20 -88.9 50.49 1.97 Allowed 'General case' 0 CA--C 1.531 0.234 0 CA-C-N 119.784 1.175 . . . . 6.7800000000000002 110.895 -168.812 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 13.8 t -166.02 -140.25 0.04 OUTLIER 'General case' 0 CA--C 1.536 0.419 0 O-C-N 121.526 -0.734 . . . . 3.1099999999999999 109.28 -171.01 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 17.88 93.5 0.01 OUTLIER 'General case' 0 N--CA 1.47 0.539 0 C-N-CA 129.088 2.955 . . . . 5.8700000000000001 114.126 172.549 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 3.7 tttp 100.44 -47.56 0.0 OUTLIER 'General case' 0 N--CA 1.464 0.268 0 C-N-CA 128.066 2.546 . . . . 8.2400000000000002 107.25 177.143 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 19.7 t80 91.32 98.61 0.02 OUTLIER 'General case' 0 CA--C 1.528 0.115 0 C-N-CA 127.175 2.19 . . . . 4.71 108.864 169.267 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 32.8 pt 43.27 -126.4 0.03 OUTLIER 'Isoleucine or valine' 0 CA--C 1.542 0.645 0 C-N-CA 125.048 1.339 . . . . 4.1100000000000003 111.796 -173.846 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 26.6 t70 69.06 -72.84 0.1 Allowed 'General case' 0 N--CA 1.468 0.456 0 C-N-CA 127.101 2.161 . . . . 2.6299999999999999 112.047 174.945 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 8.1 mm -48.34 -53.17 6.67 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.392 0 C-N-CA 126.732 2.013 . . . . 0.84999999999999998 109.421 175.179 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 32.3 t80 -64.42 -34.24 77.74 Favored 'General case' 0 C--O 1.224 -0.256 0 O-C-N 121.93 -0.481 . . . . 0.45000000000000001 112.15 176.069 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . 0.457 ' HA ' ' HE2' ' A' ' 49' ' ' LYS . 10.3 mmpt? -63.11 -46.45 87.26 Favored 'General case' 0 N--CA 1.453 -0.288 0 O-C-N 120.94 -1.1 . . . . 1.04 110.784 -176.285 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 1.2 mm-40 -81.07 -67.12 0.81 Allowed 'General case' 0 N--CA 1.451 -0.378 0 CA-C-O 122.379 1.085 . . . . 2.8999999999999999 109.717 179.012 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . 0.428 ' OE2' ' HE3' ' A' ' 91' ' ' LYS . 45.1 mm-40 -75.98 -22.79 55.51 Favored 'General case' 0 N--CA 1.451 -0.389 0 CA-C-N 115.589 -0.732 . . . . 3.3900000000000001 110.952 -165.442 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . 0.407 ' HA2' ' CD1' ' A' ' 66' ' ' PHE . . . -71.99 35.45 0.63 Allowed Glycine 0 CA--C 1.531 1.065 0 C-N-CA 123.784 0.707 . . . . 0.42999999999999999 113.284 168.008 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 30.0 t -152.1 36.27 0.54 Allowed 'General case' 0 N--CA 1.448 -0.551 0 O-C-N 120.899 -1.354 . . . . 2.1499999999999999 108.269 156.794 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 4.6 t-20 -134.88 -50.52 0.77 Allowed 'General case' 0 CA--C 1.519 -0.217 0 C-N-CA 122.67 0.388 . . . . 1.76 110.837 -168.545 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . 0.431 HD22 HG22 ' A' ' 85' ' ' VAL . 16.0 mt -64.21 -35.03 79.46 Favored 'General case' 0 C--N 1.334 -0.091 0 CA-C-O 120.798 0.332 . . . . 0.51000000000000001 111.266 -174.3 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER 178.2 165.94 0.76 Allowed 'General case' 0 CA--C 1.531 0.238 0 C-N-CA 124.845 1.258 . . . . 0.70999999999999996 108.067 -174.81 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 9.0 m -59.11 -36.51 75.3 Favored 'General case' 0 N--CA 1.455 -0.204 0 C-N-CA 123.803 0.841 . . . . 0.92000000000000004 110.881 170.557 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -59.78 -34.05 72.5 Favored 'General case' 0 C--O 1.223 -0.314 0 C-N-CA 123.825 0.85 . . . . 1.4299999999999999 109.575 172.367 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -63.18 -11.55 39.81 Favored Glycine 0 C--O 1.223 -0.551 0 O-C-N 121.482 -0.761 . . . . 0.42999999999999999 112.384 176.663 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 3.1 tmt_? -111.7 -3.79 14.9 Favored 'General case' 0 N--CA 1.452 -0.37 0 CA-C-N 118.515 1.158 . . . . 3.27 112.48 -176.857 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 56.3 p -72.27 -137.75 0.01 OUTLIER 'General case' 0 CA--C 1.538 0.481 0 N-CA-C 108.596 -0.89 . . . . 1.1299999999999999 108.596 175.944 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 98.5 m-20 -69.76 149.84 47.55 Favored 'General case' 0 CA--C 1.528 0.119 0 O-C-N 119.717 -1.864 . . . . 1.5800000000000001 108.73 178.199 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 45.0 tt0 -58.6 -27.76 64.96 Favored 'General case' 0 CA--C 1.538 0.516 0 CA-C-O 121.682 0.754 . . . . 3.1000000000000001 111.222 -179.55 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -62.96 -36.61 84.02 Favored 'General case' 0 N--CA 1.452 -0.339 0 C-N-CA 124.163 0.985 . . . . 0.71999999999999997 112.826 174.562 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 4.2 mt-10 -75.81 -48.47 21.51 Favored 'General case' 0 CA--C 1.511 -0.55 0 O-C-N 121.322 -0.861 . . . . 1.9199999999999999 109.175 177.766 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 66' ' ' PHE . . . . . 0.407 ' CD1' ' HA2' ' A' ' 52' ' ' GLY . 41.2 t80 -40.23 -51.73 2.68 Favored 'General case' 0 CA--C 1.535 0.403 0 C-N-CA 123.969 0.908 . . . . 0.29999999999999999 111.694 171.609 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 59.5 t80 -60.98 -42.99 99.42 Favored 'General case' 0 CA--C 1.538 0.483 0 C-N-CA 122.95 0.5 . . . . 0.47999999999999998 111.828 175.989 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -60.76 -49.33 77.92 Favored 'General case' 0 CA--C 1.538 0.486 0 O-C-N 120.999 -1.063 . . . . 0.40000000000000002 111.836 -178.993 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 2.9 mp0 -58.28 -40.69 82.57 Favored 'General case' 0 CA--C 1.519 -0.219 0 O-C-N 121.437 -0.789 . . . . 4.5099999999999998 110.644 171.863 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -56.01 -42.29 76.22 Favored 'General case' 0 N--CA 1.449 -0.485 0 C-N-CA 120.294 -0.563 . . . . 0.65000000000000002 109.594 177.934 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -60.09 -51.47 69.5 Favored 'General case' 0 CA--C 1.528 0.114 0 CA-C-N 119.187 0.903 . . . . 3.6000000000000001 112.09 174.88 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 20.9 ttt180 -45.85 -67.46 0.28 Allowed 'General case' 0 N--CA 1.467 0.387 0 CA-C-N 118.555 0.616 . . . . 1.8500000000000001 109.569 175.489 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . 0.661 HD12 HG23 ' A' ' 85' ' ' VAL . 0.2 OUTLIER -59.12 -35.25 73.13 Favored 'General case' 0 CA--C 1.509 -0.605 0 C-N-CA 125.603 1.561 . . . . 0.60999999999999999 111.314 -173.054 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 1.8 tmt? -59.06 -38.55 79.64 Favored 'General case' 0 N--CA 1.445 -0.683 0 CA-C-O 119.783 -0.151 . . . . 2.8700000000000001 111.164 -177.256 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 23.1 p80 -91.13 -35.95 14.27 Favored 'General case' 0 N--CA 1.454 -0.237 0 CA-C-O 116.467 -1.73 . . . . 1.1200000000000001 111.915 179.353 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 20.4 m -10.36 117.46 0.01 OUTLIER 'General case' 0 C--N 1.344 0.328 0 C-N-CA 128.532 2.733 . . . . 1.23 115.251 -169.359 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 6.9 p -46.66 -44.01 18.12 Favored 'General case' 0 N--CA 1.452 -0.347 0 C-N-CA 125.814 1.645 . . . . 1.0900000000000001 110.346 176.585 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 10.5 t0 -68.33 102.68 1.44 Allowed 'General case' 0 N--CA 1.448 -0.558 0 CA-C-O 121.669 0.747 . . . . 2.21 109.243 166.04 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 34.4 p-80 -50.23 -35.54 27.22 Favored 'General case' 0 N--CA 1.455 -0.21 0 CA-C-N 115.832 -0.622 . . . . 4.3499999999999996 111.986 175.145 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -59.47 -48.28 82.24 Favored 'General case' 0 N--CA 1.448 -0.538 0 CA-C-O 118.278 -0.868 . . . . 0.79000000000000004 110.399 179.757 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 1.4 tt0 -46.69 -42.6 16.78 Favored 'General case' 0 N--CA 1.465 0.298 0 CA-C-N 119.066 0.848 . . . . 3.3700000000000001 110.161 177.1 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -63.18 -51.88 64.6 Favored 'General case' 0 CA--C 1.516 -0.351 0 N-CA-C 109.504 -0.554 . . . . 3.0800000000000001 109.504 -179.982 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 1.4 mm? -65.72 -18.38 65.29 Favored 'General case' 0 N--CA 1.45 -0.431 0 CA-C-O 117.628 -1.177 . . . . 0.57999999999999996 113.059 178.166 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -67.04 -50.58 61.47 Favored 'General case' 0 CA--C 1.519 -0.218 0 CA-C-N 121.387 1.903 . . . . 1.55 107.141 168.092 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 85' ' ' VAL . . . . . 0.661 HG23 HD12 ' A' ' 73' ' ' LEU . 69.0 t -58.03 -43.53 85.25 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.671 0 CA-C-O 117.471 -1.252 . . . . 0.45000000000000001 112.008 177.79 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 9.9 mt-30 -68.1 -47.79 67.25 Favored 'General case' 0 C--O 1.225 -0.225 0 CA-C-N 122.305 2.321 . . . . 1.71 111.853 177.972 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 72.4 tttt -57.12 -49.18 76.71 Favored 'General case' 0 N--CA 1.449 -0.506 0 O-C-N 121.568 -0.707 . . . . 2.27 110.602 -173.942 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 25.0 m120 -68.83 -48.76 62.73 Favored 'General case' 0 N--CA 1.453 -0.291 0 N-CA-C 109.622 -0.511 . . . . 1.8200000000000001 109.622 175.738 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -122.81 77.62 48.88 Favored Pre-proline 0 C--O 1.236 0.393 0 C-N-CA 125.652 1.581 . . . . 0.59999999999999998 111.656 -170.34 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 57.9 Cg_endo -69.78 4.18 2.35 Favored 'Trans proline' 0 CA--C 1.537 0.632 0 C-N-CA 122.907 2.404 . . . . 1.5700000000000001 113.187 -176.815 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 91' ' ' LYS . . . . . 0.428 ' HE3' ' OE2' ' A' ' 51' ' ' GLU . 0.5 OUTLIER -122.49 -44.14 2.25 Favored 'General case' 0 N--CA 1.45 -0.448 0 C-N-CA 126.26 1.824 . . . . 3.3199999999999998 110.143 -171.702 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 5.9 m -58.25 -45.52 87.64 Favored 'General case' 0 N--CA 1.464 0.237 0 O-C-N 120.946 -1.097 . . . . 0.52000000000000002 111.214 175.668 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 10.9 t80 -58.15 -46.08 86.3 Favored 'General case' 0 CA--C 1.511 -0.556 0 CA-C-O 121.771 0.796 . . . . 2.21 110.83 178.136 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 26.8 tt0 -56.09 -34.75 66.31 Favored 'General case' 0 N--CA 1.44 -0.931 0 CA-C-N 114.284 -1.325 . . . . 2.4399999999999999 109.834 179.851 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 4.0 t80 -62.7 -57.19 11.85 Favored 'General case' 0 N--CA 1.455 -0.207 0 C-N-CA 124.338 1.055 . . . . 0.97999999999999998 110.305 -178.083 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 37.3 mm -53.91 -44.62 61.7 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.114 0 N-CA-C 109.591 -0.522 . . . . 1.3300000000000001 109.591 177.368 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 9.3 t30 -62.56 -30.78 71.57 Favored 'General case' 0 CA--C 1.534 0.335 0 N-CA-C 111.957 0.354 . . . . 1.55 111.957 -179.329 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 7.7 t70 -65.43 -47.07 77.47 Favored 'General case' 0 N--CA 1.462 0.156 0 C-N-CA 124.587 1.155 . . . . 2.46 110.003 175.118 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 6.7 mm100 -81.47 70.85 8.43 Favored 'General case' 0 N--CA 1.453 -0.305 0 CA-C-O 122.162 0.982 . . . . 2.75 110.212 -175.47 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 9.4 tp -69.4 106.67 1.38 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.425 0 N-CA-C 108.765 -0.828 . . . . 4.46 108.765 178.966 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 9.5 ttmm -155.79 151.42 27.21 Favored 'General case' 0 N--CA 1.455 -0.204 0 O-C-N 120.736 -1.227 . . . . 10.81 107.958 174.084 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 102' ' ' PHE . . . . . . . . . . . . . 87.6 m-85 -137.49 135.09 36.49 Favored 'General case' 0 N--CA 1.449 -0.511 0 N-CA-C 105.537 -2.023 . . . . 7.6900000000000004 105.537 175.273 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 8.8 tp -136.01 140.83 43.26 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.21 0 N-CA-C 106.519 -1.66 . . . . 4.0700000000000003 106.519 177.744 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 104' ' ' ILE . . . . . . . . . . . . . 26.1 mm 63.66 -73.8 0.08 OUTLIER 'Isoleucine or valine' 0 CA--C 1.533 0.324 0 C-N-CA 124.989 1.316 . . . . 6.9800000000000004 110.5 -169.938 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 12.9 t-20 75.47 -163.73 0.07 Allowed 'General case' 0 CA--C 1.534 0.338 0 C-N-CA 126.013 1.725 . . . . 8.4600000000000009 109.506 -178.029 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 22.5 p . . . . . 0 C--O 1.246 0.888 0 N-CA-C 107.437 -1.32 . . . . 9.8000000000000007 107.437 176.785 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . 0.491 ' O ' ' HE3' ' A' ' 3' ' ' LYS . . . . . . . . 0 N--CA 1.472 1.083 0 N-CA-C 109.59 -1.404 . . . . 17.239999999999998 109.59 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 5.5 m 25.56 76.35 0.02 OUTLIER 'General case' 0 CA--C 1.53 0.182 0 C-N-CA 127.64 2.376 . . . . 19.27 116.228 174.114 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . 0.491 ' HE3' ' O ' ' A' ' 1' ' ' GLY . 12.1 ptpt -156.34 88.31 1.07 Allowed 'General case' 0 C--O 1.225 -0.232 0 N-CA-C 109.485 -0.561 . . . . 18.719999999999999 109.485 170.385 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 70.74 -163.98 53.31 Favored Glycine 0 CA--C 1.522 0.509 0 N-CA-C 111.1 -0.8 . . . . 17.16 111.1 -176.375 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 26.7 m -85.91 -157.89 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.446 -0.628 0 C-N-CA 123.853 0.861 . . . . 17.420000000000002 109.492 178.329 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 21.5 mt-10 -82.79 119.28 24.15 Favored 'General case' 0 N--CA 1.443 -0.775 0 N-CA-C 108.924 -0.769 . . . . 12.800000000000001 108.924 172.135 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -156.07 37.03 0.34 Allowed 'General case' 0 N--CA 1.452 -0.33 0 C-N-CA 125.484 1.514 . . . . 10.949999999999999 109.565 179.197 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 7.3 mmm180 -144.14 121.65 11.74 Favored 'General case' 0 N--CA 1.446 -0.648 0 N-CA-C 106.288 -1.745 . . . . 10.66 106.288 -178.933 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 1.7 m120 -48.78 -32.25 8.32 Favored 'General case' 0 C--O 1.223 -0.324 0 C-N-CA 123.784 0.834 . . . . 2.6899999999999999 112.653 174.292 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 9.5 t70 -55.07 -58.01 9.38 Favored 'General case' 0 N--CA 1.449 -0.519 0 C-N-CA 124.768 1.227 . . . . 2.3599999999999999 110.978 173.012 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 66.1 m -64.94 -50.47 66.3 Favored 'General case' 0 N--CA 1.462 0.166 0 CA-C-O 122.115 0.96 . . . . 1.79 111.193 178.822 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 7.4 tt0 -70.52 -22.35 62.63 Favored 'General case' 0 CA--C 1.536 0.42 0 C-N-CA 125.022 1.329 . . . . 3.9900000000000002 110.45 -169.599 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -79.93 -41.1 12.91 Favored Glycine 0 CA--C 1.525 0.708 0 C-N-CA 125.1 1.333 . . . . 0.68000000000000005 109.978 168.577 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -52.28 -49.4 64.22 Favored 'General case' 0 C--N 1.333 -0.12 0 CA-C-N 118.599 1.199 . . . . 2.8799999999999999 110.741 -179.24 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -63.87 -34.33 67.56 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.559 0 N-CA-C 112.747 0.647 . . . . 0.47999999999999998 112.747 178.891 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 2.1 t-160 -59.79 -54.65 43.82 Favored 'General case' 0 N--CA 1.462 0.128 0 N-CA-C 106.762 -1.57 . . . . 0.46000000000000002 106.762 176.4 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 41.0 mt-10 -57.28 -39.32 75.45 Favored 'General case' 0 C--O 1.222 -0.349 0 CA-C-O 118.209 -0.901 . . . . 2.46 111.075 179.723 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -51.1 -54.72 22.5 Favored 'General case' 0 CA--C 1.52 -0.203 0 CA-C-N 119.368 0.985 . . . . 3.1099999999999999 110.45 173.452 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -47.94 -46.26 25.93 Favored Glycine 0 CA--C 1.527 0.792 0 N-CA-C 110.999 -0.84 . . . . 0.44 110.999 176.5 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 20' ' ' HIS . . . . . 0.573 ' CE1' ' HB1' ' A' ' 64' ' ' ALA . 2.1 t-160 -63.62 -46.73 84.42 Favored 'General case' 0 N--CA 1.45 -0.462 0 O-C-N 121.98 -0.718 . . . . 1.8300000000000001 111.794 -179.367 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -59.23 -32.72 70.22 Favored 'General case' 0 N--CA 1.452 -0.342 0 CA-C-N 118.603 0.638 . . . . 0.56999999999999995 109.352 -179.25 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 45.0 t -68.39 -41.57 83.53 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.267 0 C-N-CA 119.923 -0.711 . . . . 0.80000000000000004 110.201 177.092 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 2.0 t70 -59.53 -29.16 67.69 Favored 'General case' 0 C--O 1.23 0.07 0 CA-C-O 121.284 0.564 . . . . 2.1600000000000001 110.974 173.86 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 10.3 t70 -70.49 -49.56 47.1 Favored 'General case' 0 N--CA 1.45 -0.427 0 N-CA-C 108.602 -0.888 . . . . 2.1899999999999999 108.602 -173.65 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 25' ' ' TYR . . . . . 0.439 ' CD2' HD11 ' A' ' 103' ' ' ILE . 0.2 OUTLIER -64.2 -49.4 72.16 Favored 'General case' 0 N--CA 1.453 -0.284 0 C-N-CA 123.547 0.739 . . . . 4.5499999999999998 110.787 178.171 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -54.61 -41.5 70.06 Favored 'General case' 0 N--CA 1.454 -0.267 0 O-C-N 121.983 -0.448 . . . . 1.02 110.382 178.795 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -60.39 -58.36 14.34 Favored Glycine 0 C--O 1.224 -0.531 0 N-CA-C 109.664 -1.374 . . . . 1.1299999999999999 109.664 175.728 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -46.73 -42.64 17.02 Favored 'General case' 0 C--N 1.33 -0.242 0 C-N-CA 124.49 1.116 . . . . 2.8700000000000001 112.044 -175.187 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 3.0 mm? -84.83 -30.11 24.8 Favored 'General case' 0 N--CA 1.445 -0.696 0 C-N-CA 124.146 0.978 . . . . 1.71 113.439 -177.729 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 11.8 mt -124.82 64.78 1.11 Allowed 'General case' 0 CA--C 1.529 0.146 0 CA-C-N 119.375 0.989 . . . . 1.8999999999999999 109.949 -165.457 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 1.6 t70 -144.8 171.11 14.88 Favored 'General case' 0 CA--C 1.529 0.147 0 CA-C-O 121.237 0.541 . . . . 4.3200000000000003 110.48 -178.162 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 3.2 mmtm -101.82 -40.24 7.02 Favored 'General case' 0 N--CA 1.452 -0.35 0 C-N-CA 125.686 1.594 . . . . 7.21 110.287 168.69 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 7.4 t30 -98.4 138.55 35.46 Favored 'General case' 0 N--CA 1.454 -0.246 0 N-CA-C 107.598 -1.26 . . . . 6.6799999999999997 107.598 -179.205 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 1.4 tt0 -66.95 -20.18 65.85 Favored 'General case' 0 CA--C 1.535 0.372 0 O-C-N 121.509 -0.744 . . . . 12.0 111.229 179.845 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 1.8 p -109.94 66.12 0.63 Allowed 'General case' 0 N--CA 1.448 -0.528 0 C-N-CA 125.178 1.391 . . . . 7.7199999999999998 109.724 -177.15 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -154.87 -179.52 8.11 Favored 'General case' 0 CA--C 1.537 0.445 0 C-N-CA 124.658 1.183 . . . . 6.8899999999999997 107.962 173.845 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 5.4 mp -138.47 164.89 28.21 Favored 'General case' 0 N--CA 1.464 0.246 0 C-N-CA 124.071 0.949 . . . . 2.3300000000000001 108.577 176.371 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 9.3 p -59.58 -43.55 91.24 Favored 'Isoleucine or valine' 0 C--N 1.342 0.276 0 CA-C-N 118.509 0.595 . . . . 2.54 110.339 -175.942 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 59.7 p 48.51 -156.98 0.07 Allowed 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 124.87 1.268 . . . . 3.8100000000000001 112.123 179.97 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 26.6 t30 -75.09 69.09 1.95 Allowed 'General case' 0 CA--C 1.532 0.28 0 O-C-N 120.509 -1.369 . . . . 6.71 109.963 173.417 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 8.4 t -77.59 -176.75 4.44 Favored 'General case' 0 CA--C 1.534 0.357 0 O-C-N 121.57 -0.706 . . . . 3.5499999999999998 109.39 170.518 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 33.5 mtmt 56.71 -77.14 0.01 OUTLIER 'General case' 0 N--CA 1.467 0.383 0 C-N-CA 124.868 1.267 . . . . 6.5899999999999999 110.987 -161.897 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.3 -45.59 92.84 Favored 'General case' 0 C--O 1.224 -0.272 0 CA-C-N 118.801 0.728 . . . . 8.1799999999999997 111.15 -178.95 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 3.8 t80 64.39 74.99 0.39 Allowed 'General case' 0 CA--C 1.531 0.246 0 C-N-CA 123.611 0.765 . . . . 5.4900000000000002 111.576 174.424 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . 0.265 3.9 mt 65.65 90.74 0.05 OUTLIER 'Isoleucine or valine' 0 CA--C 1.539 0.545 0 C-N-CA 125.4 1.48 . . . . 2.9399999999999999 110.967 -178.335 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 6.6 t70 -164.57 -66.56 0.04 OUTLIER 'General case' 0 N--CA 1.465 0.292 0 C-N-CA 125.692 1.597 . . . . 2.75 107.374 -179.133 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 4.3 mm -54.28 -55.79 12.98 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.396 0 C-N-CA 126.038 1.735 . . . . 0.48999999999999999 109.689 -179.894 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 30.4 t80 -62.28 -26.02 68.17 Favored 'General case' 0 C--O 1.225 -0.219 0 O-C-N 120.498 -1.376 . . . . 0.38 112.181 175.664 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . 0.486 ' HA ' ' HE2' ' A' ' 49' ' ' LYS . 10.9 mmpt? -70.15 -47.21 62.66 Favored 'General case' 0 N--CA 1.45 -0.433 0 O-C-N 120.164 -1.585 . . . . 0.98999999999999999 110.877 -178.066 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 16.4 tp10 -89.25 -60.61 1.9 Allowed 'General case' 0 C--N 1.332 -0.179 0 CA-C-O 121.519 0.676 . . . . 2.48 109.449 -176.504 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . 0.443 ' OE2' ' HE2' ' A' ' 91' ' ' LYS . 29.3 mp0 -71.32 -26.99 63.08 Favored 'General case' 0 C--O 1.235 0.324 0 O-C-N 121.185 -0.947 . . . . 2.6099999999999999 110.699 -174.534 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . 0.443 ' HA2' ' CD1' ' A' ' 66' ' ' PHE . . . -72.45 42.59 0.84 Allowed Glycine 0 CA--C 1.53 1.016 0 C-N-CA 124.152 0.882 . . . . 0.35999999999999999 114.562 171.619 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 28.2 t -151.51 34.24 0.56 Allowed 'General case' 0 N--CA 1.451 -0.409 0 O-C-N 121.109 -1.23 . . . . 2.0499999999999998 109.087 151.432 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 1.5 m-20 -132.25 -47.68 0.92 Allowed 'General case' 0 CA--C 1.519 -0.237 0 N-CA-C 112.246 0.462 . . . . 1.78 112.246 -172.238 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 25.0 mt -59.42 -36.89 76.72 Favored 'General case' 0 N--CA 1.464 0.26 0 CA-C-O 121.033 0.444 . . . . 0.41999999999999998 111.411 -172.294 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -177.56 171.76 1.87 Allowed 'General case' 0 C--N 1.33 -0.245 0 N-CA-C 107.126 -1.435 . . . . 0.64000000000000001 107.126 -175.871 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 31.2 m -63.15 -33.7 76.03 Favored 'General case' 0 CA--C 1.53 0.179 0 O-C-N 121.693 -0.629 . . . . 1.0 110.834 169.101 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 1.8 m-85 -65.63 -19.2 65.82 Favored 'General case' 0 N--CA 1.466 0.361 0 CA-C-N 119.191 0.905 . . . . 1.21 111.502 171.041 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -69.21 -9.81 61.28 Favored Glycine 0 N--CA 1.443 -0.845 0 CA-C-O 118.656 -1.08 . . . . 0.41999999999999998 111.31 173.607 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 58.3 ttt180 -116.35 -11.5 11.21 Favored 'General case' 0 N--CA 1.454 -0.232 0 CA-C-N 119.211 1.506 . . . . 3.6800000000000002 112.657 -174.33 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 32.4 p -72.85 -123.61 0.0 OUTLIER 'General case' 0 CA--C 1.533 0.317 0 C-N-CA 123.227 0.611 . . . . 1.1200000000000001 109.724 -178.378 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 14.3 t30 -76.3 149.19 37.11 Favored 'General case' 0 N--CA 1.451 -0.405 0 O-C-N 120.215 -1.553 . . . . 1.98 107.537 177.219 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -57.12 -33.32 67.24 Favored 'General case' 0 CA--C 1.534 0.336 0 CA-C-O 121.79 0.805 . . . . 2.8599999999999999 110.321 178.832 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 64' ' ' ALA . . . . . 0.573 ' HB1' ' CE1' ' A' ' 20' ' ' HIS . . . -60.14 -34.81 74.05 Favored 'General case' 0 N--CA 1.45 -0.445 0 O-C-N 121.684 -0.635 . . . . 0.41999999999999998 112.592 177.656 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 7.0 mt-10 -76.25 -42.29 46.22 Favored 'General case' 0 CA--C 1.516 -0.34 0 O-C-N 121.694 -0.628 . . . . 2.1400000000000001 110.174 178.491 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 66' ' ' PHE . . . . . 0.443 ' CD1' ' HA2' ' A' ' 52' ' ' GLY . 36.8 t80 -48.94 -53.84 18.01 Favored 'General case' 0 N--CA 1.453 -0.289 0 C-N-CA 123.786 0.834 . . . . 0.34000000000000002 111.183 171.626 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 72.3 t80 -61.79 -45.92 91.79 Favored 'General case' 0 CA--C 1.534 0.347 0 C-N-CA 123.028 0.531 . . . . 0.51000000000000001 110.483 -179.988 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -60.54 -48.22 82.74 Favored 'General case' 0 CA--C 1.538 0.517 0 O-C-N 121.378 -0.826 . . . . 0.28999999999999998 112.186 -177.226 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 5.7 mm-40 -57.47 -41.53 80.79 Favored 'General case' 0 N--CA 1.458 -0.067 0 C-N-CA 123.74 0.816 . . . . 4.1500000000000004 110.095 172.256 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -57.48 -45.16 85.15 Favored 'General case' 0 N--CA 1.451 -0.401 0 CA-C-O 118.664 -0.684 . . . . 0.32000000000000001 109.801 -179.92 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 50.1 t80 -55.99 -49.87 72.43 Favored 'General case' 0 N--CA 1.465 0.287 0 CA-C-N 119.167 0.894 . . . . 2.2400000000000002 112.004 174.607 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 11.6 ttt180 -47.46 -61.35 1.96 Allowed 'General case' 0 CA--C 1.533 0.327 0 N-CA-C 109.107 -0.701 . . . . 2.1000000000000001 109.107 175.405 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . 0.607 ' CB ' HG21 ' A' ' 85' ' ' VAL . 0.1 OUTLIER -65.36 -23.37 66.97 Favored 'General case' 0 C--N 1.328 -0.362 0 C-N-CA 124.414 1.086 . . . . 0.55000000000000004 111.607 -173.411 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -65.05 -40.8 95.28 Favored 'General case' 0 C--N 1.326 -0.425 0 C-N-CA 122.933 0.493 . . . . 2.8399999999999999 110.719 179.109 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 13.8 p80 -95.41 -18.68 20.53 Favored 'General case' 0 C--O 1.227 -0.083 0 CA-C-O 116.936 -1.506 . . . . 0.90000000000000002 113.478 -178.603 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 7.6 m -25.67 118.04 0.06 Allowed 'General case' 0 CA--C 1.516 -0.342 0 C-N-CA 126.419 1.888 . . . . 1.05 113.59 -171.603 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 6.2 p -46.08 -44.19 15.3 Favored 'General case' 0 N--CA 1.451 -0.424 0 C-N-CA 125.746 1.619 . . . . 1.0900000000000001 109.985 177.607 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 13.4 t0 -70.03 103.81 2.38 Favored 'General case' 0 N--CA 1.451 -0.408 0 CA-C-O 122.034 0.921 . . . . 1.9199999999999999 109.738 166.274 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 1.4 p80 -45.49 -37.32 5.19 Favored 'General case' 0 CA--C 1.531 0.239 0 CA-C-N 115.569 -0.741 . . . . 4.6500000000000004 112.746 172.017 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -65.22 -42.07 93.82 Favored 'General case' 0 N--CA 1.449 -0.477 0 CA-C-O 118.68 -0.676 . . . . 0.58999999999999997 110.879 -178.699 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 1.2 tt0 -48.83 -41.41 32.84 Favored 'General case' 0 N--CA 1.463 0.188 0 CA-C-N 118.896 0.771 . . . . 2.9900000000000002 109.794 174.377 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 14.9 mtp180 -65.01 -52.53 55.55 Favored 'General case' 0 CA--C 1.517 -0.317 0 N-CA-C 109.332 -0.618 . . . . 2.3100000000000001 109.332 -179.714 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 1.4 mm? -62.5 -21.79 65.77 Favored 'General case' 0 C--O 1.222 -0.345 0 CA-C-O 118.315 -0.85 . . . . 0.5 112.838 177.752 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 30.4 mttt -67.45 -42.91 82.31 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 120.907 1.685 . . . . 1.75 108.424 174.467 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 85' ' ' VAL . . . . . 0.607 HG21 ' CB ' ' A' ' 73' ' ' LEU . 84.0 t -60.69 -64.9 0.53 Allowed 'Isoleucine or valine' 0 C--O 1.219 -0.503 0 CA-C-O 118.032 -0.985 . . . . 0.62 109.815 170.639 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -48.72 -42.67 35.9 Favored 'General case' 0 CA--C 1.533 0.309 0 CA-C-N 120.309 1.413 . . . . 2.1000000000000001 112.31 -174.622 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 35.6 tttm -62.52 -49.35 75.69 Favored 'General case' 0 N--CA 1.448 -0.56 0 C-N-CA 123.933 0.893 . . . . 2.21 111.891 178.793 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 70.6 m-80 -84.79 -4.96 59.3 Favored 'General case' 0 CA--C 1.531 0.219 0 CA-C-N 118.332 0.515 . . . . 1.8999999999999999 111.973 -179.465 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -162.02 62.78 1.44 Allowed Pre-proline 0 N--CA 1.448 -0.539 0 C-N-CA 124.274 1.029 . . . . 0.45000000000000001 110.005 -166.343 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 30.2 Cg_endo -60.08 -35.07 93.95 Favored 'Trans proline' 0 N--CA 1.454 -0.836 0 C-N-CA 122.516 2.144 . . . . 2.4300000000000002 110.446 -174.754 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 91' ' ' LYS . . . . . 0.443 ' HE2' ' OE2' ' A' ' 51' ' ' GLU . 0.2 OUTLIER -81.65 -39.55 24.23 Favored 'General case' 0 N--CA 1.451 -0.379 0 C-N-CA 124.813 1.245 . . . . 2.6299999999999999 112.639 -177.525 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 3.5 m -60.96 -45.99 92.52 Favored 'General case' 0 N--CA 1.464 0.262 0 CA-C-N 120.303 1.411 . . . . 0.39000000000000001 110.342 179.04 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 5.1 t80 -58.84 -47.96 83.01 Favored 'General case' 0 CA--C 1.51 -0.571 0 CA-C-O 121.068 0.461 . . . . 1.97 110.835 176.835 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 44.9 tt0 -56.22 -31.22 63.3 Favored 'General case' 0 N--CA 1.441 -0.887 0 CA-C-N 115.327 -0.851 . . . . 1.48 110.767 177.841 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 3.6 t80 -61.12 -58.78 6.96 Favored 'General case' 0 N--CA 1.455 -0.205 0 CA-C-N 118.702 0.683 . . . . 0.93000000000000005 110.417 -176.07 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 3.3 mp -57.15 -41.58 78.1 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.206 0 N-CA-C 108.625 -0.88 . . . . 0.79000000000000004 108.625 176.237 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 7.7 t-20 -59.65 -35.14 73.82 Favored 'General case' 0 CA--C 1.542 0.662 0 N-CA-C 112.342 0.497 . . . . 1.8600000000000001 112.342 -177.726 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 21.0 t70 -57.41 -43.81 84.05 Favored 'General case' 0 CA--C 1.516 -0.356 0 C-N-CA 125.214 1.406 . . . . 2.4700000000000002 109.66 176.423 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 70.3 mm-40 -88.76 65.9 7.85 Favored 'General case' 0 N--CA 1.443 -0.785 0 CA-C-O 121.52 0.676 . . . . 3.4300000000000002 109.857 -173.709 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 5.7 tp -69.17 88.14 0.19 Allowed 'Isoleucine or valine' 0 CA--C 1.537 0.477 0 CA-C-O 122.032 0.92 . . . . 4.4100000000000001 110.359 -176.406 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 101' ' ' LYS . . . . . 0.427 ' CE ' ' H ' ' A' ' 102' ' ' PHE . 0.1 OUTLIER -152.57 -175.76 5.43 Favored 'General case' 0 C--N 1.333 -0.131 0 O-C-N 120.644 -1.285 . . . . 8.6999999999999993 107.755 177.235 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 102' ' ' PHE . . . . . 0.427 ' H ' ' CE ' ' A' ' 101' ' ' LYS . 39.0 p90 -147.56 163.78 35.51 Favored 'General case' 0 C--N 1.327 -0.401 0 C-N-CA 125.665 1.586 . . . . 6.5700000000000003 106.745 -177.604 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 103' ' ' ILE . . . . . 0.439 HD11 ' CD2' ' A' ' 25' ' ' TYR . 9.5 tp -116.59 157.82 17.33 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.238 0 N-CA-C 108.739 -0.838 . . . . 3.6899999999999999 108.739 179.272 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 104' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -135.74 141.49 41.9 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.51 0 N-CA-C 107.019 -1.474 . . . . 6.0 107.019 179.674 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 52.4 t30 65.49 107.96 0.04 OUTLIER 'General case' 0 CA--C 1.532 0.252 0 C-N-CA 125.651 1.58 . . . . 10.85 111.764 -174.709 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 13.3 p . . . . . 0 C--O 1.253 1.265 0 CA-C-O 115.122 -2.371 . . . . 12.77 109.693 178.017 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.471 0.995 0 N-CA-C 109.492 -1.443 . . . . 16.010000000000002 109.492 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . 0.486 ' O ' ' HE2' ' A' ' 3' ' ' LYS . 7.0 m -147.08 64.08 1.17 Allowed 'General case' 0 CA--C 1.516 -0.334 0 CA-C-N 118.115 0.957 . . . . 15.33 109.429 178.466 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . 0.486 ' HE2' ' O ' ' A' ' 2' ' ' SER . 0.3 OUTLIER -158.8 154.02 25.48 Favored 'General case' 0 N--CA 1.45 -0.457 0 N-CA-C 108.14 -1.059 . . . . 20.57 108.14 -179.15 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 173.37 164.02 27.95 Favored Glycine 0 CA--C 1.519 0.333 0 N-CA-C 108.167 -1.973 . . . . 13.83 108.167 177.322 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 14.4 m -89.37 175.94 0.69 Allowed 'Isoleucine or valine' 0 N--CA 1.445 -0.702 0 N-CA-C 107.911 -1.144 . . . . 13.56 107.911 158.038 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 8.1 pt-20 -82.33 120.76 25.82 Favored 'General case' 0 N--CA 1.45 -0.446 0 CA-C-O 121.499 0.666 . . . . 9.5800000000000001 111.915 -177.561 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -111.32 26.78 10.32 Favored 'General case' 0 N--CA 1.453 -0.324 0 C-N-CA 125.236 1.414 . . . . 8.8699999999999992 110.995 -177.692 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 18.9 mtp180 66.94 -69.51 0.13 Allowed 'General case' 0 N--CA 1.466 0.335 0 C-N-CA 125.133 1.373 . . . . 7.0800000000000001 110.861 -174.571 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 3.5 m120 -48.9 -49.21 40.94 Favored 'General case' 0 C--O 1.224 -0.241 0 O-C-N 121.02 -1.05 . . . . 3.3399999999999999 112.055 177.62 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -75.53 -26.97 58.5 Favored 'General case' 0 C--O 1.218 -0.591 0 C-N-CA 119.273 -0.971 . . . . 2.5600000000000001 111.633 -179.434 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 30.5 t -65.76 -66.56 0.53 Allowed 'General case' 0 N--CA 1.451 -0.419 0 CA-C-N 119.369 0.986 . . . . 2.4300000000000002 109.333 178.622 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . 0.438 ' HA ' HD11 ' A' ' 15' ' ' ILE . 3.8 mp0 -74.55 -30.42 61.74 Favored 'General case' 0 N--CA 1.448 -0.528 0 N-CA-C 109.311 -0.625 . . . . 4.6799999999999997 109.311 -173.938 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -61.81 -53.28 44.55 Favored Glycine 0 CA--C 1.524 0.62 0 N-CA-C 111.045 -0.822 . . . . 0.67000000000000004 111.045 171.566 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 84.3 t80 -57.02 -53.15 61.34 Favored 'General case' 0 CA--C 1.517 -0.319 0 CA-C-N 118.771 1.285 . . . . 3.1899999999999999 110.197 -175.139 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . 0.438 HD11 ' HA ' ' A' ' 12' ' ' GLU . 0.9 OUTLIER -62.99 -33.72 62.26 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.407 0 O-C-N 121.755 -0.59 . . . . 0.51000000000000001 112.194 -179.906 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 1.9 t60 -58.99 -57.51 12.75 Favored 'General case' 0 C--N 1.342 0.259 0 N-CA-C 107.303 -1.369 . . . . 0.60999999999999999 107.303 175.954 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 44.0 mt-10 -55.64 -35.44 65.92 Favored 'General case' 0 C--O 1.222 -0.389 0 C-N-CA 124.262 1.025 . . . . 2.5600000000000001 110.72 -179.805 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 6.2 t80 -58.64 -49.66 76.71 Favored 'General case' 0 N--CA 1.453 -0.292 0 C-N-CA 124.097 0.959 . . . . 2.7799999999999998 109.8 177.521 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -48.52 -46.93 29.73 Favored Glycine 0 CA--C 1.527 0.837 0 N-CA-C 110.959 -0.856 . . . . 0.44 110.959 171.128 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 20' ' ' HIS . . . . . 0.539 ' CE1' ' HB1' ' A' ' 64' ' ' ALA . 1.9 t-160 -62.5 -44.99 95.03 Favored 'General case' 0 N--CA 1.453 -0.299 0 O-C-N 121.516 -0.991 . . . . 1.8799999999999999 111.742 -179.526 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -62.59 -29.56 70.69 Favored 'General case' 0 N--CA 1.451 -0.377 0 O-C-N 121.483 -0.761 . . . . 0.57999999999999996 109.806 -179.695 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 90.1 t -66.29 -40.07 85.87 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.147 0 O-C-N 121.36 -0.838 . . . . 0.79000000000000004 110.697 175.432 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 18.8 t0 -59.36 -30.53 68.47 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-O 121.785 0.802 . . . . 2.0 110.863 173.936 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 11.8 t70 -69.37 -51.58 35.34 Favored 'General case' 0 N--CA 1.451 -0.393 0 N-CA-C 108.258 -1.016 . . . . 1.8700000000000001 108.258 -176.107 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 48.9 t80 -59.38 -50.66 73.12 Favored 'General case' 0 N--CA 1.454 -0.263 0 C-N-CA 123.09 0.556 . . . . 2.6000000000000001 110.512 179.021 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -52.91 -42.45 65.37 Favored 'General case' 0 N--CA 1.451 -0.394 0 N-CA-C 110.285 -0.265 . . . . 1.4099999999999999 110.285 179.671 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -69.67 -46.9 52.18 Favored Glycine 0 C--O 1.226 -0.401 0 N-CA-C 111.464 -0.654 . . . . 1.6499999999999999 111.464 -178.351 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 0.9 OUTLIER -54.09 -47.47 71.71 Favored 'General case' 0 N--CA 1.455 -0.207 0 C-N-CA 123.606 0.762 . . . . 2.52 109.422 -177.298 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -74.31 -33.02 63.08 Favored 'General case' 0 N--CA 1.447 -0.603 0 C-N-CA 123.254 0.621 . . . . 2.04 112.531 -177.821 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 12.3 mt -118.74 37.06 4.2 Favored 'General case' 0 CA--C 1.532 0.257 0 CA-C-N 118.834 0.743 . . . . 2.3799999999999999 110.245 -166.723 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 4.7 t70 -64.9 146.0 55.53 Favored 'General case' 0 CA--C 1.533 0.31 0 C-N-CA 123.244 0.618 . . . . 6.79 110.986 177.997 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . 0.447 ' HA ' ' HE2' ' A' ' 32' ' ' LYS . 0.0 OUTLIER 179.71 -43.44 0.01 OUTLIER 'General case' 0 N--CA 1.464 0.233 0 C-N-CA 126.404 1.882 . . . . 7.3399999999999999 109.33 162.268 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 24.1 t-20 -78.95 168.05 20.26 Favored 'General case' 0 CA--C 1.532 0.288 0 C-N-CA 123.686 0.794 . . . . 9.0600000000000005 110.068 -173.08 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 3.1 mm-40 -66.57 8.04 0.28 Allowed 'General case' 0 CA--C 1.537 0.445 0 N-CA-C 114.194 1.183 . . . . 7.6900000000000004 114.194 177.714 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 18.1 p -142.27 111.9 6.71 Favored 'General case' 0 N--CA 1.447 -0.607 0 N-CA-C 106.882 -1.525 . . . . 6.9000000000000004 106.882 169.3 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -58.64 -54.4 47.44 Favored 'General case' 0 C--O 1.224 -0.266 0 C-N-CA 124.367 1.067 . . . . 6.3799999999999999 108.863 -178.278 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 10.8 mp -51.34 118.67 3.43 Favored 'General case' 0 C--O 1.233 0.226 0 C-N-CA 124.862 1.265 . . . . 2.2599999999999998 109.82 -175.992 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 55.9 t -84.16 75.67 1.11 Allowed 'Isoleucine or valine' 0 N--CA 1.454 -0.253 0 CA-C-O 122.279 1.037 . . . . 3.4100000000000001 108.496 -176.337 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 15.0 t -138.21 -54.44 0.64 Allowed 'General case' 0 N--CA 1.454 -0.27 0 CA-C-N 115.489 -0.778 . . . . 4.5199999999999996 109.601 172.474 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 11.5 p-10 -83.32 62.76 6.88 Favored 'General case' 0 CA--C 1.537 0.469 0 O-C-N 120.787 -1.195 . . . . 5.7699999999999996 111.258 -172.952 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 22.3 t -137.38 -56.94 0.7 Allowed 'General case' 0 CA--C 1.534 0.337 0 O-C-N 121.425 -0.797 . . . . 3.0499999999999998 111.95 -168.841 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 6.6 mmtp -62.94 93.95 0.06 Allowed 'General case' 0 N--CA 1.465 0.314 0 O-C-N 121.311 -0.868 . . . . 6.2400000000000002 109.007 177.51 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 35.2 mttp 73.76 133.69 0.05 OUTLIER 'General case' 0 N--CA 1.464 0.255 0 C-N-CA 127.179 2.192 . . . . 6.2699999999999996 108.347 -170.101 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 7.0 m-85 -59.78 105.81 0.42 Allowed 'General case' 0 N--CA 1.456 -0.166 0 N-CA-C 108.709 -0.848 . . . . 4.79 108.709 176.315 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER 35.47 64.78 0.09 OUTLIER 'Isoleucine or valine' 0 CA--C 1.542 0.664 0 C-N-CA 126.514 1.925 . . . . 2.9700000000000002 111.847 175.272 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 6.3 t70 -103.01 -55.05 2.49 Favored 'General case' 0 N--CA 1.47 0.533 0 CA-C-O 121.775 0.798 . . . . 2.5099999999999998 110.068 -179.392 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 4.5 mm -54.8 -50.02 64.4 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.385 0 C-N-CA 124.901 1.28 . . . . 0.48999999999999999 108.643 -176.418 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 36.1 t80 -66.92 -26.99 67.12 Favored 'General case' 0 N--CA 1.453 -0.314 0 O-C-N 121.617 -0.677 . . . . 0.67000000000000004 112.724 177.067 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . 0.488 ' HA ' ' HE2' ' A' ' 49' ' ' LYS . 0.2 OUTLIER -68.44 -48.59 64.18 Favored 'General case' 0 N--CA 1.452 -0.367 0 O-C-N 120.591 -1.318 . . . . 1.3100000000000001 111.047 -175.994 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 7.6 mm-40 -86.77 -62.17 1.57 Allowed 'General case' 0 C--N 1.33 -0.258 0 N-CA-C 109.059 -0.719 . . . . 2.6499999999999999 109.059 179.155 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 4.2 mm-40 -69.9 -33.58 72.38 Favored 'General case' 0 CA--C 1.535 0.373 0 O-C-N 121.643 -0.661 . . . . 2.0499999999999998 109.546 -167.719 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -68.92 34.97 0.29 Allowed Glycine 0 CA--C 1.53 0.997 0 C-N-CA 125.926 1.727 . . . . 0.38 114.213 169.041 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 23.0 t -146.9 35.94 0.93 Allowed 'General case' 0 N--CA 1.447 -0.601 0 O-C-N 120.917 -1.343 . . . . 1.79 108.845 157.433 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 1.1 t-20 -141.25 -43.58 0.37 Allowed 'General case' 0 CA--C 1.52 -0.204 0 N-CA-C 112.817 0.673 . . . . 1.79 112.817 -173.985 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . 0.524 HD21 ' HB2' ' A' ' 89' ' ' ALA . 17.0 mt -60.58 -37.04 80.04 Favored 'General case' 0 N--CA 1.461 0.124 0 CA-C-O 120.876 0.369 . . . . 0.34999999999999998 111.385 -174.56 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER 178.93 168.86 0.93 Allowed 'General case' 0 C--N 1.33 -0.25 0 C-N-CA 125.386 1.474 . . . . 0.44 107.319 -178.21 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 18.7 m -60.43 -36.42 78.13 Favored 'General case' 0 N--CA 1.454 -0.24 0 O-C-N 121.742 -0.599 . . . . 1.1100000000000001 110.569 168.701 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -67.81 -8.34 35.18 Favored 'General case' 0 N--CA 1.465 0.308 0 C-N-CA 122.806 0.443 . . . . 1.1699999999999999 112.066 174.209 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -92.47 -0.39 70.03 Favored Glycine 0 N--CA 1.443 -0.846 0 CA-C-O 118.787 -1.007 . . . . 0.46999999999999997 110.825 175.2 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 1.2 ttt180 -123.11 -2.93 8.57 Favored 'General case' 0 C--O 1.227 -0.087 0 CA-C-N 119.003 1.401 . . . . 2.2799999999999998 112.175 -178.746 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 12.1 p -68.63 -106.72 0.0 OUTLIER 'General case' 0 N--CA 1.453 -0.275 0 C-N-CA 125.038 1.335 . . . . 1.51 109.644 175.877 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 2.2 t-20 -93.25 151.22 19.94 Favored 'General case' 0 N--CA 1.447 -0.599 0 N-CA-C 108.312 -0.995 . . . . 2.4500000000000002 108.312 177.071 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 22.7 tt0 -61.23 -29.49 69.86 Favored 'General case' 0 CA--C 1.535 0.401 0 CA-C-N 118.769 0.713 . . . . 3.1499999999999999 109.974 176.914 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 64' ' ' ALA . . . . . 0.539 ' HB1' ' CE1' ' A' ' 20' ' ' HIS . . . -64.91 -36.43 84.33 Favored 'General case' 0 N--CA 1.452 -0.357 0 N-CA-C 112.797 0.666 . . . . 0.52000000000000002 112.797 174.959 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 11.3 mt-10 -75.47 -37.75 60.07 Favored 'General case' 0 CA--C 1.511 -0.531 0 O-C-N 121.367 -0.833 . . . . 2.2799999999999998 110.178 178.473 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 48.8 t80 -53.2 -51.54 61.79 Favored 'General case' 0 N--CA 1.447 -0.607 0 C-N-CA 123.604 0.762 . . . . 0.33000000000000002 110.472 173.685 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 84.8 t80 -60.59 -46.71 89.22 Favored 'General case' 0 CA--C 1.534 0.35 0 CA-C-O 121.204 0.526 . . . . 0.46999999999999997 111.121 177.512 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -60.81 -50.96 71.33 Favored 'General case' 0 CA--C 1.541 0.606 0 O-C-N 121.4 -0.813 . . . . 0.29999999999999999 112.342 -176.553 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 24.8 mm-40 -54.01 -43.71 70.32 Favored 'General case' 0 CA--C 1.52 -0.192 0 C-N-CA 124.425 1.09 . . . . 4.3499999999999996 110.487 169.6 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -56.36 -42.25 77.49 Favored 'General case' 0 N--CA 1.451 -0.413 0 CA-C-O 118.414 -0.803 . . . . 0.33000000000000002 109.768 -178.649 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 22.9 t80 -58.09 -52.21 66.51 Favored 'General case' 0 N--CA 1.465 0.323 0 CA-C-N 119.233 0.924 . . . . 2.9900000000000002 111.578 173.055 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 28.1 ttt180 -46.8 -51.2 16.95 Favored 'General case' 0 CA--C 1.533 0.303 0 C-N-CA 122.738 0.415 . . . . 2.21 110.148 177.584 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . 0.634 HD12 HG23 ' A' ' 85' ' ' VAL . 0.1 OUTLIER -72.51 -30.19 64.27 Favored 'General case' 0 C--N 1.327 -0.377 0 C-N-CA 124.698 1.199 . . . . 0.44 111.035 -176.132 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 4.0 tmm? -62.78 -37.91 88.52 Favored 'General case' 0 C--N 1.33 -0.245 0 C-N-CA 123.784 0.834 . . . . 2.6299999999999999 111.015 -179.374 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 23.4 p80 -87.57 -47.59 8.59 Favored 'General case' 0 C--O 1.224 -0.278 0 CA-C-O 116.832 -1.556 . . . . 1.0700000000000001 109.826 179.201 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 5.2 m -0.09 104.75 0.01 OUTLIER 'General case' 0 N--CA 1.47 0.557 0 C-N-CA 128.297 2.639 . . . . 1.05 113.624 -173.454 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 2.1 p -45.7 -41.62 10.71 Favored 'General case' 0 N--CA 1.452 -0.372 0 C-N-CA 125.685 1.594 . . . . 0.96999999999999997 111.621 -177.086 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 59.4 t0 -69.48 103.5 2.06 Favored 'General case' 0 N--CA 1.455 -0.223 0 C-N-CA 118.589 -1.244 . . . . 2.1099999999999999 109.129 167.381 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 1.7 p80 -42.03 -36.57 1.16 Allowed 'General case' 0 CA--C 1.53 0.177 0 C-N-CA 124.462 1.105 . . . . 4.4199999999999999 112.63 172.581 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -58.1 -48.84 78.97 Favored 'General case' 0 N--CA 1.451 -0.38 0 C-N-CA 122.644 0.378 . . . . 0.65000000000000002 111.011 178.91 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -53.62 -38.55 64.13 Favored 'General case' 0 C--O 1.232 0.181 0 C-N-CA 123.407 0.683 . . . . 3.8500000000000001 110.964 179.073 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 3.3 mtp-105 -65.4 -51.4 60.65 Favored 'General case' 0 C--N 1.328 -0.334 0 C-N-CA 120.167 -0.613 . . . . 3.1099999999999999 109.702 178.383 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . 0.415 HD13 ' HA ' ' A' ' 83' ' ' LEU . 0.8 OUTLIER -60.53 -26.7 67.07 Favored 'General case' 0 N--CA 1.452 -0.344 0 CA-C-O 118.656 -0.688 . . . . 0.51000000000000001 112.695 177.752 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 37.6 mttt -65.14 -42.39 93.86 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 119.691 1.132 . . . . 1.6000000000000001 108.489 175.814 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 85' ' ' VAL . . . . . 0.634 HG23 HD12 ' A' ' 73' ' ' LEU . 78.5 t -62.77 -60.34 2.91 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.485 0 CA-C-O 117.4 -1.286 . . . . 0.40000000000000002 111.612 171.138 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 11.9 mt-30 -49.11 -46.55 45.01 Favored 'General case' 0 N--CA 1.468 0.446 0 CA-C-N 121.19 1.814 . . . . 1.9399999999999999 111.619 -175.86 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 18.5 tttt -60.25 -52.33 65.73 Favored 'General case' 0 N--CA 1.449 -0.494 0 C-N-CA 123.737 0.815 . . . . 2.3599999999999999 110.57 178.803 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 19.3 m-20 -84.25 5.38 26.86 Favored 'General case' 0 CA--C 1.533 0.293 0 C-N-CA 123.296 0.638 . . . . 1.0700000000000001 111.516 -174.629 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 89' ' ' ALA . . . . . 0.524 ' HB2' HD21 ' A' ' 55' ' ' LEU . . . -164.47 77.93 1.47 Allowed Pre-proline 0 N--CA 1.448 -0.553 0 C-N-CA 125.324 1.45 . . . . 0.38 108.894 -177.696 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 96.8 Cg_endo -80.65 47.42 2.55 Favored 'Trans proline' 0 CA--C 1.539 0.76 0 C-N-CA 124.211 3.274 . . . . 1.8100000000000001 111.624 -175.101 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 4.0 ptmt -169.06 -51.14 0.02 OUTLIER 'General case' 0 C--O 1.225 -0.233 0 C-N-CA 126.436 1.894 . . . . 2.4399999999999999 109.643 -176.889 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 3.2 m -53.19 -45.61 68.66 Favored 'General case' 0 N--CA 1.464 0.231 0 CA-C-N 119.09 0.859 . . . . 0.32000000000000001 111.817 179.913 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 9.1 t80 -60.2 -47.27 86.69 Favored 'General case' 0 CA--C 1.514 -0.408 0 CA-C-O 121.572 0.701 . . . . 2.4900000000000002 110.039 178.527 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 2.0 tt0 -57.89 -30.14 65.62 Favored 'General case' 0 N--CA 1.442 -0.834 0 CA-C-N 114.746 -1.115 . . . . 1.9299999999999999 110.471 179.253 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 3.9 t80 -64.49 -57.41 9.3 Favored 'General case' 0 N--CA 1.455 -0.196 0 C-N-CA 124.715 1.206 . . . . 0.95999999999999996 109.917 -175.723 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 3.2 mp -58.79 -41.99 84.18 Favored 'Isoleucine or valine' 0 C--O 1.226 -0.136 0 N-CA-C 108.326 -0.99 . . . . 0.78000000000000003 108.326 176.108 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 7.7 t30 -59.66 -31.34 69.45 Favored 'General case' 0 CA--C 1.536 0.44 0 N-CA-C 111.617 0.228 . . . . 1.4199999999999999 111.617 -179.496 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 2.4 t0 -66.2 -53.05 42.02 Favored 'General case' 0 C--N 1.338 0.095 0 C-N-CA 126.132 1.773 . . . . 2.3100000000000001 108.829 175.672 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 52.5 mm-40 -86.15 70.37 10.56 Favored 'General case' 0 N--CA 1.452 -0.368 0 CA-C-O 122.501 1.143 . . . . 3.0 110.292 -177.253 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 7.3 tp -69.17 110.02 2.39 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.45 0 CA-C-N 115.464 -0.789 . . . . 3.7599999999999998 109.393 176.688 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 22.2 tptt -148.8 96.84 2.63 Favored 'General case' 0 N--CA 1.458 -0.041 0 O-C-N 120.776 -1.203 . . . . 9.4499999999999993 110.011 171.197 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 102' ' ' PHE . . . . . . . . . . . . . 72.4 m-85 -77.73 79.42 4.22 Favored 'General case' 0 N--CA 1.455 -0.217 0 N-CA-C 109.051 -0.722 . . . . 8.7699999999999996 109.051 172.922 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 3.5 tp -81.21 138.96 18.75 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.198 0 N-CA-C 107.095 -1.446 . . . . 4.0800000000000001 107.095 168.863 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 104' ' ' ILE . . . . . . . . . . . . . 19.1 tt -155.93 120.02 0.46 Allowed 'Isoleucine or valine' 0 N--CA 1.453 -0.282 0 N-CA-C 108.327 -0.99 . . . . 7.9800000000000004 108.327 175.278 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 5.1 p-10 -164.68 166.63 19.86 Favored 'General case' 0 C--N 1.33 -0.277 0 N-CA-C 107.589 -1.263 . . . . 9.5999999999999996 107.589 176.165 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 64.2 m . . . . . 0 C--O 1.252 1.219 0 CA-C-O 116.582 -1.675 . . . . 12.199999999999999 107.425 160.011 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.472 1.078 0 N-CA-C 108.839 -1.704 . . . . 10.890000000000001 108.839 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 18.9 m -143.04 146.37 33.77 Favored 'General case' 0 C--O 1.238 0.497 0 N-CA-C 108.585 -0.895 . . . . 12.1 108.585 173.482 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -170.06 112.12 0.45 Allowed 'General case' 0 CA--C 1.529 0.167 0 CA-C-N 118.229 0.468 . . . . 14.77 110.66 172.842 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 92.47 -156.4 23.27 Favored Glycine 0 C--N 1.334 0.447 0 N-CA-C 110.613 -0.995 . . . . 12.199999999999999 110.613 175.992 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 34.3 m -80.22 -160.15 0.05 OUTLIER 'Isoleucine or valine' 0 N--CA 1.442 -0.843 0 N-CA-C 107.652 -1.24 . . . . 12.98 107.652 161.826 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -103.07 122.69 45.18 Favored 'General case' 0 N--CA 1.443 -0.812 0 N-CA-C 108.572 -0.899 . . . . 8.6500000000000004 108.572 173.365 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . 0.41 HD22 ' N ' ' A' ' 7' ' ' LEU . 1.9 mm? -111.7 35.73 3.55 Favored 'General case' 0 N--CA 1.454 -0.26 0 C-N-CA 125.409 1.484 . . . . 8.2400000000000002 108.448 -177.841 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER 71.15 -60.74 0.5 Allowed 'General case' 0 C--O 1.222 -0.354 0 C-N-CA 125.663 1.585 . . . . 9.6400000000000006 109.893 -162.518 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 32.5 m-20 -55.05 -45.26 75.26 Favored 'General case' 0 C--O 1.224 -0.275 0 CA-C-N 119.279 0.945 . . . . 3.3100000000000001 112.313 -174.246 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 5.9 t70 -74.34 -25.71 59.7 Favored 'General case' 0 C--O 1.223 -0.327 0 C-N-CA 119.009 -1.076 . . . . 2.6899999999999999 111.2 -178.735 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -68.88 -65.07 0.75 Allowed 'General case' 0 CA--C 1.534 0.327 0 CA-C-O 121.975 0.893 . . . . 1.99 109.632 175.835 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . 0.459 ' HA ' HD11 ' A' ' 15' ' ' ILE . 49.5 mt-10 -61.72 -38.04 86.41 Favored 'General case' 0 N--CA 1.455 -0.196 0 C-N-CA 126.376 1.87 . . . . 3.3300000000000001 109.038 -176.236 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -62.55 -56.35 22.05 Favored Glycine 0 N--CA 1.45 -0.423 0 C-N-CA 124.701 1.143 . . . . 0.64000000000000001 110.295 176.441 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 39.8 t80 -52.34 -56.42 15.0 Favored 'General case' 0 C--O 1.225 -0.197 0 CA-C-N 117.911 0.855 . . . . 3.6899999999999999 110.206 -178.02 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . 0.459 HD11 ' HA ' ' A' ' 12' ' ' GLU . 0.7 OUTLIER -65.72 -31.93 55.92 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.21 0 O-C-N 121.761 -0.587 . . . . 0.38 112.111 -177.778 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 9.1 t60 -60.78 -54.74 41.46 Favored 'General case' 0 CA--C 1.532 0.254 0 N-CA-C 107.388 -1.338 . . . . 0.5 107.388 177.647 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 22.4 mt-10 -53.2 -39.37 63.65 Favored 'General case' 0 C--O 1.222 -0.353 0 C-N-CA 123.773 0.829 . . . . 2.1400000000000001 110.639 174.977 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 5.1 t80 -58.05 -47.67 82.43 Favored 'General case' 0 CA--C 1.52 -0.182 0 C-N-CA 123.757 0.823 . . . . 2.8399999999999999 110.259 -178.407 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -49.07 -48.73 31.29 Favored Glycine 0 CA--C 1.524 0.621 0 N-CA-C 110.508 -1.037 . . . . 0.42999999999999999 110.508 171.068 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 20' ' ' HIS . . . . . 0.505 ' CE1' ' HB1' ' A' ' 64' ' ' ALA . 2.0 t60 -60.69 -45.53 93.84 Favored 'General case' 0 N--CA 1.451 -0.384 0 O-C-N 122.002 -0.705 . . . . 1.8400000000000001 112.0 -178.4 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -66.32 -27.24 67.76 Favored 'General case' 0 N--CA 1.452 -0.354 0 O-C-N 121.606 -0.684 . . . . 0.62 110.032 -179.599 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 55.8 t -73.44 -37.83 51.7 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.185 0 C-N-CA 119.406 -0.918 . . . . 0.79000000000000004 110.187 174.586 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 7.0 t0 -57.73 -31.15 66.16 Favored 'General case' 0 N--CA 1.453 -0.319 0 C-N-CA 122.718 0.407 . . . . 1.8899999999999999 110.954 174.464 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 9.9 t70 -63.52 -54.82 30.35 Favored 'General case' 0 N--CA 1.457 -0.093 0 N-CA-C 108.098 -1.075 . . . . 2.0299999999999998 108.098 -176.125 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 0.9 OUTLIER -54.89 -51.21 66.69 Favored 'General case' 0 N--CA 1.456 -0.168 0 CA-C-N 115.308 -0.86 . . . . 2.5800000000000001 109.362 177.183 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -56.16 -40.33 73.69 Favored 'General case' 0 N--CA 1.447 -0.576 0 CA-C-O 119.1 -0.476 . . . . 1.0900000000000001 111.081 -177.167 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -84.89 -14.69 69.21 Favored Glycine 0 CA--C 1.525 0.663 0 C-N-CA 123.723 0.678 . . . . 1.29 112.403 -174.977 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 1.2 t80 -74.95 -45.05 44.95 Favored 'General case' 0 N--CA 1.453 -0.291 0 CA-C-N 117.898 0.849 . . . . 2.0099999999999998 108.952 174.178 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 3.2 mm? -82.64 -36.41 26.07 Favored 'General case' 0 N--CA 1.449 -0.502 0 C-N-CA 125.151 1.38 . . . . 1.6399999999999999 112.658 -177.126 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 10.2 mt -124.66 124.2 41.68 Favored 'General case' 0 N--CA 1.452 -0.338 0 N-CA-C 107.172 -1.418 . . . . 2.2400000000000002 107.172 -168.461 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 2.2 t70 69.33 169.86 0.3 Allowed 'General case' 0 CA--C 1.54 0.581 0 N-CA-C 109.122 -0.696 . . . . 5.0800000000000001 109.122 -165.254 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 32.7 mtpt -156.11 119.75 4.37 Favored 'General case' 0 N--CA 1.463 0.177 0 N-CA-C 107.004 -1.48 . . . . 9.2899999999999991 107.004 172.075 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 43.5 t-20 -152.53 174.75 13.53 Favored 'General case' 0 CA--C 1.532 0.28 0 N-CA-C 107.471 -1.307 . . . . 7.1299999999999999 107.471 178.862 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 10.2 tt0 -64.5 -11.95 39.2 Favored 'General case' 0 CA--C 1.537 0.458 0 CA-C-N 119.595 1.089 . . . . 9.4900000000000002 111.449 173.062 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -121.65 99.26 6.36 Favored 'General case' 0 N--CA 1.446 -0.659 0 N-CA-C 105.614 -1.995 . . . . 7.1900000000000004 105.614 171.87 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 1.2 p30 -78.5 81.07 4.86 Favored 'General case' 0 C--N 1.328 -0.365 0 C-N-CA 125.664 1.585 . . . . 6.8099999999999996 109.194 179.397 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 5.4 mp -141.59 140.68 33.41 Favored 'General case' 0 CA--C 1.53 0.18 0 N-CA-C 107.197 -1.409 . . . . 2.71 107.197 174.36 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 6.0 p -83.11 34.15 0.05 OUTLIER 'Isoleucine or valine' 0 CA--C 1.538 0.493 0 C-N-CA 124.553 1.141 . . . . 2.6299999999999999 110.941 -177.523 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 71.7 p -115.61 79.62 1.32 Allowed 'General case' 0 N--CA 1.449 -0.489 0 O-C-N 120.54 -1.35 . . . . 4.0300000000000002 108.068 -170.49 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 19.1 t-20 -173.16 -42.78 0.01 OUTLIER 'General case' 0 C--N 1.333 -0.133 0 C-N-CA 123.815 0.846 . . . . 5.8799999999999999 109.712 -179.039 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 65.9 p -65.0 166.48 9.27 Favored 'General case' 0 CA--C 1.541 0.603 0 C-N-CA 126.012 1.725 . . . . 3.4300000000000002 112.311 -172.577 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 56.7 mttm 49.98 82.5 0.05 Allowed 'General case' 0 N--CA 1.47 0.548 0 C-N-CA 125.98 1.712 . . . . 6.0700000000000003 112.015 -168.39 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER 67.51 116.99 0.03 OUTLIER 'General case' 0 N--CA 1.468 0.475 0 C-N-CA 126.84 2.056 . . . . 6.9699999999999998 108.031 -168.76 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 2.2 m-85 -47.35 109.07 0.18 Allowed 'General case' 0 CA--C 1.527 0.092 0 C-N-CA 123.755 0.822 . . . . 5.5099999999999998 109.435 178.05 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 47.6 pt 44.14 72.2 0.08 OUTLIER 'Isoleucine or valine' 0 C--O 1.219 -0.517 0 C-N-CA 125.751 1.621 . . . . 2.71 111.293 176.262 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 10.2 t70 -102.07 -59.87 1.63 Allowed 'General case' 0 N--CA 1.466 0.373 0 O-C-N 120.578 -1.326 . . . . 2.5600000000000001 110.451 -173.253 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 2.9 mm -51.42 -48.16 34.55 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.226 0 C-N-CA 126.911 2.084 . . . . 0.44 109.526 176.78 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 48' ' ' PHE . . . . . 0.407 ' O ' ' HA3' ' A' ' 52' ' ' GLY . 20.0 t80 -63.42 -31.92 73.21 Favored 'General case' 0 N--CA 1.45 -0.436 0 O-C-N 121.039 -1.038 . . . . 0.51000000000000001 112.229 177.917 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . 0.51 ' HA ' ' HE2' ' A' ' 49' ' ' LYS . 10.8 mmpt? -69.97 -45.52 67.18 Favored 'General case' 0 C--N 1.33 -0.265 0 O-C-N 119.662 -1.899 . . . . 1.1100000000000001 110.543 -177.954 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 7.2 mm-40 -79.95 -65.76 0.96 Allowed 'General case' 0 N--CA 1.452 -0.344 0 CA-C-O 121.901 0.858 . . . . 2.3199999999999998 109.526 -176.906 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 14.0 mp0 -73.53 -28.32 61.82 Favored 'General case' 0 CA--C 1.533 0.314 0 O-C-N 121.492 -0.755 . . . . 2.6499999999999999 110.64 -172.33 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . 0.407 ' HA3' ' O ' ' A' ' 48' ' ' PHE . . . -68.99 33.5 0.29 Allowed Glycine 0 CA--C 1.533 1.158 0 C-N-CA 124.944 1.259 . . . . 0.34000000000000002 114.498 168.285 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 32.6 t -149.61 44.16 0.93 Allowed 'General case' 0 N--CA 1.447 -0.58 0 O-C-N 120.79 -1.418 . . . . 1.5800000000000001 107.56 158.84 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -148.48 -42.41 0.16 Allowed 'General case' 0 CA--C 1.516 -0.334 0 N-CA-C 114.003 1.112 . . . . 2.1000000000000001 114.003 -176.078 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 19.0 mt -61.89 -38.69 89.27 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-O 120.954 0.407 . . . . 0.40999999999999998 110.778 -176.737 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 1.2 t 178.63 172.76 0.73 Allowed 'General case' 0 CA--C 1.531 0.236 0 C-N-CA 125.41 1.484 . . . . 0.47999999999999998 107.678 -176.325 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 10.7 m -60.86 -34.66 74.94 Favored 'General case' 0 N--CA 1.453 -0.303 0 O-C-N 121.671 -0.643 . . . . 0.95999999999999996 110.408 168.45 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 1.6 m-85 -67.5 -10.82 55.25 Favored 'General case' 0 N--CA 1.464 0.242 0 N-CA-C 112.332 0.493 . . . . 1.45 112.332 173.831 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -83.1 -9.37 84.25 Favored Glycine 0 N--CA 1.443 -0.879 0 N-CA-C 110.825 -0.91 . . . . 0.39000000000000001 110.825 173.775 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 3.4 tmt_? -120.96 -6.39 9.54 Favored 'General case' 0 CA--C 1.526 0.03 0 CA-C-N 118.994 1.397 . . . . 2.5499999999999998 112.767 -173.81 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 19.5 p -67.56 -145.32 0.01 OUTLIER 'General case' 0 CA--C 1.54 0.575 0 C-N-CA 124.689 1.196 . . . . 0.75 108.947 169.277 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 32.5 m-80 -62.36 148.75 44.27 Favored 'General case' 0 N--CA 1.456 -0.158 0 O-C-N 119.318 -2.114 . . . . 2.21 109.261 178.269 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 58.2 tt0 -60.37 -27.86 67.74 Favored 'General case' 0 CA--C 1.537 0.449 0 CA-C-O 121.819 0.819 . . . . 2.7799999999999998 111.065 -179.565 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 64' ' ' ALA . . . . . 0.505 ' HB1' ' CE1' ' A' ' 20' ' ' HIS . . . -59.32 -40.92 87.79 Favored 'General case' 0 N--CA 1.452 -0.362 0 C-N-CA 124.643 1.177 . . . . 0.5 112.507 171.564 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 10.4 mt-10 -70.41 -47.09 62.42 Favored 'General case' 0 N--CA 1.446 -0.631 0 CA-C-O 118.211 -0.899 . . . . 2.04 109.828 176.927 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 48.7 t80 -45.86 -51.92 12.21 Favored 'General case' 0 N--CA 1.454 -0.249 0 C-N-CA 124.042 0.937 . . . . 0.34000000000000002 111.576 175.23 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 60.1 t80 -65.11 -43.81 90.81 Favored 'General case' 0 CA--C 1.538 0.5 0 O-C-N 121.426 -0.796 . . . . 0.38 110.98 178.27 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -62.73 -53.89 47.47 Favored 'General case' 0 CA--C 1.541 0.611 0 O-C-N 121.023 -1.048 . . . . 0.28000000000000003 113.156 -176.23 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -57.78 -40.15 79.14 Favored 'General case' 0 C--N 1.332 -0.154 0 O-C-N 120.435 -1.416 . . . . 3.8300000000000001 110.738 171.388 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -56.76 -39.41 73.95 Favored 'General case' 0 N--CA 1.451 -0.378 0 CA-C-O 118.282 -0.866 . . . . 0.46000000000000002 110.951 176.899 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 58.6 t80 -57.61 -49.82 75.18 Favored 'General case' 0 N--CA 1.465 0.299 0 CA-C-N 120.195 1.361 . . . . 3.8500000000000001 111.05 172.375 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 38.0 ttp85 -49.5 -57.7 6.55 Favored 'General case' 0 C--N 1.341 0.218 0 N-CA-C 109.235 -0.654 . . . . 3.27 109.235 178.256 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . 0.592 ' HB3' HG21 ' A' ' 85' ' ' VAL . 0.1 OUTLIER -64.09 -29.6 70.72 Favored 'General case' 0 N--CA 1.451 -0.409 0 C-N-CA 124.34 1.056 . . . . 0.5 110.834 -174.704 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 1.4 ttp -60.7 -41.44 95.19 Favored 'General case' 0 C--O 1.234 0.271 0 C-N-CA 123.042 0.537 . . . . 2.3999999999999999 110.116 -179.582 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 75' ' ' HIS . . . . . 0.419 ' CE1' HD12 ' A' ' 15' ' ' ILE . 5.8 p80 -97.48 -9.79 26.53 Favored 'General case' 0 N--CA 1.454 -0.266 0 CA-C-O 116.238 -1.839 . . . . 0.88 113.97 -177.598 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 8.0 m -36.19 123.78 0.75 Allowed 'General case' 0 CA--C 1.516 -0.363 0 CA-C-N 120.363 1.438 . . . . 1.0800000000000001 111.505 -169.026 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 2.1 p -48.95 -42.82 38.75 Favored 'General case' 0 N--CA 1.45 -0.467 0 CA-C-N 113.318 -1.765 . . . . 1.0700000000000001 109.068 -179.791 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 14.9 t0 -70.52 104.19 2.7 Favored 'General case' 0 N--CA 1.445 -0.705 0 CA-C-O 122.439 1.114 . . . . 1.78 109.764 165.879 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 18.1 p-80 -45.39 -38.84 6.29 Favored 'General case' 0 N--CA 1.453 -0.284 0 CA-C-N 115.064 -0.971 . . . . 4.3399999999999999 112.763 170.909 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -63.35 -44.64 94.26 Favored 'General case' 0 N--CA 1.451 -0.391 0 O-C-N 121.537 -0.727 . . . . 0.70999999999999996 110.179 -177.82 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 1.8 tt0 -47.61 -43.16 25.54 Favored 'General case' 0 C--O 1.231 0.127 0 C-N-CA 123.948 0.899 . . . . 2.7599999999999998 110.389 175.185 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 4.5 mtp180 -62.79 -51.0 68.78 Favored 'General case' 0 CA--C 1.516 -0.359 0 N-CA-C 108.774 -0.824 . . . . 2.7000000000000002 108.774 -179.405 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 1.6 mm? -63.68 -18.62 64.17 Favored 'General case' 0 N--CA 1.455 -0.211 0 CA-C-O 118.194 -0.907 . . . . 0.45000000000000001 113.355 176.664 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 1.9 mptm? -65.93 -47.46 74.65 Favored 'General case' 0 CA--C 1.521 -0.164 0 CA-C-N 120.856 1.662 . . . . 1.8 107.998 169.234 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 85' ' ' VAL . . . . . 0.592 HG21 ' HB3' ' A' ' 73' ' ' LEU . 84.8 t -60.58 -59.07 4.74 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.6 0 CA-C-O 118.401 -0.809 . . . . 0.45000000000000001 110.206 175.19 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -52.69 -48.62 66.42 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 120.075 1.307 . . . . 2.3199999999999998 111.959 -175.803 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 18.5 pttt -65.19 -41.07 94.91 Favored 'General case' 0 CA--C 1.533 0.32 0 O-C-N 120.931 -1.106 . . . . 2.6600000000000001 110.676 -177.975 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 37.8 m-20 -74.81 -20.68 59.67 Favored 'General case' 0 CA--C 1.534 0.335 0 C-N-CA 122.712 0.405 . . . . 0.91000000000000003 111.013 -179.208 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -157.43 67.11 3.88 Favored Pre-proline 0 N--CA 1.45 -0.459 0 C-N-CA 125.932 1.693 . . . . 0.5 108.959 -163.549 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 25.4 Cg_endo -60.33 -28.84 87.6 Favored 'Trans proline' 0 N--CA 1.455 -0.786 0 C-N-CA 122.255 1.97 . . . . 2.5600000000000001 110.919 -173.486 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -89.31 -43.8 10.69 Favored 'General case' 0 N--CA 1.451 -0.387 0 C-N-CA 126.215 1.806 . . . . 2.25 111.941 -174.561 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 4.9 m -56.86 -44.52 82.26 Favored 'General case' 0 N--CA 1.465 0.28 0 CA-C-N 120.168 1.349 . . . . 0.39000000000000001 110.909 178.791 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 13.5 t80 -55.39 -49.42 72.39 Favored 'General case' 0 CA--C 1.512 -0.498 0 C-N-CA 120.123 -0.631 . . . . 1.8400000000000001 110.631 176.008 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 9.8 tt0 -59.22 -30.09 67.98 Favored 'General case' 0 N--CA 1.445 -0.693 0 CA-C-N 115.594 -0.73 . . . . 2.23 110.894 -179.508 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 4.6 t80 -61.46 -57.86 10.47 Favored 'General case' 0 C--O 1.231 0.12 0 C-N-CA 123.781 0.833 . . . . 1.1599999999999999 109.047 -176.687 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 3.4 mp -58.45 -42.48 84.39 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.254 0 N-CA-C 108.681 -0.859 . . . . 0.88 108.681 175.983 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -57.44 -35.69 70.44 Favored 'General case' 0 CA--C 1.532 0.266 0 CA-C-N 118.445 0.566 . . . . 1.97 111.515 -177.73 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -70.31 -39.88 74.53 Favored 'General case' 0 CA--C 1.532 0.253 0 C-N-CA 123.509 0.724 . . . . 2.0899999999999999 109.416 179.263 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 7.6 mm-40 -65.19 -60.48 2.96 Favored 'General case' 0 CA--C 1.535 0.393 0 C-N-CA 124.413 1.085 . . . . 3.1499999999999999 112.428 179.601 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 1.2 pt -70.45 86.84 0.27 Allowed 'Isoleucine or valine' 0 CA--C 1.527 0.074 0 O-C-N 121.478 -0.764 . . . . 6.0099999999999998 111.135 -172.034 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 8.5 tttt -134.05 109.42 8.95 Favored 'General case' 0 N--CA 1.45 -0.457 0 N-CA-C 107.738 -1.208 . . . . 10.5 107.738 -171.991 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 102' ' ' PHE . . . . . . . . . . . . . 30.6 p90 42.1 29.92 0.16 Allowed 'General case' 0 CA--C 1.537 0.462 0 C-N-CA 126.16 1.784 . . . . 8.4800000000000004 113.609 -177.754 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 11.2 tp -97.85 65.18 0.31 Allowed 'Isoleucine or valine' 0 N--CA 1.454 -0.238 0 CA-C-O 122.073 0.94 . . . . 5.3700000000000001 108.719 -170.933 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 104' ' ' ILE . . . . . . . . . . . . . 39.3 pt -131.06 154.67 41.08 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.134 0 N-CA-C 109.042 -0.725 . . . . 8.9299999999999997 109.042 -177.698 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 1.2 t30 -153.55 116.85 4.6 Favored 'General case' 0 N--CA 1.451 -0.384 0 N-CA-C 107.155 -1.424 . . . . 7.4100000000000001 107.155 175.088 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 14.1 p . . . . . 0 C--O 1.247 0.921 0 N-CA-C 106.871 -1.529 . . . . 9.0999999999999996 106.871 -179.162 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.468 0.797 0 N-CA-C 109.586 -1.405 . . . . 17.73 109.586 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 2.7 p -65.88 148.38 51.87 Favored 'General case' 0 N--CA 1.451 -0.409 0 C-N-CA 124.755 1.222 . . . . 17.039999999999999 111.911 -173.487 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 5.2 ptpt -171.06 170.8 6.05 Favored 'General case' 0 N--CA 1.465 0.305 0 C-N-CA 125.77 1.628 . . . . 21.57 108.032 166.058 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 148.73 177.08 22.65 Favored Glycine 0 C--N 1.332 0.358 0 N-CA-C 110.111 -1.196 . . . . 15.83 110.111 172.878 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 21.6 m -83.91 -160.27 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.445 -0.715 0 N-CA-C 108.912 -0.773 . . . . 16.890000000000001 108.912 170.952 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 10.6 pt-20 -85.25 115.44 23.03 Favored 'General case' 0 N--CA 1.446 -0.64 0 CA-C-O 122.575 1.179 . . . . 12.34 110.958 173.297 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . 0.459 ' H ' HD22 ' A' ' 7' ' ' LEU . 0.0 OUTLIER -146.99 50.6 1.1 Allowed 'General case' 0 N--CA 1.447 -0.596 0 C-N-CA 126.199 1.799 . . . . 10.949999999999999 107.461 173.687 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 38.5 mtp180 53.86 39.75 30.75 Favored 'General case' 0 C--O 1.226 -0.182 0 C-N-CA 124.133 0.973 . . . . 6.3700000000000001 111.996 -174.9 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 3.3 m-20 -52.8 -31.6 39.55 Favored 'General case' 0 C--O 1.219 -0.53 0 N-CA-C 112.374 0.509 . . . . 4.2599999999999998 112.374 -179.108 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 2.6 t70 -62.46 -55.69 25.2 Favored 'General case' 0 C--N 1.324 -0.533 0 C-N-CA 123.058 0.543 . . . . 2.3399999999999999 111.27 175.199 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 12.1 t -71.05 -48.95 49.88 Favored 'General case' 0 C--N 1.33 -0.248 0 N-CA-C 109.338 -0.616 . . . . 1.8999999999999999 109.338 -171.651 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -67.39 -34.35 77.1 Favored 'General case' 0 C--O 1.221 -0.436 0 N-CA-C 107.957 -1.127 . . . . 5.8600000000000003 107.957 179.661 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -60.35 -46.42 94.34 Favored Glycine 0 C--O 1.22 -0.724 0 N-CA-C 109.711 -1.355 . . . . 1.1699999999999999 109.711 178.866 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -57.56 -57.48 12.5 Favored 'General case' 0 N--CA 1.454 -0.271 0 CA-C-N 118.422 1.111 . . . . 3.0299999999999998 110.312 -177.174 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . 0.456 HD12 ' CE1' ' A' ' 75' ' ' HIS . 0.4 OUTLIER -66.91 -31.59 54.14 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.336 0 O-C-N 121.265 -0.897 . . . . 0.67000000000000004 111.849 -176.933 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 2.5 t-160 -63.32 -57.64 9.74 Favored 'General case' 0 N--CA 1.45 -0.46 0 N-CA-C 106.878 -1.527 . . . . 0.77000000000000002 106.878 -179.411 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 42.4 mt-10 -57.88 -32.51 67.77 Favored 'General case' 0 N--CA 1.446 -0.641 0 C-N-CA 124.573 1.149 . . . . 2.96 110.552 177.408 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 4.3 t80 -55.95 -49.75 72.67 Favored 'General case' 0 C--N 1.332 -0.161 0 CA-C-N 120.388 1.449 . . . . 3.21 110.02 174.481 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -51.95 -47.11 54.74 Favored Glycine 0 CA--C 1.526 0.749 0 N-CA-C 111.308 -0.717 . . . . 0.76000000000000001 111.308 173.499 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 20' ' ' HIS . . . . . 0.597 ' CE1' ' HB1' ' A' ' 64' ' ' ALA . 2.4 t-160 -65.89 -50.66 63.68 Favored 'General case' 0 N--CA 1.452 -0.348 0 O-C-N 121.608 -0.936 . . . . 1.96 111.69 -174.374 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -57.54 -31.2 65.86 Favored 'General case' 0 N--CA 1.446 -0.647 0 C-N-CA 124.672 1.189 . . . . 0.68000000000000005 109.624 -179.184 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 71.4 t -67.69 -45.84 83.9 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.238 0 C-N-CA 118.663 -1.215 . . . . 1.05 110.944 173.439 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 2.2 t70 -59.77 -28.27 67.26 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 121.136 0.494 . . . . 2.1800000000000002 111.57 175.217 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . 0.55 ' HA ' HD13 ' A' ' 37' ' ' LEU . 11.2 t70 -74.45 -50.26 19.1 Favored 'General case' 0 N--CA 1.452 -0.367 0 N-CA-C 108.061 -1.089 . . . . 2.2200000000000002 108.061 -172.805 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 26.5 t80 -59.12 -49.88 76.17 Favored 'General case' 0 N--CA 1.448 -0.529 0 CA-C-N 115.388 -0.824 . . . . 2.6499999999999999 108.99 177.553 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -51.65 -40.06 59.29 Favored 'General case' 0 N--CA 1.45 -0.475 0 CA-C-O 119.213 -0.422 . . . . 1.3300000000000001 111.129 173.814 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -75.74 -25.01 68.35 Favored Glycine 0 CA--C 1.524 0.599 0 CA-C-N 118.909 0.777 . . . . 1.77 113.448 -176.265 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 1.4 t80 -82.33 -39.95 22.11 Favored 'General case' 0 N--CA 1.455 -0.176 0 CA-C-N 118.342 1.071 . . . . 3.04 109.661 178.09 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -80.71 -30.63 36.28 Favored 'General case' 0 N--CA 1.452 -0.363 0 C-N-CA 124.405 1.082 . . . . 2.54 112.932 -177.411 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 9.1 mt -123.36 132.68 54.05 Favored 'General case' 0 N--CA 1.449 -0.478 0 N-CA-C 106.654 -1.61 . . . . 2.3700000000000001 106.654 -170.248 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 1.7 t70 66.63 -155.2 0.24 Allowed 'General case' 0 CA--C 1.536 0.44 0 N-CA-C 109.087 -0.709 . . . . 4.5499999999999998 109.087 -169.614 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 9.7 tmtt? -148.7 175.01 11.57 Favored 'General case' 0 C--O 1.227 -0.109 0 N-CA-C 107.472 -1.307 . . . . 11.960000000000001 107.472 172.223 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 54.1 t30 -62.53 101.52 0.25 Allowed 'General case' 0 N--CA 1.454 -0.26 0 O-C-N 121.187 -0.945 . . . . 8.8599999999999994 109.766 178.211 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -130.62 -38.93 1.29 Allowed 'General case' 0 CA--C 1.53 0.179 0 C-N-CA 125.321 1.449 . . . . 7.9699999999999998 109.964 -176.935 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 5.7 t -132.73 -85.13 0.47 Allowed 'General case' 0 N--CA 1.454 -0.267 0 N-CA-C 108.467 -0.938 . . . . 6.9000000000000004 108.467 177.737 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 68.4 t0 -151.15 109.0 3.68 Favored 'General case' 0 C--O 1.226 -0.172 0 N-CA-C 106.278 -1.749 . . . . 7.6200000000000001 106.278 176.233 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . 0.55 HD13 ' HA ' ' A' ' 24' ' ' ASP . 46.2 mt 43.38 -141.83 0.16 Allowed 'General case' 0 CA--C 1.543 0.71 0 C-N-CA 125.146 1.378 . . . . 3.7799999999999998 112.573 178.066 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 5.5 p -85.41 -39.22 13.73 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.289 0 CA-C-N 119.41 1.005 . . . . 2.7200000000000002 109.861 178.38 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 11.5 p 40.56 -166.82 0.0 OUTLIER 'General case' 0 CA--C 1.537 0.473 0 C-N-CA 128.567 2.747 . . . . 3.6000000000000001 113.988 -176.516 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 8.2 t30 -74.7 88.13 2.21 Favored 'General case' 0 N--CA 1.453 -0.293 0 O-C-N 120.133 -1.604 . . . . 7.0800000000000001 109.623 179.053 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 1.3 p -97.77 23.48 7.87 Favored 'General case' 0 N--CA 1.447 -0.603 0 CA-C-N 114.198 -1.365 . . . . 3.3999999999999999 110.583 179.368 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 11.5 tttt -82.72 -77.4 0.24 Allowed 'General case' 0 C--N 1.344 0.328 0 O-C-N 120.966 -1.083 . . . . 8.2799999999999994 110.895 -177.934 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -97.3 5.47 49.9 Favored 'General case' 0 CA--C 1.532 0.284 0 O-C-N 121.285 -0.884 . . . . 6.8799999999999999 110.563 -177.952 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER 85.1 86.95 0.02 OUTLIER 'General case' 0 C--N 1.342 0.251 0 C-N-CA 126.95 2.1 . . . . 4.79 108.287 172.625 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 14.5 tt 38.39 70.54 0.07 OUTLIER 'Isoleucine or valine' 0 CA--C 1.539 0.556 0 C-N-CA 125.953 1.701 . . . . 2.4900000000000002 112.49 -177.966 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 19.7 t70 -131.78 -60.65 0.92 Allowed 'General case' 0 N--CA 1.464 0.26 0 C-N-CA 124.209 1.004 . . . . 2.1400000000000001 110.367 -163.85 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 2.3 mm -45.52 -49.04 4.0 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.546 0 CA-C-O 122.749 1.262 . . . . 0.62 109.671 169.277 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 28.7 t80 -65.76 -28.36 68.97 Favored 'General case' 0 N--CA 1.452 -0.356 0 O-C-N 120.397 -1.439 . . . . 0.45000000000000001 112.386 -179.754 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . 0.458 ' HA ' ' HE2' ' A' ' 49' ' ' LYS . 0.6 OUTLIER -65.04 -55.29 19.78 Favored 'General case' 0 N--CA 1.454 -0.263 0 O-C-N 120.049 -1.657 . . . . 0.92000000000000004 109.801 174.764 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 6.4 mm-40 -74.0 -70.74 0.37 Allowed 'General case' 0 N--CA 1.451 -0.421 0 N-CA-C 108.687 -0.857 . . . . 2.2400000000000002 108.687 -173.337 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . 0.546 ' OE2' ' HE2' ' A' ' 91' ' ' LYS . 18.5 mp0 -70.21 -31.36 68.75 Favored 'General case' 0 C--O 1.235 0.32 0 O-C-N 121.544 -0.722 . . . . 2.5600000000000001 110.693 -171.577 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . 0.451 ' HA2' ' CD1' ' A' ' 66' ' ' PHE . . . -69.92 35.96 0.39 Allowed Glycine 0 CA--C 1.53 1.0 0 C-N-CA 124.59 1.09 . . . . 0.29999999999999999 114.155 170.341 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 33.2 p -142.39 20.14 2.05 Favored 'General case' 0 N--CA 1.449 -0.517 0 O-C-N 120.81 -1.406 . . . . 2.0099999999999998 111.535 157.915 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -134.04 -35.16 0.96 Allowed 'General case' 0 C--N 1.342 0.24 0 N-CA-C 112.871 0.693 . . . . 2.5800000000000001 112.871 -171.629 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 29.4 mt -61.89 -39.18 91.06 Favored 'General case' 0 N--CA 1.465 0.293 0 CA-C-N 119.302 0.955 . . . . 0.40999999999999998 110.927 -175.817 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 1.2 t 178.2 173.65 0.62 Allowed 'General case' 0 CA--C 1.531 0.233 0 C-N-CA 125.463 1.505 . . . . 0.5 107.564 -179.146 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 14.7 m -58.64 -36.39 74.02 Favored 'General case' 0 N--CA 1.453 -0.306 0 O-C-N 121.712 -0.617 . . . . 0.92000000000000004 110.819 168.526 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -68.54 -12.43 61.26 Favored 'General case' 0 N--CA 1.467 0.381 0 CA-C-N 118.401 0.546 . . . . 1.02 112.191 175.001 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -86.45 -4.98 82.82 Favored Glycine 0 N--CA 1.444 -0.783 0 CA-C-O 118.596 -1.113 . . . . 0.35999999999999999 110.927 173.047 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -120.4 1.95 10.74 Favored 'General case' 0 CA--C 1.529 0.169 0 CA-C-N 119.402 1.601 . . . . 3.1600000000000001 112.129 -178.447 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 14.9 p -76.18 -145.99 0.03 OUTLIER 'General case' 0 CA--C 1.539 0.543 0 N-CA-C 108.605 -0.887 . . . . 0.79000000000000004 108.605 170.759 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 1.6 m120 -58.16 149.57 23.53 Favored 'General case' 0 C--N 1.34 0.19 0 CA-C-N 120.532 1.515 . . . . 1.75 109.087 177.224 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -58.55 -34.42 71.0 Favored 'General case' 0 CA--C 1.533 0.317 0 CA-C-O 121.739 0.78 . . . . 2.8900000000000001 110.366 178.479 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 64' ' ' ALA . . . . . 0.597 ' HB1' ' CE1' ' A' ' 20' ' ' HIS . . . -59.31 -34.0 71.78 Favored 'General case' 0 N--CA 1.451 -0.42 0 O-C-N 121.536 -0.728 . . . . 0.52000000000000002 112.922 175.277 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 12.5 mt-10 -74.19 -42.62 59.54 Favored 'General case' 0 N--CA 1.45 -0.427 0 O-C-N 121.278 -0.889 . . . . 1.8500000000000001 110.408 174.932 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 66' ' ' PHE . . . . . 0.451 ' CD1' ' HA2' ' A' ' 52' ' ' GLY . 57.9 t80 -49.91 -50.45 46.1 Favored 'General case' 0 N--CA 1.455 -0.206 0 C-N-CA 123.173 0.589 . . . . 0.46999999999999997 111.115 173.709 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 76.3 t80 -63.42 -42.44 98.72 Favored 'General case' 0 CA--C 1.537 0.448 0 O-C-N 121.589 -0.694 . . . . 0.59999999999999998 111.28 178.291 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -70.97 -39.55 72.47 Favored 'General case' 0 CA--C 1.535 0.396 0 O-C-N 121.095 -1.003 . . . . 0.41999999999999998 111.802 -172.616 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -76.71 -31.72 57.37 Favored 'General case' 0 N--CA 1.449 -0.484 0 O-C-N 121.281 -0.887 . . . . 3.27 109.232 179.121 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -55.02 -47.28 74.92 Favored 'General case' 0 C--O 1.222 -0.355 0 O-C-N 121.684 -0.635 . . . . 0.5 109.394 167.944 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -50.47 -47.41 57.03 Favored 'General case' 0 N--CA 1.468 0.442 0 CA-C-N 119.289 0.95 . . . . 3.54 112.212 172.098 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 49.5 ttp85 -53.35 -52.17 60.1 Favored 'General case' 0 CA--C 1.534 0.345 0 CA-C-N 118.71 0.687 . . . . 3.0299999999999998 109.95 176.659 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . 0.576 ' CB ' HG21 ' A' ' 85' ' ' VAL . 0.2 OUTLIER -71.44 -25.36 62.28 Favored 'General case' 0 C--N 1.327 -0.372 0 C-N-CA 123.88 0.872 . . . . 0.58999999999999997 111.717 -173.888 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 38.9 mmm -62.16 -39.74 93.67 Favored 'General case' 0 C--O 1.234 0.265 0 C-N-CA 124.751 1.22 . . . . 3.0899999999999999 110.537 178.829 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 75' ' ' HIS . . . . . 0.456 ' CE1' HD12 ' A' ' 15' ' ' ILE . 8.7 p80 -96.87 -8.56 30.58 Favored 'General case' 0 N--CA 1.455 -0.185 0 CA-C-O 116.24 -1.838 . . . . 1.1399999999999999 113.151 -177.857 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 3.2 m -33.71 119.74 0.39 Allowed 'General case' 0 C--N 1.344 0.343 0 C-N-CA 124.763 1.225 . . . . 1.1899999999999999 111.089 -170.476 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 1.3 p -51.02 -42.26 60.32 Favored 'General case' 0 N--CA 1.45 -0.43 0 CA-C-N 113.481 -1.691 . . . . 1.21 108.863 -177.938 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 78' ' ' ASP . . . . . 0.483 ' OD2' ' HB3' ' A' ' 80' ' ' ALA . 12.6 t0 -71.4 110.06 5.78 Favored 'General case' 0 N--CA 1.447 -0.613 0 CA-C-O 121.998 0.904 . . . . 1.9099999999999999 109.344 164.578 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 6.9 p80 -50.41 -37.43 37.76 Favored 'General case' 0 N--CA 1.452 -0.347 0 CA-C-N 115.867 -0.606 . . . . 4.5499999999999998 111.866 172.719 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 80' ' ' ALA . . . . . 0.483 ' HB3' ' OD2' ' A' ' 78' ' ' ASP . . . -60.17 -47.73 84.69 Favored 'General case' 0 N--CA 1.454 -0.255 0 CA-C-N 118.413 0.551 . . . . 0.82999999999999996 110.224 -177.327 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 13.6 mt-10 -47.95 -41.29 24.59 Favored 'General case' 0 N--CA 1.453 -0.278 0 C-N-CA 124.057 0.943 . . . . 2.8700000000000001 111.212 175.748 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 4.2 mtp180 -63.4 -48.16 79.01 Favored 'General case' 0 C--N 1.329 -0.317 0 N-CA-C 108.968 -0.753 . . . . 2.6200000000000001 108.968 178.623 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 1.5 mm? -62.37 -23.71 66.96 Favored 'General case' 0 N--CA 1.452 -0.334 0 CA-C-O 117.513 -1.232 . . . . 0.67000000000000004 112.932 175.88 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -63.42 -43.19 98.17 Favored 'General case' 0 N--CA 1.462 0.156 0 CA-C-N 121.678 2.035 . . . . 1.51 108.122 171.407 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 85' ' ' VAL . . . . . 0.576 HG21 ' CB ' ' A' ' 73' ' ' LEU . 86.5 t -62.22 -62.29 1.22 Allowed 'Isoleucine or valine' 0 C--O 1.218 -0.579 0 CA-C-O 117.405 -1.283 . . . . 0.58999999999999997 110.629 173.696 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 1.9 mt-30 -48.86 -49.78 37.87 Favored 'General case' 0 N--CA 1.464 0.264 0 CA-C-N 120.946 1.703 . . . . 1.95 111.464 -175.628 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 51.9 tttt -55.41 -51.78 65.74 Favored 'General case' 0 N--CA 1.445 -0.707 0 C-N-CA 123.422 0.689 . . . . 2.1400000000000001 111.138 178.769 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 85.7 m-20 -80.39 -5.79 57.01 Favored 'General case' 0 CA--C 1.531 0.239 0 CA-C-O 119.481 -0.295 . . . . 1.1299999999999999 111.703 -176.722 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -163.92 68.0 1.57 Allowed Pre-proline 0 N--CA 1.448 -0.545 0 C-N-CA 124.223 1.009 . . . . 0.38 110.418 -167.364 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 59.5 Cg_endo -70.57 0.33 6.41 Favored 'Trans proline' 0 N--CA 1.457 -0.648 0 C-N-CA 123.057 2.504 . . . . 1.7 112.76 -174.629 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 91' ' ' LYS . . . . . 0.546 ' HE2' ' OE2' ' A' ' 51' ' ' GLU . 0.4 OUTLIER -115.81 -41.97 3.15 Favored 'General case' 0 N--CA 1.453 -0.315 0 C-N-CA 125.248 1.419 . . . . 2.9500000000000002 110.15 -178.812 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 2.5 m -57.6 -44.77 85.66 Favored 'General case' 0 C--O 1.226 -0.14 0 CA-C-N 119.591 1.087 . . . . 0.48999999999999999 110.74 174.66 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 9.0 t80 -60.64 -48.33 82.28 Favored 'General case' 0 CA--C 1.511 -0.556 0 CA-C-O 121.75 0.786 . . . . 1.96 110.655 179.526 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 30.3 tt0 -54.93 -34.52 63.28 Favored 'General case' 0 N--CA 1.44 -0.936 0 CA-C-N 114.762 -1.108 . . . . 1.5700000000000001 110.369 177.313 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 5.5 t80 -59.82 -59.65 5.1 Favored 'General case' 0 N--CA 1.454 -0.235 0 C-N-CA 124.363 1.065 . . . . 1.0 110.573 -174.157 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 3.7 mp -60.81 -38.54 79.21 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.231 0 N-CA-C 109.04 -0.726 . . . . 0.91000000000000003 109.04 176.653 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 4.3 t30 -60.46 -28.67 68.5 Favored 'General case' 0 CA--C 1.533 0.291 0 O-C-N 121.781 -0.575 . . . . 1.4099999999999999 111.66 -178.965 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -68.92 -57.51 5.41 Favored 'General case' 0 N--CA 1.456 -0.146 0 C-N-CA 124.725 1.21 . . . . 2.21 109.076 174.976 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 32.4 mm-40 -80.44 89.42 5.6 Favored 'General case' 0 N--CA 1.451 -0.421 0 CA-C-O 121.378 0.608 . . . . 2.79 110.521 -177.033 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -51.28 139.76 6.48 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.42 0 CA-C-O 121.829 0.823 . . . . 5.1799999999999997 112.386 -179.874 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -87.69 119.1 27.68 Favored 'General case' 0 N--CA 1.455 -0.184 0 O-C-N 121.279 -0.888 . . . . 11.210000000000001 109.759 -176.648 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 102' ' ' PHE . . . . . . . . . . . . . 4.5 t80 -153.83 99.71 2.3 Favored 'General case' 0 N--CA 1.454 -0.251 0 N-CA-C 107.646 -1.242 . . . . 6.5999999999999996 107.646 173.266 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -145.69 130.13 11.86 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.287 0 N-CA-C 106.692 -1.596 . . . . 4.3300000000000001 106.692 179.981 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 104' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER 59.46 175.48 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.535 0.4 0 C-N-CA 124.687 1.195 . . . . 6.8399999999999999 110.876 -171.563 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -155.5 174.25 15.52 Favored 'General case' 0 C--N 1.331 -0.215 0 N-CA-C 107.261 -1.385 . . . . 7.0800000000000001 107.261 162.235 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 16.4 m . . . . . 0 C--O 1.252 1.196 0 CA-C-O 117.18 -1.391 . . . . 9.2799999999999994 109.3 168.216 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.469 0.866 0 N-CA-C 108.363 -1.895 . . . . 11.289999999999999 108.363 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -135.16 168.06 19.84 Favored 'General case' 0 C--N 1.332 -0.191 0 C-N-CA 124.481 1.113 . . . . 11.82 109.585 -163.242 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -166.16 158.04 13.95 Favored 'General case' 0 N--CA 1.463 0.209 0 N-CA-C 109.658 -0.497 . . . . 14.41 109.658 175.672 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 101.8 -158.39 18.5 Favored Glycine 0 C--N 1.331 0.298 0 N-CA-C 110.125 -1.19 . . . . 11.67 110.125 176.177 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 27.7 m -84.78 -158.71 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.442 -0.833 0 N-CA-C 107.753 -1.202 . . . . 12.220000000000001 107.753 163.822 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 11.3 pt-20 -99.69 119.11 37.59 Favored 'General case' 0 N--CA 1.445 -0.681 0 CA-C-O 121.998 0.904 . . . . 9.1799999999999997 111.25 174.426 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 1.9 mm? -108.71 36.5 2.83 Favored 'General case' 0 N--CA 1.454 -0.271 0 C-N-CA 124.062 0.945 . . . . 7.6299999999999999 109.46 -177.89 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 4.3 mmm-85 67.78 -77.57 0.05 OUTLIER 'General case' 0 N--CA 1.465 0.321 0 N-CA-C 108.263 -1.014 . . . . 7.9299999999999997 108.263 -168.314 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 3.6 m-20 -44.52 -42.04 6.9 Favored 'General case' 0 C--O 1.224 -0.255 0 C-N-CA 125.5 1.52 . . . . 2.8300000000000001 112.682 178.014 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 22.5 t70 -66.85 -46.13 76.02 Favored 'General case' 0 C--O 1.224 -0.274 0 C-N-CA 119.635 -0.826 . . . . 2.3199999999999998 111.184 -179.934 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -64.13 -56.44 14.84 Favored 'General case' 0 C--O 1.233 0.225 0 CA-C-O 122.334 1.064 . . . . 1.5700000000000001 110.041 -177.041 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . 0.41 ' HA ' HD11 ' A' ' 15' ' ' ILE . 9.2 pt-20 -69.31 -28.97 66.73 Favored 'General case' 0 N--CA 1.453 -0.322 0 C-N-CA 123.75 0.82 . . . . 3.1000000000000001 109.821 -175.998 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -61.91 -45.79 95.44 Favored Glycine 0 CA--C 1.525 0.686 0 C-N-CA 124.287 0.946 . . . . 0.79000000000000004 110.969 169.278 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -59.51 -55.37 35.47 Favored 'General case' 0 C--N 1.333 -0.117 0 CA-C-N 118.011 0.905 . . . . 3.3799999999999999 109.081 -174.465 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . 0.41 HD11 ' HA ' ' A' ' 12' ' ' GLU . 0.4 OUTLIER -67.71 -27.69 39.0 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.25 0 O-C-N 121.656 -0.652 . . . . 0.48999999999999999 111.588 179.316 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 6.6 t60 -60.79 -47.9 84.24 Favored 'General case' 0 CA--C 1.534 0.351 0 N-CA-C 107.369 -1.345 . . . . 0.68000000000000005 107.369 175.36 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 32.7 mt-10 -59.42 -40.7 87.55 Favored 'General case' 0 CA--C 1.528 0.111 0 O-C-N 121.254 -0.904 . . . . 2.0299999999999998 111.186 177.439 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 2.4 m-85 -50.73 -47.33 59.31 Favored 'General case' 0 CA--C 1.519 -0.229 0 CA-C-N 118.938 0.79 . . . . 3.4399999999999999 110.764 173.478 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -48.81 -43.68 30.35 Favored Glycine 0 CA--C 1.533 1.192 0 CA-C-N 118.352 0.524 . . . . 0.79000000000000004 111.88 176.71 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 58.0 m-70 -62.12 -49.52 75.56 Favored 'General case' 0 C--O 1.226 -0.169 0 O-C-N 121.435 -1.038 . . . . 3.5600000000000001 111.768 174.481 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -59.17 -27.39 65.64 Favored 'General case' 0 CA--C 1.533 0.319 0 O-C-N 122.043 -0.41 . . . . 0.57999999999999996 111.214 -178.758 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 71.4 t -68.07 -42.96 85.57 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.19 0 O-C-N 121.029 -1.044 . . . . 1.0600000000000001 110.477 175.311 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 4.3 m-20 -61.22 -20.28 62.62 Favored 'General case' 0 N--CA 1.462 0.17 0 N-CA-C 111.747 0.277 . . . . 1.96 111.747 173.489 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 12.1 t70 -71.97 -54.52 9.7 Favored 'General case' 0 N--CA 1.452 -0.355 0 N-CA-C 108.778 -0.823 . . . . 2.1000000000000001 108.778 -178.798 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 18.1 t80 -64.34 -51.26 64.23 Favored 'General case' 0 CA--C 1.52 -0.207 0 CA-C-N 116.472 -0.331 . . . . 2.5899999999999999 110.513 -178.236 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 26' ' ' ALA . . . . . 0.683 ' HB3' HG11 ' A' ' 38' ' ' VAL . . . -56.58 -31.31 64.12 Favored 'General case' 0 N--CA 1.452 -0.352 0 CA-C-O 118.269 -0.872 . . . . 0.96999999999999997 111.185 175.356 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -60.86 -66.42 2.7 Favored Glycine 0 CA--C 1.524 0.616 0 CA-C-N 119.166 0.894 . . . . 1.4299999999999999 111.506 172.625 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 1.2 t80 -54.69 -35.41 63.58 Favored 'General case' 0 CA--C 1.535 0.367 0 O-C-N 122.029 -0.689 . . . . 2.2400000000000002 111.511 -171.09 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -85.33 -30.49 23.66 Favored 'General case' 0 N--CA 1.449 -0.494 0 N-CA-C 113.92 1.082 . . . . 1.46 113.92 -179.87 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 10.8 mt -127.14 111.37 13.92 Favored 'General case' 0 C--O 1.221 -0.4 0 CA-C-N 119.823 1.192 . . . . 1.9099999999999999 108.354 -167.672 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . 0.41 0.4 OUTLIER 79.28 -165.4 0.03 OUTLIER 'General case' 0 CA--C 1.539 0.526 0 C-N-CA 124.81 1.244 . . . . 4.3499999999999996 108.853 -162.387 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 179.71 -25.6 0.0 OUTLIER 'General case' 0 N--CA 1.471 0.597 0 C-N-CA 125.505 1.522 . . . . 6.8200000000000003 110.366 -177.301 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 1.9 p30 -129.26 162.31 28.2 Favored 'General case' 0 N--CA 1.434 -1.235 0 C-N-CA 125.779 1.631 . . . . 7.5300000000000002 107.146 179.622 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 22.5 tp60 74.49 34.73 0.75 Allowed 'General case' 0 CA--C 1.537 0.446 0 C-N-CA 124.449 1.1 . . . . 9.5399999999999991 111.718 -176.375 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER 100.93 118.71 0.01 OUTLIER 'General case' 0 C--O 1.219 -0.541 0 C-N-CA 130.266 3.426 . . . . 5.4699999999999998 107.177 179.548 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -68.94 -38.04 79.23 Favored 'General case' 0 N--CA 1.466 0.366 0 C-N-CA 122.584 0.354 . . . . 6.9100000000000001 111.472 -171.953 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 7.6 mp -68.19 143.99 55.13 Favored 'General case' 0 C--O 1.226 -0.132 0 N-CA-C 107.835 -1.172 . . . . 2.3399999999999999 107.835 174.484 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . 0.683 HG11 ' HB3' ' A' ' 26' ' ' ALA . 13.8 p -75.55 24.7 0.05 OUTLIER 'Isoleucine or valine' 0 CA--C 1.555 1.158 0 C-N-CA 123.44 0.696 . . . . 2.1099999999999999 112.214 -178.612 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 10.9 t -68.69 140.03 55.42 Favored 'General case' 0 CA--C 1.535 0.385 0 O-C-N 120.25 -1.531 . . . . 3.2400000000000002 108.751 -178.743 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 57.4 t30 50.87 60.7 3.69 Favored 'General case' 0 CA--C 1.531 0.216 0 C-N-CA 125.243 1.417 . . . . 5.0599999999999996 113.27 179.484 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 73.8 m -125.9 171.7 10.51 Favored 'General case' 0 N--CA 1.455 -0.213 0 C-N-CA 122.992 0.517 . . . . 3.7000000000000002 110.116 178.389 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 66.89 -73.39 0.08 Allowed 'General case' 0 C--O 1.225 -0.193 0 C-N-CA 125.768 1.627 . . . . 6.7300000000000004 111.363 -173.32 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 12.2 tptt -72.43 -23.42 61.07 Favored 'General case' 0 C--O 1.223 -0.29 0 CA-C-N 118.643 0.656 . . . . 6.5899999999999999 112.014 -178.867 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER 59.76 55.52 3.91 Favored 'General case' 0 CA--C 1.534 0.346 0 C-N-CA 123.369 0.668 . . . . 5.1699999999999999 111.886 168.543 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . 0.309 0.1 OUTLIER 83.05 80.13 0.02 OUTLIER 'Isoleucine or valine' 0 CA--C 1.539 0.539 0 C-N-CA 127.103 2.161 . . . . 3.4300000000000002 110.147 173.735 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 28.8 t0 -157.36 -66.39 0.1 Allowed 'General case' 0 N--CA 1.464 0.249 0 O-C-N 121.016 -1.053 . . . . 2.29 109.057 -173.972 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 8.2 mm -52.13 -54.17 15.3 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.413 0 C-N-CA 125.404 1.482 . . . . 0.56000000000000005 109.5 177.966 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 36.5 t80 -64.0 -24.8 67.85 Favored 'General case' 0 N--CA 1.453 -0.305 0 O-C-N 121.346 -0.847 . . . . 0.51000000000000001 113.206 178.372 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . 0.47 ' CA ' ' HE2' ' A' ' 49' ' ' LYS . 1.0 OUTLIER -66.77 -53.66 30.78 Favored 'General case' 0 N--CA 1.456 -0.168 0 C-N-CA 118.186 -1.406 . . . . 1.0800000000000001 109.304 -178.85 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -84.49 -59.78 2.27 Favored 'General case' 0 N--CA 1.451 -0.385 0 N-CA-C 108.734 -0.839 . . . . 2.4500000000000002 108.734 -172.812 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . 0.462 ' OE2' ' HE2' ' A' ' 91' ' ' LYS . 18.1 mm-40 -71.15 -31.24 67.45 Favored 'General case' 0 C--O 1.235 0.306 0 O-C-N 122.058 -0.401 . . . . 2.3100000000000001 110.268 -170.44 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . 0.436 ' HA2' ' CD1' ' A' ' 66' ' ' PHE . . . -68.08 40.52 0.26 Allowed Glycine 0 CA--C 1.528 0.864 0 C-N-CA 126.644 2.069 . . . . 0.35999999999999999 114.464 171.318 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 9.3 p -156.61 34.83 0.31 Allowed 'General case' 0 N--CA 1.449 -0.504 0 O-C-N 120.806 -1.409 . . . . 1.5 109.901 155.725 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 35.9 t-20 -135.6 -46.83 0.68 Allowed 'General case' 0 CA--C 1.521 -0.147 0 O-C-N 122.174 -0.329 . . . . 1.6499999999999999 111.722 -169.74 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . 0.525 HD21 ' HB2' ' A' ' 89' ' ' ALA . 17.8 mt -55.85 -40.47 72.91 Favored 'General case' 0 CA--C 1.53 0.18 0 CA-C-O 120.825 0.345 . . . . 0.46999999999999997 111.196 -178.873 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 2.8 t 178.07 173.76 0.6 Allowed 'General case' 0 CA--C 1.533 0.301 0 C-N-CA 125.67 1.588 . . . . 0.56999999999999995 107.766 -174.483 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 9.6 p -61.75 -36.29 80.59 Favored 'General case' 0 N--CA 1.456 -0.173 0 C-N-CA 123.499 0.72 . . . . 2.5699999999999998 109.959 170.307 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -62.16 -14.4 36.94 Favored 'General case' 0 CA--C 1.537 0.446 0 N-CA-C 112.332 0.493 . . . . 1.1299999999999999 112.332 174.342 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -87.12 -13.25 66.52 Favored Glycine 0 N--CA 1.446 -0.693 0 CA-C-O 118.802 -0.999 . . . . 0.39000000000000001 111.603 177.649 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 71.5 ttt-85 -101.94 -17.7 16.01 Favored 'General case' 0 N--CA 1.461 0.077 0 CA-C-N 119.23 1.515 . . . . 2.29 112.252 176.985 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 1.4 p -60.01 -170.01 0.01 OUTLIER 'General case' 0 CA--C 1.538 0.489 0 C-N-CA 123.064 0.546 . . . . 0.89000000000000001 110.529 168.736 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 83.6 m-20 -48.89 148.28 2.32 Favored 'General case' 0 N--CA 1.464 0.227 0 O-C-N 121.428 -0.795 . . . . 2.2200000000000002 110.529 -174.751 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -60.34 -31.23 70.11 Favored 'General case' 0 C--O 1.224 -0.273 0 C-N-CA 120.526 -0.47 . . . . 2.9300000000000002 110.7 -174.056 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -54.64 -38.35 66.76 Favored 'General case' 0 N--CA 1.453 -0.297 0 N-CA-C 113.013 0.745 . . . . 0.45000000000000001 113.013 173.675 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 1.6 mt-10 -74.56 -44.79 49.3 Favored 'General case' 0 CA--C 1.505 -0.784 0 CA-C-O 118.622 -0.704 . . . . 2.2200000000000002 110.148 178.569 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 66' ' ' PHE . . . . . 0.436 ' CD1' ' HA2' ' A' ' 52' ' ' GLY . 49.1 t80 -50.22 -47.33 54.93 Favored 'General case' 0 N--CA 1.45 -0.457 0 O-C-N 123.896 0.748 . . . . 0.34000000000000002 111.594 174.397 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 67' ' ' PHE . . . . . 0.427 ' O ' ' HB3' ' A' ' 70' ' ' ALA . 76.8 t80 -64.75 -45.01 88.21 Favored 'General case' 0 N--CA 1.452 -0.327 0 O-C-N 121.421 -0.799 . . . . 0.38 110.355 175.605 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -64.83 -54.44 31.0 Favored 'General case' 0 CA--C 1.537 0.456 0 O-C-N 121.446 -0.784 . . . . 0.35999999999999999 112.619 -172.023 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -55.1 -36.62 65.88 Favored 'General case' 0 N--CA 1.456 -0.126 0 C-N-CA 124.207 1.003 . . . . 3.5899999999999999 111.071 169.534 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 70' ' ' ALA . . . . . 0.427 ' HB3' ' O ' ' A' ' 67' ' ' PHE . . . -53.18 -52.12 59.87 Favored 'General case' 0 C--O 1.22 -0.496 0 CA-C-N 118.913 0.779 . . . . 0.46000000000000002 109.644 170.635 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 4.7 t80 -51.71 -49.81 61.73 Favored 'General case' 0 C--O 1.233 0.209 0 CA-C-N 119.764 1.165 . . . . 2.5299999999999998 111.682 179.981 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 25.1 ttt180 -46.89 -58.66 3.71 Favored 'General case' 0 CA--C 1.536 0.434 0 CA-C-N 118.005 0.366 . . . . 1.8799999999999999 110.341 172.389 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . 0.589 HD12 ' CG2' ' A' ' 85' ' ' VAL . 0.1 OUTLIER -67.31 -33.24 74.85 Favored 'General case' 0 C--N 1.329 -0.293 0 C-N-CA 123.607 0.763 . . . . 0.46000000000000002 110.565 -170.317 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 74' ' ' MET . . . . . 0.558 ' CE ' HG11 ' A' ' 85' ' ' VAL . 0.0 OUTLIER -61.5 -39.74 92.08 Favored 'General case' 0 CA--C 1.52 -0.199 0 C-N-CA 124.853 1.261 . . . . 6.3399999999999999 109.939 -178.865 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 14.1 p80 -88.45 -33.29 17.9 Favored 'General case' 0 N--CA 1.453 -0.294 0 CA-C-O 116.702 -1.618 . . . . 1.05 110.991 -177.458 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 17.5 m -14.45 116.62 0.02 OUTLIER 'General case' 0 C--N 1.345 0.403 0 C-N-CA 128.561 2.744 . . . . 1.1299999999999999 113.537 -167.204 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 7.7 p -45.29 -44.37 11.38 Favored 'General case' 0 N--CA 1.452 -0.365 0 C-N-CA 126.172 1.789 . . . . 1.21 110.017 -179.657 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 11.0 t0 -70.68 108.2 4.29 Favored 'General case' 0 N--CA 1.447 -0.624 0 CA-C-O 121.822 0.82 . . . . 2.0299999999999998 109.614 168.054 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 57.8 m80 -52.27 -32.68 38.35 Favored 'General case' 0 N--CA 1.456 -0.155 0 CA-C-N 115.936 -0.574 . . . . 5.8600000000000003 111.519 174.676 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -61.64 -51.19 69.49 Favored 'General case' 0 N--CA 1.449 -0.478 0 CA-C-O 118.325 -0.845 . . . . 0.81000000000000005 110.37 177.935 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 1.9 mt-10 -47.26 -40.92 17.63 Favored 'General case' 0 N--CA 1.464 0.264 0 CA-C-N 119.331 0.969 . . . . 3.0299999999999998 110.419 178.049 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -62.91 -52.57 62.53 Favored 'General case' 0 CA--C 1.515 -0.386 0 C-N-CA 120.108 -0.637 . . . . 3.1299999999999999 110.145 178.581 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -61.98 -24.59 67.11 Favored 'General case' 0 N--CA 1.453 -0.319 0 CA-C-O 117.49 -1.243 . . . . 0.5 112.677 177.491 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 1.1 mptm? -61.29 -42.46 98.69 Favored 'General case' 0 C--O 1.225 -0.232 0 CA-C-N 121.166 1.803 . . . . 1.27 107.567 172.517 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 85' ' ' VAL . . . . . 0.589 ' CG2' HD12 ' A' ' 73' ' ' LEU . 93.0 t -69.26 -55.36 15.62 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.473 0 CA-C-O 118.21 -0.9 . . . . 0.42999999999999999 112.308 176.19 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -50.8 -41.38 57.16 Favored 'General case' 0 CA--C 1.531 0.243 0 CA-C-N 120.676 1.58 . . . . 2.1600000000000001 111.237 -178.013 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 34.9 tttt -62.88 -60.62 3.22 Favored 'General case' 0 N--CA 1.448 -0.54 0 C-N-CA 124.747 1.219 . . . . 1.9399999999999999 110.919 175.67 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 3.0 m120 -76.7 0.34 20.78 Favored 'General case' 0 CA--C 1.53 0.187 0 C-N-CA 123.539 0.735 . . . . 1.21 112.075 -174.069 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 89' ' ' ALA . . . . . 0.525 ' HB2' HD21 ' A' ' 55' ' ' LEU . . . -158.33 68.58 3.68 Favored Pre-proline 0 N--CA 1.448 -0.53 0 C-N-CA 124.443 1.097 . . . . 0.53000000000000003 108.7 -171.434 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 89.2 Cg_endo -80.3 56.64 6.15 Favored 'Trans proline' 0 CA--C 1.536 0.58 0 C-N-CA 124.378 3.386 . . . . 2.0 110.568 -173.3 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 91' ' ' LYS . . . . . 0.462 ' HE2' ' OE2' ' A' ' 51' ' ' GLU . 0.0 OUTLIER 176.18 -53.76 0.01 OUTLIER 'General case' 0 C--O 1.227 -0.127 0 C-N-CA 126.681 1.992 . . . . 2.6000000000000001 109.669 -168.626 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 2.7 m -55.19 -46.51 75.84 Favored 'General case' 0 CA--C 1.518 -0.272 0 CA-C-N 118.855 0.752 . . . . 0.39000000000000001 110.486 179.138 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 3.0 t80 -57.76 -49.02 77.97 Favored 'General case' 0 CA--C 1.506 -0.72 0 N-CA-C 109.677 -0.49 . . . . 2.27 109.677 178.246 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 3.8 tt0 -53.92 -33.78 57.67 Favored 'General case' 0 N--CA 1.443 -0.789 0 O-C-N 124.072 0.857 . . . . 2.25 110.694 -177.631 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 4.6 t80 -60.56 -56.25 23.56 Favored 'General case' 0 CA--C 1.529 0.173 0 C-N-CA 123.355 0.662 . . . . 0.92000000000000004 109.945 -175.865 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 2.3 mp -61.67 -41.28 89.79 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.293 0 N-CA-C 108.853 -0.795 . . . . 0.91000000000000003 108.853 176.817 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 11.7 t30 -58.7 -36.34 74.08 Favored 'General case' 0 CA--C 1.533 0.304 0 C-N-CA 123.143 0.577 . . . . 1.6899999999999999 110.953 -175.896 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -62.76 -44.59 95.8 Favored 'General case' 0 CA--C 1.529 0.171 0 C-N-CA 126.588 1.955 . . . . 2.73 109.128 175.865 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 23.3 mm-40 -86.23 78.84 9.26 Favored 'General case' 0 N--CA 1.453 -0.276 0 O-C-N 121.079 -1.013 . . . . 3.4500000000000002 110.507 174.12 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 1.9 tt -77.33 51.61 0.06 OUTLIER 'Isoleucine or valine' 0 CA--C 1.541 0.599 0 C-N-CA 123.828 0.851 . . . . 4.7599999999999998 111.165 171.594 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 32.9 ttmt -159.51 157.49 30.09 Favored 'General case' 0 N--CA 1.457 -0.124 0 O-C-N 120.454 -1.404 . . . . 8.8100000000000005 107.442 174.671 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 102' ' ' PHE . . . . . . . . . . . . . 38.6 p90 -151.65 -178.35 6.66 Favored 'General case' 0 C--N 1.33 -0.26 0 N-CA-C 108.711 -0.848 . . . . 8.3499999999999996 108.711 -175.63 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 18.2 tt -61.29 141.45 17.44 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.308 0 C-N-CA 122.605 0.362 . . . . 5.3899999999999997 110.121 179.632 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 104' ' ' ILE . . . . . . . . . . . . . 8.4 pt -72.24 165.64 2.88 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.305 0 O-C-N 121.78 -0.575 . . . . 6.8600000000000003 110.089 175.836 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 96.8 m-20 61.33 100.81 0.03 OUTLIER 'General case' 0 N--CA 1.463 0.211 0 C-N-CA 126.388 1.875 . . . . 8.0199999999999996 111.572 -176.321 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 19.0 p . . . . . 0 C--O 1.247 0.939 0 N-CA-C 106.963 -1.495 . . . . 9.0099999999999998 106.963 -178.223 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.47 0.928 0 N-CA-C 107.697 -2.161 . . . . 15.779999999999999 107.697 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 2.1 m -153.09 -179.73 7.95 Favored 'General case' 0 N--CA 1.451 -0.383 0 N-CA-C 108.38 -0.97 . . . . 16.670000000000002 108.38 -165.089 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 32.6 ttpt -139.03 -80.31 0.32 Allowed 'General case' 0 N--CA 1.454 -0.231 0 N-CA-C 109.127 -0.694 . . . . 23.620000000000001 109.127 175.509 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -109.01 94.14 0.82 Allowed Glycine 0 C--N 1.332 0.351 0 N-CA-C 108.655 -1.778 . . . . 15.31 108.655 175.025 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 27.1 m -123.94 -152.1 0.12 Allowed 'Isoleucine or valine' 0 N--CA 1.438 -1.03 0 N-CA-C 107.57 -1.27 . . . . 12.050000000000001 107.57 172.635 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 17.4 mt-10 -107.26 97.93 7.63 Favored 'General case' 0 N--CA 1.449 -0.508 0 CA-C-O 122.133 0.968 . . . . 8.4100000000000001 111.397 -177.598 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . 0.479 HD22 ' N ' ' A' ' 7' ' ' LEU . 1.4 mm? -84.33 40.74 0.79 Allowed 'General case' 0 N--CA 1.449 -0.499 0 CA-C-N 115.325 -0.852 . . . . 10.98 110.703 -178.028 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 7.6 mtm-85 -131.97 -92.49 0.39 Allowed 'General case' 0 N--CA 1.438 -1.052 0 C-N-CA 127.023 2.129 . . . . 7.6799999999999997 105.41 178.6 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 8.1 m120 -65.72 -44.71 85.22 Favored 'General case' 0 CA--C 1.515 -0.391 0 N-CA-C 113.657 0.984 . . . . 4.5099999999999998 113.657 -175.328 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 6.8 t70 -63.36 -44.56 94.46 Favored 'General case' 0 C--O 1.224 -0.279 0 CA-C-N 119.006 0.821 . . . . 2.4900000000000002 109.394 179.706 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 58.5 m -60.03 -54.92 40.27 Favored 'General case' 0 CA--C 1.532 0.254 0 O-C-N 121.291 -0.881 . . . . 1.77 113.245 177.287 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 34.2 mt-10 -59.46 -40.65 87.57 Favored 'General case' 0 C--N 1.329 -0.3 0 C-N-CA 126.415 1.886 . . . . 3.8100000000000001 109.451 -177.127 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -55.73 -56.7 22.46 Favored Glycine 0 CA--C 1.528 0.886 0 N-CA-C 110.644 -0.983 . . . . 0.88 110.644 170.256 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -52.44 -55.49 21.53 Favored 'General case' 0 C--N 1.333 -0.151 0 C-N-CA 124.477 1.111 . . . . 3.5600000000000001 110.82 -175.034 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 1.1 pt -70.67 -27.14 29.85 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.283 0 O-C-N 121.613 -0.679 . . . . 0.81000000000000005 112.479 -178.322 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 1.1 t-160 -58.31 -57.76 11.48 Favored 'General case' 0 CA--C 1.529 0.163 0 N-CA-C 105.894 -1.891 . . . . 0.62 105.894 174.015 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 43.5 mt-10 -55.4 -43.35 75.14 Favored 'General case' 0 N--CA 1.456 -0.158 0 C-N-CA 123.967 0.907 . . . . 2.4700000000000002 110.663 -178.859 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 16.1 t80 -53.53 -51.49 62.67 Favored 'General case' 0 N--CA 1.455 -0.176 0 C-N-CA 123.493 0.717 . . . . 2.23 110.533 177.273 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -48.64 -43.56 29.02 Favored Glycine 0 CA--C 1.525 0.676 0 N-CA-C 111.347 -0.701 . . . . 0.72999999999999998 111.347 174.889 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 20' ' ' HIS . . . . . 0.544 ' CE1' ' HB1' ' A' ' 64' ' ' ALA . 2.3 t-160 -61.18 -48.94 79.22 Favored 'General case' 0 N--CA 1.45 -0.466 0 O-C-N 121.967 -0.726 . . . . 1.8600000000000001 111.047 178.299 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -58.63 -32.41 69.01 Favored 'General case' 0 N--CA 1.454 -0.232 0 CA-C-N 118.279 0.49 . . . . 1.1899999999999999 110.346 177.802 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 41.4 t -67.6 -33.83 64.46 Favored 'Isoleucine or valine' 0 N--CA 1.46 0.059 0 O-C-N 121.256 -0.902 . . . . 1.21 111.537 179.13 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 12.1 t0 -57.19 -32.4 66.43 Favored 'General case' 0 CA--C 1.533 0.295 0 CA-C-O 122.082 0.944 . . . . 1.96 110.688 174.309 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 7.4 t0 -66.98 -51.31 56.64 Favored 'General case' 0 N--CA 1.454 -0.273 0 CA-C-O 122.555 1.169 . . . . 2.04 108.243 -177.864 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 1.2 t80 -52.78 -42.97 65.53 Favored 'General case' 0 N--CA 1.457 -0.125 0 CA-C-N 114.945 -1.025 . . . . 3.3500000000000001 110.743 174.52 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -61.14 -33.23 73.07 Favored 'General case' 0 N--CA 1.449 -0.485 0 CA-C-O 118.693 -0.67 . . . . 0.94999999999999996 111.377 -179.878 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -72.72 -32.65 61.21 Favored Glycine 0 CA--C 1.523 0.565 0 CA-C-N 118.929 0.786 . . . . 1.6499999999999999 111.759 177.342 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -72.56 -44.07 62.6 Favored 'General case' 0 N--CA 1.453 -0.304 0 O-C-N 121.667 -0.902 . . . . 2.8100000000000001 110.611 -179.312 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 2.0 mm? -83.84 -34.93 24.55 Favored 'General case' 0 N--CA 1.45 -0.434 0 C-N-CA 124.081 0.953 . . . . 2.54 112.807 -174.861 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 1.9 mt -125.38 165.9 17.55 Favored 'General case' 0 N--CA 1.449 -0.518 0 N-CA-C 107.973 -1.121 . . . . 2.5699999999999998 107.973 -170.164 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 1.6 t70 68.48 162.07 0.2 Allowed 'General case' 0 CA--C 1.534 0.365 0 C-N-CA 123.803 0.841 . . . . 4.7699999999999996 109.484 -163.745 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 1.4 tptm -128.79 -7.79 5.03 Favored 'General case' 0 C--N 1.331 -0.219 0 O-C-N 120.947 -1.096 . . . . 8.9600000000000009 110.993 179.798 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 36.0 t-20 -85.35 166.17 16.66 Favored 'General case' 0 N--CA 1.446 -0.66 0 N-CA-C 108.028 -1.101 . . . . 6.4699999999999998 108.028 177.31 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -65.73 -6.9 13.01 Favored 'General case' 0 CA--C 1.537 0.48 0 N-CA-C 112.802 0.667 . . . . 6.7599999999999998 112.802 173.757 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 12.1 m -72.12 88.19 1.1 Allowed 'General case' 0 N--CA 1.448 -0.566 0 C-N-CA 123.596 0.758 . . . . 6.1399999999999997 110.549 176.124 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 10.5 m-20 -62.99 168.94 3.62 Favored 'General case' 0 CA--C 1.533 0.326 0 C-N-CA 122.742 0.417 . . . . 6.8799999999999999 110.113 166.651 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 7.1 mp 68.74 106.26 0.05 Allowed 'General case' 0 CA--C 1.531 0.233 0 C-N-CA 127.527 2.331 . . . . 2.1000000000000001 110.8 -172.2 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 53.9 t -87.11 76.43 1.32 Allowed 'Isoleucine or valine' 0 N--CA 1.455 -0.222 0 CA-C-O 123.108 1.432 . . . . 2.98 108.181 178.781 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -113.91 116.04 28.65 Favored 'General case' 0 N--CA 1.442 -0.871 0 N-CA-C 107.158 -1.423 . . . . 3.3100000000000001 107.158 -177.482 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 61.0 m-80 41.72 51.17 4.01 Favored 'General case' 0 N--CA 1.467 0.386 0 C-N-CA 125.061 1.344 . . . . 6.9299999999999997 114.488 -178.863 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 22.4 t -62.58 -74.13 0.1 Allowed 'General case' 0 CA--C 1.539 0.529 0 C-N-CA 122.856 0.462 . . . . 3.1400000000000001 110.737 177.061 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -53.13 -54.75 31.1 Favored 'General case' 0 N--CA 1.472 0.626 0 O-C-N 120.741 -1.224 . . . . 7.1600000000000001 112.92 -171.83 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -72.0 -19.91 61.79 Favored 'General case' 0 C--O 1.223 -0.34 0 CA-C-O 118.706 -0.664 . . . . 7.1399999999999997 112.063 -178.671 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER 63.75 85.5 0.13 Allowed 'General case' 0 N--CA 1.451 -0.382 0 C-N-CA 125.402 1.481 . . . . 5.0700000000000003 112.266 170.732 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 15.5 tt 41.75 74.56 0.06 OUTLIER 'Isoleucine or valine' 0 CA--C 1.539 0.545 0 C-N-CA 125.989 1.715 . . . . 2.3599999999999999 111.794 -178.832 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 19.8 t70 -134.9 -55.97 0.82 Allowed 'General case' 0 N--CA 1.465 0.319 0 C-N-CA 123.43 0.692 . . . . 2.1099999999999999 110.784 -170.808 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 5.9 mm -56.53 -46.49 82.45 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.315 0 CA-C-O 122.943 1.354 . . . . 0.68999999999999995 109.102 175.873 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 24.7 t80 -63.62 -23.14 67.26 Favored 'General case' 0 N--CA 1.451 -0.401 0 O-C-N 120.561 -1.337 . . . . 0.58999999999999997 112.187 177.085 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . 0.485 ' HA ' ' CE ' ' A' ' 49' ' ' LYS . 0.9 OUTLIER -71.85 -48.96 42.38 Favored 'General case' 0 N--CA 1.448 -0.549 0 O-C-N 120.053 -1.655 . . . . 1.4299999999999999 110.343 -179.653 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 21.8 tp10 -90.31 -55.82 3.45 Favored 'General case' 0 C--N 1.331 -0.208 0 O-C-N 123.541 0.526 . . . . 2.48 109.619 -173.04 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 33.0 mp0 -75.67 -28.43 58.7 Favored 'General case' 0 C--O 1.236 0.359 0 O-C-N 121.25 -0.906 . . . . 2.6000000000000001 110.904 -176.261 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . 0.475 ' HA2' ' CD1' ' A' ' 66' ' ' PHE . . . -70.92 45.72 0.71 Allowed Glycine 0 CA--C 1.531 1.055 0 C-N-CA 125.805 1.669 . . . . 0.38 114.843 169.935 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 46.8 t -162.66 46.13 0.14 Allowed 'General case' 0 N--CA 1.449 -0.476 0 N-CA-C 107.182 -1.414 . . . . 2.0699999999999998 107.182 157.636 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 4.8 t-20 -147.45 -50.85 0.19 Allowed 'General case' 0 CA--C 1.519 -0.243 0 N-CA-C 111.746 0.276 . . . . 1.49 111.746 -170.116 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 28.0 mt -59.97 -37.07 78.55 Favored 'General case' 0 N--CA 1.462 0.14 0 CA-C-O 120.885 0.374 . . . . 0.46000000000000002 111.048 -176.907 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -178.0 170.52 1.85 Allowed 'General case' 0 C--N 1.33 -0.277 0 N-CA-C 107.81 -1.181 . . . . 0.42999999999999999 107.81 -175.982 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 11.6 t -63.02 -35.23 79.52 Favored 'General case' 0 CA--C 1.533 0.312 0 C-N-CA 123.195 0.598 . . . . 1.99 109.713 170.184 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -67.1 -9.52 40.43 Favored 'General case' 0 N--CA 1.466 0.342 0 O-C-N 121.737 -0.602 . . . . 1.23 112.237 172.811 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -85.58 -5.08 84.94 Favored Glycine 0 C--O 1.22 -0.745 0 CA-C-O 118.797 -1.002 . . . . 0.51000000000000001 111.287 173.195 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -114.11 -16.66 12.07 Favored 'General case' 0 C--N 1.334 -0.07 0 CA-C-N 119.291 1.546 . . . . 2.71 112.239 -175.583 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 24.1 p -64.45 -149.72 0.01 OUTLIER 'General case' 0 CA--C 1.54 0.565 0 C-N-CA 125.629 1.571 . . . . 0.93000000000000005 109.881 176.299 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 15.9 m120 -58.3 143.8 43.48 Favored 'General case' 0 N--CA 1.455 -0.184 0 O-C-N 119.298 -2.126 . . . . 2.96 109.212 177.307 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 66.3 tt0 -56.55 -29.03 61.5 Favored 'General case' 0 CA--C 1.534 0.335 0 CA-C-O 121.785 0.802 . . . . 3.1099999999999999 111.466 -178.52 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 64' ' ' ALA . . . . . 0.544 ' HB1' ' CE1' ' A' ' 20' ' ' HIS . . . -60.23 -39.82 88.03 Favored 'General case' 0 N--CA 1.449 -0.49 0 C-N-CA 123.349 0.659 . . . . 0.71999999999999997 112.224 175.126 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 9.6 mt-10 -70.91 -42.0 70.52 Favored 'General case' 0 N--CA 1.451 -0.384 0 O-C-N 121.365 -0.834 . . . . 2.3700000000000001 110.757 176.443 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 66' ' ' PHE . . . . . 0.475 ' CD1' ' HA2' ' A' ' 52' ' ' GLY . 49.8 t80 -49.98 -52.5 33.32 Favored 'General case' 0 N--CA 1.454 -0.23 0 C-N-CA 122.858 0.463 . . . . 0.53000000000000003 110.861 174.753 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 75.9 t80 -60.92 -41.81 96.88 Favored 'General case' 0 CA--C 1.534 0.346 0 C-N-CA 122.508 0.323 . . . . 0.77000000000000002 110.827 177.716 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -63.95 -45.67 88.14 Favored 'General case' 0 CA--C 1.54 0.577 0 O-C-N 121.209 -0.932 . . . . 0.48999999999999999 111.838 -176.109 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 18.8 mm-40 -58.42 -43.9 88.84 Favored 'General case' 0 CA--C 1.521 -0.143 0 C-N-CA 124.447 1.099 . . . . 4.2800000000000002 110.187 171.38 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -52.07 -54.5 29.54 Favored 'General case' 0 N--CA 1.454 -0.257 0 N-CA-C 108.359 -0.978 . . . . 0.41999999999999998 108.359 178.021 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 39.4 t80 -50.45 -51.13 49.58 Favored 'General case' 0 N--CA 1.456 -0.173 0 C-N-CA 123.551 0.74 . . . . 2.1499999999999999 111.986 179.616 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 13.6 ttt180 -47.55 -57.93 4.84 Favored 'General case' 0 CA--C 1.534 0.354 0 CA-C-N 118.62 0.646 . . . . 2.0499999999999998 110.094 176.154 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . 0.626 HD12 HG23 ' A' ' 85' ' ' VAL . 0.1 OUTLIER -67.4 -24.47 65.67 Favored 'General case' 0 C--O 1.222 -0.355 0 C-N-CA 125.132 1.373 . . . . 0.60999999999999999 110.984 -172.505 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 74' ' ' MET . . . . . 0.442 ' HG3' HG21 ' A' ' 96' ' ' ILE . 33.4 mmt -57.0 -45.72 82.8 Favored 'General case' 0 N--CA 1.468 0.437 0 CA-C-N 119.041 0.837 . . . . 5.5899999999999999 111.486 178.409 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 6.6 p80 -95.94 -29.36 14.21 Favored 'General case' 0 C--N 1.334 -0.102 0 CA-C-O 116.388 -1.768 . . . . 2.6800000000000002 113.556 -175.589 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 81.3 p -13.18 117.08 0.02 OUTLIER 'General case' 0 C--N 1.344 0.337 0 C-N-CA 127.87 2.468 . . . . 2.1800000000000002 113.672 -173.047 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 1.9 p -44.93 -42.39 8.07 Favored 'General case' 0 C--N 1.33 -0.276 0 C-N-CA 125.173 1.389 . . . . 1.1399999999999999 110.87 176.994 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 11.1 t0 -66.98 103.03 1.06 Allowed 'General case' 0 N--CA 1.452 -0.374 0 N-CA-C 108.857 -0.794 . . . . 2.3199999999999998 108.857 166.206 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 4.6 t-80 -59.87 -23.05 63.11 Favored 'General case' 0 CA--C 1.531 0.237 0 O-C-N 121.522 -0.736 . . . . 5.71 111.679 179.896 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -66.09 -46.17 78.63 Favored 'General case' 0 N--CA 1.451 -0.41 0 CA-C-O 118.525 -0.75 . . . . 0.78000000000000003 110.918 176.493 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 1.1 mt-10 -47.77 -38.85 16.46 Favored 'General case' 0 N--CA 1.465 0.306 0 CA-C-N 119.025 0.829 . . . . 3.25 109.908 177.655 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 11.3 mtp180 -62.19 -54.54 39.52 Favored 'General case' 0 CA--C 1.517 -0.32 0 N-CA-C 108.822 -0.807 . . . . 2.6499999999999999 108.822 -178.439 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 1.5 mm? -65.36 -19.08 65.79 Favored 'General case' 0 N--CA 1.451 -0.409 0 CA-C-O 118.095 -0.955 . . . . 0.60999999999999999 112.726 178.2 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 24.3 mttt -68.73 -43.6 75.59 Favored 'General case' 0 CA--C 1.517 -0.302 0 CA-C-N 120.885 1.675 . . . . 1.5700000000000001 108.317 172.351 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 85' ' ' VAL . . . . . 0.626 HG23 HD12 ' A' ' 73' ' ' LEU . 92.8 t -61.23 -62.34 1.16 Allowed 'Isoleucine or valine' 0 C--O 1.217 -0.633 0 CA-C-O 118.413 -0.803 . . . . 0.37 109.893 171.584 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -50.09 -46.13 53.27 Favored 'General case' 0 C--O 1.224 -0.249 0 CA-C-N 120.213 1.37 . . . . 2.3399999999999999 112.082 -175.084 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 41.7 tttt -58.91 -53.37 59.18 Favored 'General case' 0 N--CA 1.448 -0.529 0 O-C-N 121.459 -0.776 . . . . 2.1299999999999999 110.879 177.299 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 64.4 m-20 -79.82 -7.15 58.52 Favored 'General case' 0 C--N 1.33 -0.258 0 C-N-CA 122.386 0.274 . . . . 0.91000000000000003 111.486 -174.449 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -164.88 62.94 0.96 Allowed Pre-proline 0 N--CA 1.447 -0.576 0 C-N-CA 124.558 1.143 . . . . 0.52000000000000002 109.624 -163.709 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 20.8 Cg_endo -57.6 -41.13 74.4 Favored 'Trans proline' 0 N--CA 1.454 -0.813 0 C-N-CA 122.54 2.16 . . . . 2.5800000000000001 109.884 -173.123 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 1.2 ptpt -74.29 -43.13 58.11 Favored 'General case' 0 N--CA 1.453 -0.325 0 C-N-CA 126.584 1.954 . . . . 2.3199999999999998 113.222 -178.789 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 3.7 m -59.04 -45.74 89.99 Favored 'General case' 0 CA--C 1.517 -0.296 0 CA-C-N 119.924 1.238 . . . . 0.40000000000000002 110.048 179.967 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 2.5 t80 -59.27 -46.39 88.65 Favored 'General case' 0 CA--C 1.512 -0.502 0 C-N-CA 120.123 -0.631 . . . . 1.9199999999999999 110.162 175.577 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 2.8 tt0 -52.36 -32.72 39.75 Favored 'General case' 0 N--CA 1.448 -0.552 0 CA-C-N 115.532 -0.758 . . . . 1.6000000000000001 111.066 179.942 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 2.3 t80 -58.15 -62.56 1.74 Allowed 'General case' 0 N--CA 1.456 -0.166 0 C-N-CA 124.091 0.956 . . . . 1.21 110.191 -178.269 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 96' ' ' ILE . . . . . 0.442 HG21 ' HG3' ' A' ' 74' ' ' MET . 3.5 mp -63.05 -36.08 74.35 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.286 0 N-CA-C 109.218 -0.66 . . . . 1.1100000000000001 109.218 -179.762 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 7.3 t-20 -57.96 -39.0 77.05 Favored 'General case' 0 CA--C 1.536 0.426 0 CA-C-N 117.953 0.342 . . . . 2.1099999999999999 110.743 -179.486 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 6.9 t0 -57.88 -38.16 75.25 Favored 'General case' 0 N--CA 1.463 0.197 0 C-N-CA 125.225 1.41 . . . . 2.1899999999999999 110.141 177.327 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 28.5 mm100 -78.87 70.51 5.22 Favored 'General case' 0 N--CA 1.448 -0.567 0 CA-C-O 121.684 0.754 . . . . 2.7000000000000002 109.436 179.245 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 2.3 tp -67.84 162.09 3.58 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.434 0 N-CA-C 108.884 -0.784 . . . . 5.2999999999999998 108.884 -179.655 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 17.9 mmtp 52.62 81.59 0.08 Allowed 'General case' 0 C--N 1.339 0.147 0 CA-C-O 121.99 0.9 . . . . 9.3800000000000008 109.674 -167.56 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 102' ' ' PHE . . . . . . . . . . . . . 70.5 m-85 -50.05 155.42 0.94 Allowed 'General case' 0 N--CA 1.451 -0.376 0 CA-C-N 114.449 -1.25 . . . . 10.92 110.194 171.195 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 6.7 tp -55.2 129.41 16.49 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.515 0 N-CA-C 109.461 -0.57 . . . . 3.5899999999999999 109.461 -174.703 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 104' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -63.53 155.7 5.49 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.489 0 N-CA-C 108.905 -0.776 . . . . 6.0800000000000001 108.905 177.826 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 2.5 m-20 67.59 89.53 0.1 Allowed 'General case' 0 CA--C 1.528 0.104 0 C-N-CA 126.043 1.737 . . . . 6.5599999999999996 110.968 -177.232 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 8.4 m . . . . . 0 C--O 1.252 1.223 0 CA-C-O 116.692 -1.623 . . . . 9.6500000000000004 109.971 164.912 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.47 0.906 0 N-CA-C 108.868 -1.693 . . . . 13.51 108.868 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 2.0 m -50.54 152.76 1.82 Allowed 'General case' 0 N--CA 1.455 -0.193 0 CA-C-N 117.711 0.756 . . . . 14.09 110.866 173.12 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -141.68 150.19 41.57 Favored 'General case' 0 N--CA 1.454 -0.252 0 N-CA-C 108.155 -1.054 . . . . 16.899999999999999 108.155 175.712 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 159.69 -159.68 30.81 Favored Glycine 0 N--CA 1.45 -0.415 0 N-CA-C 108.291 -1.924 . . . . 15.18 108.291 -174.801 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -67.38 -175.69 0.12 Allowed 'Isoleucine or valine' 0 N--CA 1.454 -0.265 0 CA-C-O 120.943 0.401 . . . . 16.199999999999999 111.151 173.99 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 4.6 pt-20 -82.35 117.51 22.47 Favored 'General case' 0 N--CA 1.444 -0.729 0 CA-C-O 122.85 1.309 . . . . 11.210000000000001 111.297 173.612 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . 0.414 ' H ' HD22 ' A' ' 7' ' ' LEU . 0.0 OUTLIER -154.2 53.34 0.68 Allowed 'General case' 0 N--CA 1.442 -0.86 0 C-N-CA 125.997 1.719 . . . . 10.27 107.284 174.49 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 16.3 mmm180 64.48 36.64 8.63 Favored 'General case' 0 CA--C 1.531 0.216 0 C-N-CA 123.216 0.607 . . . . 7.0 111.134 179.31 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 7.3 m-20 -50.82 -36.04 35.31 Favored 'General case' 0 N--CA 1.468 0.461 0 CA-C-N 118.612 0.642 . . . . 3.3300000000000001 112.492 -178.974 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 8.0 t70 -61.57 -55.09 34.63 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 120.979 0.419 . . . . 2.27 110.825 175.083 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 7.7 t -65.07 -48.78 72.55 Favored 'General case' 0 N--CA 1.454 -0.225 0 C-N-CA 123.126 0.571 . . . . 1.6599999999999999 109.972 -171.907 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . 0.411 ' HA ' ' CD1' ' A' ' 15' ' ' ILE . 8.5 pt-20 -80.59 -23.34 39.92 Favored 'General case' 0 N--CA 1.453 -0.29 0 CA-C-O 121.172 0.511 . . . . 3.8199999999999998 110.09 -177.25 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -61.16 -45.81 95.79 Favored Glycine 0 N--CA 1.448 -0.514 0 N-CA-C 109.202 -1.559 . . . . 1.05 109.202 172.198 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 2.9 t80 -59.06 -52.53 65.33 Favored 'General case' 0 N--CA 1.454 -0.273 0 CA-C-N 117.659 0.73 . . . . 2.8500000000000001 110.699 -176.673 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . 0.411 ' CD1' ' HA ' ' A' ' 12' ' ' GLU . 0.7 OUTLIER -67.26 -36.31 76.36 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.499 0 O-C-N 121.229 -0.919 . . . . 0.60999999999999999 112.184 -178.859 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 3.0 t60 -57.34 -53.7 55.1 Favored 'General case' 0 CA--C 1.531 0.213 0 N-CA-C 107.228 -1.397 . . . . 0.87 107.228 176.383 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 45.8 mt-10 -64.99 -32.21 73.82 Favored 'General case' 0 N--CA 1.449 -0.487 0 C-N-CA 125.105 1.362 . . . . 2.3599999999999999 111.131 -175.333 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 1.1 m-85 -54.39 -53.84 48.66 Favored 'General case' 0 CA--C 1.517 -0.318 0 CA-C-N 119.56 1.073 . . . . 2.9100000000000001 110.129 167.762 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -49.76 -47.91 37.65 Favored Glycine 0 CA--C 1.526 0.742 0 N-CA-C 110.825 -0.91 . . . . 0.68999999999999995 110.825 176.857 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 20' ' ' HIS . . . . . 0.601 ' CE1' ' HB1' ' A' ' 64' ' ' ALA . 2.5 t60 -62.28 -43.7 98.21 Favored 'General case' 0 N--CA 1.447 -0.592 0 O-C-N 122.058 -0.672 . . . . 1.99 112.017 -178.661 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -61.84 -32.28 72.6 Favored 'General case' 0 N--CA 1.451 -0.394 0 N-CA-C 109.224 -0.658 . . . . 0.91000000000000003 109.224 -178.863 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 84.8 t -71.46 -40.83 72.75 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.164 0 C-N-CA 119.314 -0.954 . . . . 1.0 111.086 176.967 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 15.1 t0 -58.76 -30.54 67.6 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 121.807 0.813 . . . . 1.97 110.981 172.182 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 10.4 t70 -67.68 -49.6 61.97 Favored 'General case' 0 N--CA 1.455 -0.195 0 N-CA-C 107.556 -1.275 . . . . 2.52 107.556 -173.712 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 16.4 t80 -56.92 -46.61 81.88 Favored 'General case' 0 N--CA 1.453 -0.301 0 CA-C-N 115.677 -0.692 . . . . 3.1000000000000001 110.361 174.048 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -57.51 -33.87 68.5 Favored 'General case' 0 N--CA 1.452 -0.367 0 CA-C-O 118.686 -0.673 . . . . 1.3999999999999999 111.288 178.11 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -89.42 -13.63 61.27 Favored Glycine 0 CA--C 1.526 0.769 0 CA-C-N 119.028 0.831 . . . . 2.1699999999999999 112.908 -176.791 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 16.0 t80 -82.69 -49.61 9.6 Favored 'General case' 0 N--CA 1.453 -0.303 0 CA-C-N 118.263 1.031 . . . . 3.3799999999999999 108.915 173.665 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -78.3 -38.86 41.41 Favored 'General case' 0 CA--C 1.516 -0.341 0 C-N-CA 124.173 0.989 . . . . 2.0800000000000001 111.716 -176.755 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 3.4 mt -119.42 166.89 12.49 Favored 'General case' 0 N--CA 1.447 -0.611 0 N-CA-C 106.491 -1.67 . . . . 2.5299999999999998 106.491 -176.935 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 1.3 t0 70.35 117.61 0.04 OUTLIER 'General case' 0 CA--C 1.536 0.417 0 C-N-CA 124.2 1.0 . . . . 5.4000000000000004 110.339 -177.658 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -118.02 156.73 28.07 Favored 'General case' 0 CA--C 1.518 -0.272 0 O-C-N 120.426 -1.421 . . . . 8.7300000000000004 107.728 -172.74 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 3.2 t30 63.31 111.7 0.02 OUTLIER 'General case' 0 N--CA 1.451 -0.397 0 C-N-CA 127.371 2.268 . . . . 6.79 109.388 -163.596 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 20.5 tt0 59.59 51.02 6.72 Favored 'General case' 0 CA--C 1.535 0.397 0 C-N-CA 123.528 0.731 . . . . 8.6799999999999997 109.974 -173.11 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 9.6 p -61.45 99.69 0.11 Allowed 'General case' 0 N--CA 1.454 -0.24 0 C-N-CA 125.07 1.348 . . . . 8.0700000000000003 108.715 175.721 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 20.6 t70 -147.35 -51.82 0.2 Allowed 'General case' 0 C--N 1.33 -0.242 0 C-N-CA 124.748 1.219 . . . . 6.25 108.975 -171.572 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . 0.472 HD13 ' HB2' ' A' ' 64' ' ' ALA . 12.6 mt -141.46 153.05 44.75 Favored 'General case' 0 C--N 1.339 0.15 0 C-N-CA 125.56 1.544 . . . . 3.1699999999999999 107.872 -177.933 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 6.4 p -88.63 36.46 0.07 OUTLIER 'Isoleucine or valine' 0 N--CA 1.472 0.65 0 CA-C-N 119.822 1.192 . . . . 2.48 111.801 -173.771 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 9.0 t -78.1 12.1 1.99 Allowed 'General case' 0 CA--C 1.543 0.682 0 O-C-N 120.679 -1.263 . . . . 3.9100000000000001 112.314 -170.237 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 44.6 m-20 -135.13 46.03 2.45 Favored 'General case' 0 N--CA 1.464 0.232 0 CA-C-N 120.64 1.564 . . . . 6.7999999999999998 110.592 178.371 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 5.2 t -150.91 -166.89 2.66 Favored 'General case' 0 C--O 1.233 0.199 0 O-C-N 120.452 -1.405 . . . . 3.4500000000000002 110.942 175.661 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 3.7 mmpt? 67.21 -64.14 0.26 Allowed 'General case' 0 N--CA 1.467 0.401 0 C-N-CA 128.246 2.618 . . . . 6.2599999999999998 113.015 177.319 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -138.95 14.12 2.66 Favored 'General case' 0 C--O 1.222 -0.378 0 C-N-CA 126.452 1.901 . . . . 7.2800000000000002 110.921 179.412 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 1.6 t80 60.29 71.4 0.57 Allowed 'General case' 0 CA--C 1.533 0.318 0 C-N-CA 124.484 1.114 . . . . 4.9000000000000004 110.57 177.161 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 18.8 tt 36.16 71.68 0.05 OUTLIER 'Isoleucine or valine' 0 CA--C 1.536 0.416 0 C-N-CA 126.584 1.954 . . . . 2.9399999999999999 112.32 177.934 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 30.3 t70 -120.34 -48.83 2.29 Favored 'General case' 0 N--CA 1.465 0.289 0 CA-C-O 122.057 0.932 . . . . 2.3799999999999999 110.232 -172.297 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 3.4 mm -52.06 -51.2 31.62 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.19 0 C-N-CA 124.739 1.216 . . . . 0.64000000000000001 109.932 175.948 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 25.7 t80 -61.29 -32.74 72.58 Favored 'General case' 0 C--O 1.224 -0.268 0 O-C-N 121.781 -0.575 . . . . 0.89000000000000001 111.895 175.88 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . 0.461 ' HA ' ' HE2' ' A' ' 49' ' ' LYS . 7.6 mmpt? -67.74 -44.05 78.48 Favored 'General case' 0 N--CA 1.451 -0.403 0 O-C-N 120.544 -1.347 . . . . 1.3899999999999999 110.728 -176.668 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 18.5 mm-40 -82.31 -64.67 1.13 Allowed 'General case' 0 CA--C 1.532 0.274 0 CA-C-O 122.294 1.045 . . . . 3.0899999999999999 109.749 -179.738 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 21.1 mm-40 -74.18 -28.28 61.21 Favored 'General case' 0 C--O 1.235 0.338 0 C-N-CA 123.281 0.632 . . . . 2.2200000000000002 110.829 -169.084 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . 0.403 ' HA2' ' CD1' ' A' ' 66' ' ' PHE . . . -71.46 38.21 0.58 Allowed Glycine 0 CA--C 1.533 1.165 0 C-N-CA 124.295 0.95 . . . . 0.39000000000000001 113.287 170.184 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -148.61 33.16 0.78 Allowed 'General case' 0 N--CA 1.451 -0.414 0 C-N-CA 124.518 1.127 . . . . 2.5299999999999998 108.75 163.195 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 11.3 t-20 -144.37 -43.27 0.25 Allowed 'General case' 0 C--N 1.339 0.14 0 N-CA-C 112.331 0.493 . . . . 1.6499999999999999 112.331 -169.402 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 18.6 mt -62.64 -36.5 83.0 Favored 'General case' 0 N--CA 1.462 0.133 0 O-C-N 121.753 -0.592 . . . . 0.46000000000000002 111.239 -176.347 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER 175.06 169.84 0.29 Allowed 'General case' 0 CA--C 1.531 0.23 0 C-N-CA 125.989 1.716 . . . . 0.67000000000000004 107.48 -177.338 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 14.5 m -61.13 -36.46 79.81 Favored 'General case' 0 N--CA 1.455 -0.2 0 C-N-CA 123.092 0.557 . . . . 1.22 110.557 169.497 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 1.6 m-85 -68.08 -9.23 44.57 Favored 'General case' 0 N--CA 1.466 0.34 0 O-C-N 121.927 -0.483 . . . . 2.23 112.182 173.473 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -90.25 2.41 81.15 Favored Glycine 0 N--CA 1.443 -0.845 0 CA-C-O 118.828 -0.985 . . . . 0.44 111.06 173.54 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 3.2 tmt_? -125.91 -13.79 6.26 Favored 'General case' 0 C--O 1.226 -0.136 0 CA-C-N 119.157 1.479 . . . . 2.52 112.925 -176.888 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 3.6 p -59.67 -104.09 0.0 OUTLIER 'General case' 0 C--N 1.333 -0.148 0 C-N-CA 126.656 1.982 . . . . 1.47 110.583 177.175 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 4.5 t30 -93.53 152.23 19.19 Favored 'General case' 0 N--CA 1.45 -0.462 0 N-CA-C 107.681 -1.229 . . . . 2.0800000000000001 107.681 175.594 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 1.6 tm-20 -58.58 -35.72 72.85 Favored 'General case' 0 CA--C 1.532 0.271 0 CA-C-O 121.422 0.629 . . . . 3.48 109.737 176.205 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 64' ' ' ALA . . . . . 0.601 ' HB1' ' CE1' ' A' ' 20' ' ' HIS . . . -61.43 -31.64 71.58 Favored 'General case' 0 N--CA 1.453 -0.298 0 N-CA-C 113.785 1.032 . . . . 0.68000000000000005 113.785 176.315 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 10.0 mt-10 -76.47 -41.16 48.19 Favored 'General case' 0 CA--C 1.513 -0.446 0 O-C-N 121.546 -0.721 . . . . 2.25 109.534 176.548 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 66' ' ' PHE . . . . . 0.403 ' CD1' ' HA2' ' A' ' 52' ' ' GLY . 49.4 t80 -53.34 -51.63 61.82 Favored 'General case' 0 N--CA 1.451 -0.394 0 C-N-CA 123.027 0.531 . . . . 0.41999999999999998 111.251 173.804 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 71.2 t80 -64.94 -49.8 68.95 Favored 'General case' 0 N--CA 1.45 -0.468 0 C-N-CA 122.768 0.427 . . . . 0.46000000000000002 110.425 -178.283 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -60.11 -47.52 85.54 Favored 'General case' 0 CA--C 1.54 0.581 0 O-C-N 121.607 -0.683 . . . . 0.39000000000000001 112.274 -177.347 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 6.2 mm-40 -59.68 -41.54 90.9 Favored 'General case' 0 C--N 1.332 -0.167 0 C-N-CA 124.425 1.09 . . . . 4.4299999999999997 110.468 172.823 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -58.28 -41.84 85.23 Favored 'General case' 0 N--CA 1.453 -0.301 0 O-C-N 121.413 -0.804 . . . . 0.39000000000000001 109.373 179.67 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -54.59 -52.37 62.35 Favored 'General case' 0 C--O 1.232 0.149 0 C-N-CA 124.678 1.191 . . . . 3.21 111.488 172.016 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 7.6 ttt180 -48.58 -61.35 2.07 Favored 'General case' 0 CA--C 1.529 0.173 0 N-CA-C 109.432 -0.581 . . . . 2.3199999999999998 109.432 177.151 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . 0.564 ' CB ' HG21 ' A' ' 85' ' ' VAL . 0.1 OUTLIER -61.06 -28.04 68.78 Favored 'General case' 0 C--N 1.327 -0.411 0 C-N-CA 125.127 1.371 . . . . 0.53000000000000003 111.233 -176.18 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER -62.64 -40.71 97.87 Favored 'General case' 0 C--O 1.234 0.255 0 CA-C-N 118.745 0.702 . . . . 2.5099999999999998 110.744 -179.273 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 15.4 p80 -95.96 -20.48 18.7 Favored 'General case' 0 C--O 1.228 -0.067 0 CA-C-O 116.628 -1.653 . . . . 1.01 113.259 -179.109 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 33.2 m -31.92 115.22 0.16 Allowed 'General case' 0 C--O 1.221 -0.425 0 C-N-CA 125.776 1.63 . . . . 1.1699999999999999 111.823 -172.085 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 1.2 p -45.83 -39.58 8.66 Favored 'General case' 0 C--N 1.329 -0.291 0 C-N-CA 125.908 1.683 . . . . 1.1499999999999999 110.994 -177.367 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 12.6 t0 -63.48 104.87 0.68 Allowed 'General case' 0 N--CA 1.449 -0.514 0 CA-C-O 121.912 0.863 . . . . 2.48 109.872 167.402 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 9.1 m-70 -52.07 -33.87 41.06 Favored 'General case' 0 N--CA 1.457 -0.118 0 CA-C-O 118.596 -0.716 . . . . 4.6699999999999999 111.613 175.438 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -59.06 -54.11 50.72 Favored 'General case' 0 N--CA 1.448 -0.534 0 CA-C-O 118.04 -0.981 . . . . 1.05 109.957 178.988 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 4.4 mt-10 -42.73 -46.31 5.07 Favored 'General case' 0 CA--C 1.516 -0.352 0 C-N-CA 124.593 1.157 . . . . 2.71 111.055 178.561 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 12.4 mtp-105 -64.24 -51.2 64.79 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.162 -0.927 . . . . 3.27 109.423 -176.532 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 1.2 mm? -66.39 -18.88 65.62 Favored 'General case' 0 N--CA 1.451 -0.39 0 CA-C-O 117.674 -1.155 . . . . 0.52000000000000002 113.054 176.708 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -67.37 -44.19 79.56 Favored 'General case' 0 C--O 1.221 -0.445 0 CA-C-N 121.377 1.899 . . . . 1.8600000000000001 107.106 168.893 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 85' ' ' VAL . . . . . 0.564 HG21 ' CB ' ' A' ' 73' ' ' LEU . 93.8 t -63.95 -46.08 95.05 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.564 0 CA-C-O 117.559 -1.21 . . . . 0.46999999999999997 111.556 177.069 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 7.2 mt-30 -63.03 -49.62 73.9 Favored 'General case' 0 N--CA 1.463 0.217 0 CA-C-N 121.864 2.12 . . . . 1.72 111.737 178.636 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 44.9 tttt -57.83 -52.26 66.19 Favored 'General case' 0 N--CA 1.449 -0.497 0 O-C-N 121.769 -0.582 . . . . 2.1499999999999999 110.325 -176.523 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 8.0 m-20 -67.22 -33.3 75.07 Favored 'General case' 0 N--CA 1.453 -0.315 0 C-N-CA 123.704 0.802 . . . . 1.04 110.394 -179.147 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -136.04 84.24 31.54 Favored Pre-proline 0 C--O 1.236 0.373 0 C-N-CA 125.984 1.714 . . . . 0.42999999999999999 110.233 -173.728 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 97.4 Cg_endo -81.48 48.78 2.98 Favored 'Trans proline' 0 CA--C 1.538 0.683 0 C-N-CA 123.567 2.845 . . . . 1.6399999999999999 111.333 -175.791 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 2.3 ptmt -168.5 -53.55 0.02 OUTLIER 'General case' 0 N--CA 1.454 -0.231 0 C-N-CA 125.813 1.645 . . . . 2.3500000000000001 110.173 -174.025 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 6.6 m -51.21 -46.6 62.27 Favored 'General case' 0 N--CA 1.464 0.274 0 CA-C-N 118.874 0.761 . . . . 0.44 111.674 179.404 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 7.6 t80 -57.47 -47.07 82.85 Favored 'General case' 0 CA--C 1.511 -0.544 0 CA-C-O 121.486 0.66 . . . . 1.9099999999999999 111.149 178.678 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 12.6 tt0 -61.06 -31.1 70.77 Favored 'General case' 0 N--CA 1.441 -0.889 0 CA-C-N 115.052 -0.976 . . . . 1.8500000000000001 110.185 -179.41 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -60.69 -60.21 4.16 Favored 'General case' 0 N--CA 1.46 0.047 0 C-N-CA 123.663 0.785 . . . . 1.05 109.09 -176.64 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 3.0 mp -53.81 -44.21 59.09 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.302 0 N-CA-C 108.783 -0.821 . . . . 0.79000000000000004 108.783 175.964 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 52.6 t30 -60.34 -37.58 81.07 Favored 'General case' 0 CA--C 1.535 0.401 0 C-N-CA 120.336 -0.546 . . . . 1.6399999999999999 112.137 -177.306 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -67.81 -42.55 81.37 Favored 'General case' 0 CA--C 1.533 0.317 0 C-N-CA 126.878 2.071 . . . . 3.1499999999999999 108.946 -179.999 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 25.4 mm-40 -78.0 87.68 4.16 Favored 'General case' 0 N--CA 1.457 -0.1 0 O-C-N 120.866 -1.147 . . . . 2.71 109.656 170.702 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 2.0 tp -40.63 122.8 0.34 Allowed 'Isoleucine or valine' 0 CA--C 1.535 0.382 0 C-N-CA 124.168 0.987 . . . . 4.5700000000000003 109.556 174.173 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.92 80.77 0.47 Allowed 'General case' 0 C--O 1.226 -0.153 0 C-N-CA 123.973 0.909 . . . . 9.4199999999999999 109.542 -174.132 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 102' ' ' PHE . . . . . . . . . . . . . 0.8 OUTLIER -143.65 117.19 9.16 Favored 'General case' 0 N--CA 1.447 -0.583 0 N-CA-C 107.398 -1.334 . . . . 6.21 107.398 -172.198 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 19.1 tt -132.9 -38.77 0.51 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.233 0 C-N-CA 123.975 0.91 . . . . 5.1799999999999997 110.773 -176.996 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 104' ' ' ILE . . . . . . . . . . . . . 6.6 tp -131.88 -57.73 0.83 Allowed 'Isoleucine or valine' 0 N--CA 1.453 -0.315 0 N-CA-C 108.021 -1.103 . . . . 6.5 108.021 177.235 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 59.3 t30 -154.13 173.17 16.43 Favored 'General case' 0 C--O 1.235 0.315 0 N-CA-C 107.535 -1.283 . . . . 7.6399999999999997 107.535 174.386 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 20.3 t . . . . . 0 C--O 1.25 1.093 0 CA-C-O 115.739 -2.077 . . . . 10.449999999999999 108.285 155.326 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.473 1.157 0 N-CA-C 110.496 -1.042 . . . . 11.43 110.496 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -128.66 -44.97 1.33 Allowed 'General case' 0 C--O 1.223 -0.307 0 CA-C-N 117.399 0.599 . . . . 11.43 110.785 -148.785 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 58.18 -153.99 0.37 Allowed 'General case' 0 CA--C 1.538 0.509 0 CA-C-O 117.976 -1.011 . . . . 15.880000000000001 108.929 -171.722 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -107.08 -116.41 4.11 Favored Glycine 0 C--N 1.337 0.621 0 CA-C-N 119.469 1.032 . . . . 10.91 110.716 -166.168 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 19.7 m -77.59 -167.68 0.08 OUTLIER 'Isoleucine or valine' 0 N--CA 1.447 -0.62 0 N-CA-C 109.381 -0.6 . . . . 11.539999999999999 109.381 175.146 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 2.4 pm0 -76.7 112.48 13.32 Favored 'General case' 0 N--CA 1.443 -0.813 0 CA-C-O 122.767 1.27 . . . . 9.1600000000000001 112.168 176.979 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . 0.46 ' H ' HD22 ' A' ' 7' ' ' LEU . 0.0 OUTLIER -147.88 43.85 1.07 Allowed 'General case' 0 N--CA 1.451 -0.402 0 C-N-CA 124.243 1.017 . . . . 7.3799999999999999 110.033 175.35 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 42.3 mtp180 72.25 -61.57 0.49 Allowed 'General case' 0 N--CA 1.468 0.456 0 C-N-CA 126.61 1.964 . . . . 8.5500000000000007 111.829 -179.251 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -50.82 -36.03 35.25 Favored 'General case' 0 CA--C 1.514 -0.426 0 C-N-CA 126.1 1.76 . . . . 3.8100000000000001 113.578 177.912 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -55.68 -59.78 4.37 Favored 'General case' 0 C--N 1.323 -0.546 0 C-N-CA 123.614 0.766 . . . . 3.8300000000000001 109.828 170.217 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 6.9 m -63.92 -49.05 74.17 Favored 'General case' 0 N--CA 1.449 -0.522 0 CA-C-O 121.901 0.858 . . . . 2.1200000000000001 109.801 -168.83 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 6.7 pt-20 -66.22 -34.91 79.09 Favored 'General case' 0 N--CA 1.45 -0.453 0 CA-C-N 115.477 -0.783 . . . . 3.9900000000000002 109.579 179.459 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -59.07 -45.91 94.55 Favored Glycine 0 CA--C 1.528 0.893 0 N-CA-C 111.526 -0.63 . . . . 0.97999999999999998 111.526 172.779 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -59.84 -57.88 10.98 Favored 'General case' 0 N--CA 1.451 -0.407 0 C-N-CA 125.144 1.378 . . . . 3.7000000000000002 108.441 -173.758 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 0.6 OUTLIER -69.41 -24.88 28.01 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.306 0 CA-C-N 115.815 -0.63 . . . . 0.64000000000000001 112.317 179.631 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 1.0 OUTLIER -59.41 -54.14 50.13 Favored 'General case' 0 N--CA 1.455 -0.215 0 N-CA-C 106.753 -1.573 . . . . 0.47999999999999998 106.753 175.28 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 2.6 mt-10 -59.45 -35.56 74.27 Favored 'General case' 0 CA--C 1.516 -0.348 0 CA-C-O 118.254 -0.879 . . . . 3.5800000000000001 111.189 179.22 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 10.0 t80 -52.43 -47.47 66.35 Favored 'General case' 0 C--N 1.333 -0.146 0 CA-C-N 119.001 0.819 . . . . 3.1699999999999999 110.815 173.984 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -49.75 -48.8 36.03 Favored Glycine 0 CA--C 1.525 0.658 0 N-CA-C 111.478 -0.649 . . . . 0.42999999999999999 111.478 172.148 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 20' ' ' HIS . . . . . 0.513 ' CE1' ' HB1' ' A' ' 64' ' ' ALA . 1.8 t-160 -63.01 -41.74 99.64 Favored 'General case' 0 N--CA 1.454 -0.274 0 O-C-N 121.66 -0.906 . . . . 1.9399999999999999 111.663 -178.504 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -62.14 -32.98 73.64 Favored 'General case' 0 N--CA 1.449 -0.482 0 N-CA-C 109.684 -0.487 . . . . 0.71999999999999997 109.684 178.817 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 93.9 t -67.44 -40.35 84.38 Favored 'Isoleucine or valine' 0 C--O 1.233 0.209 0 C-N-CA 119.611 -0.836 . . . . 0.77000000000000002 110.121 175.112 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -62.08 -20.02 63.57 Favored 'General case' 0 CA--C 1.527 0.088 0 CA-C-O 119.46 -0.305 . . . . 2.2000000000000002 111.292 176.145 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 17.6 t70 -63.92 -57.27 10.3 Favored 'General case' 0 N--CA 1.454 -0.241 0 N-CA-C 109.076 -0.713 . . . . 2.9100000000000001 109.076 -179.377 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 63.7 t80 -54.94 -52.48 62.85 Favored 'General case' 0 CA--C 1.521 -0.168 0 C-N-CA 123.196 0.598 . . . . 3.8700000000000001 110.217 178.844 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -58.92 -34.69 72.01 Favored 'General case' 0 N--CA 1.45 -0.47 0 C-N-CA 120.364 -0.534 . . . . 0.93000000000000005 111.282 -177.721 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -69.21 -46.97 55.62 Favored Glycine 0 C--O 1.224 -0.509 0 N-CA-C 110.359 -1.096 . . . . 1.1000000000000001 110.359 178.209 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -54.67 -48.22 72.64 Favored 'General case' 0 N--CA 1.454 -0.254 0 C-N-CA 125.084 1.353 . . . . 2.23 110.029 -176.993 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 3.2 mm? -76.14 -41.03 51.26 Favored 'General case' 0 N--CA 1.445 -0.678 0 C-N-CA 123.847 0.859 . . . . 1.97 111.871 -178.423 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 11.2 mt -112.42 52.12 0.79 Allowed 'General case' 0 N--CA 1.454 -0.247 0 N-CA-C 107.713 -1.217 . . . . 2.3700000000000001 107.713 -170.955 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 24.5 t0 -72.43 149.27 44.39 Favored 'General case' 0 CA--C 1.53 0.21 0 CA-C-N 115.525 -0.762 . . . . 6.4900000000000002 110.983 -165.98 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 2.1 pttt -162.63 -43.25 0.04 OUTLIER 'General case' 0 N--CA 1.455 -0.204 0 C-N-CA 124.962 1.305 . . . . 12.449999999999999 111.113 -173.718 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 54.8 t-20 -113.89 110.56 20.3 Favored 'General case' 0 N--CA 1.45 -0.438 0 N-CA-C 108.091 -1.077 . . . . 9.0899999999999999 108.091 -166.582 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 3.1 mt-30 -61.03 -11.62 8.91 Favored 'General case' 0 CA--C 1.534 0.336 0 N-CA-C 113.83 1.048 . . . . 7.6900000000000004 113.83 -174.554 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 18.7 t -138.11 30.85 2.44 Favored 'General case' 0 N--CA 1.454 -0.23 0 CA-C-N 119.454 1.025 . . . . 8.3699999999999992 110.806 177.697 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 5.2 t0 -150.73 -168.39 3.09 Favored 'General case' 0 CA--C 1.533 0.312 0 N-CA-C 107.465 -1.309 . . . . 8.0600000000000005 107.465 167.763 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 3.3 mm? -117.96 -157.07 0.66 Allowed 'General case' 0 CA--C 1.536 0.415 0 N-CA-C 108.228 -1.027 . . . . 2.5499999999999998 108.228 -175.91 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 14.0 p -57.1 -40.41 72.92 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.275 0 O-C-N 121.076 -1.015 . . . . 2.3900000000000001 109.879 177.594 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 39' ' ' THR . . . . . . . . . . . . 0.264 1.0 OUTLIER 27.03 84.41 0.01 OUTLIER 'General case' 0 CA--C 1.55 0.979 0 C-N-CA 126.271 1.828 . . . . 2.8700000000000001 113.218 175.697 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 76.0 m-20 53.86 27.74 7.57 Favored 'General case' 0 CA--C 1.537 0.472 0 C-N-CA 127.255 2.222 . . . . 7.8799999999999999 116.581 174.983 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 58.1 m -36.19 -56.36 0.76 Allowed 'General case' 0 N--CA 1.47 0.539 0 N-CA-C 116.056 1.872 . . . . 3.1899999999999999 116.056 -178.155 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . 0.414 ' HE2' ' O ' ' A' ' 42' ' ' LYS . 1.2 tmtt? -57.0 -32.64 66.33 Favored 'General case' 0 N--CA 1.465 0.288 0 CA-C-N 119.264 0.938 . . . . 7.04 112.181 -172.054 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 2.1 ttmp? -124.28 63.99 1.08 Allowed 'General case' 0 N--CA 1.453 -0.296 0 N-CA-C 106.388 -1.708 . . . . 7.3200000000000003 106.388 172.6 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 37.6 p90 -46.32 114.07 0.74 Allowed 'General case' 0 N--CA 1.448 -0.527 0 C-N-CA 125.697 1.599 . . . . 5.3099999999999996 110.067 -176.608 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . 0.269 0.1 OUTLIER 60.66 73.09 0.1 OUTLIER 'Isoleucine or valine' 0 CA--C 1.542 0.636 0 CA-C-O 123.107 1.432 . . . . 2.8199999999999998 110.709 173.37 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 10.0 t0 -156.89 -60.73 0.09 Allowed 'General case' 0 N--CA 1.465 0.278 0 O-C-N 120.109 -1.62 . . . . 2.1899999999999999 109.608 -179.083 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 9.4 mm -51.4 -51.8 22.82 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.481 0 C-N-CA 125.711 1.604 . . . . 0.45000000000000001 108.651 173.79 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 32.5 t80 -62.5 -32.4 73.3 Favored 'General case' 0 N--CA 1.45 -0.448 0 O-C-N 120.422 -1.424 . . . . 0.40999999999999998 113.357 175.728 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -63.42 -50.93 67.85 Favored 'General case' 0 N--CA 1.455 -0.186 0 C-N-CA 118.209 -1.396 . . . . 1.4199999999999999 110.116 -176.135 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 31.3 mt-10 -79.94 -66.59 0.86 Allowed 'General case' 0 N--CA 1.454 -0.275 0 N-CA-C 108.669 -0.863 . . . . 3.71 108.669 -178.699 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 17.1 mp0 -71.83 -28.44 63.57 Favored 'General case' 0 C--O 1.236 0.384 0 O-C-N 121.865 -0.522 . . . . 2.6299999999999999 110.589 -165.808 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . 0.401 ' HA2' ' CD1' ' A' ' 66' ' ' PHE . . . -70.6 38.74 0.48 Allowed Glycine 0 CA--C 1.529 0.91 0 C-N-CA 124.874 1.226 . . . . 0.34999999999999998 113.686 169.603 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 36.1 p -148.88 29.94 0.81 Allowed 'General case' 0 N--CA 1.446 -0.645 0 O-C-N 120.832 -1.393 . . . . 1.79 109.983 158.328 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 2.7 t-20 -141.04 -42.1 0.39 Allowed 'General case' 0 CA--C 1.52 -0.199 0 N-CA-C 113.005 0.743 . . . . 1.95 113.005 -170.946 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 31.1 mt -59.18 -38.05 78.89 Favored 'General case' 0 N--CA 1.463 0.199 0 CA-C-O 120.874 0.369 . . . . 0.65000000000000002 111.2 -175.66 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -179.12 171.1 1.38 Allowed 'General case' 0 CA--C 1.533 0.312 0 C-N-CA 125.356 1.462 . . . . 0.78000000000000003 107.35 -179.585 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 13.3 m -61.63 -36.41 80.69 Favored 'General case' 0 CA--C 1.53 0.209 0 O-C-N 121.648 -0.657 . . . . 0.96999999999999997 110.506 169.413 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -69.13 -4.31 16.87 Favored 'General case' 0 CA--C 1.533 0.321 0 N-CA-C 112.346 0.499 . . . . 1.3200000000000001 112.346 172.82 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -91.87 -7.88 64.02 Favored Glycine 0 N--CA 1.444 -0.817 0 CA-C-O 118.66 -1.078 . . . . 0.52000000000000002 111.071 173.632 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 4.1 tmt_? -111.8 -12.86 13.77 Favored 'General case' 0 C--N 1.338 0.082 0 CA-C-N 119.095 1.447 . . . . 2.9199999999999999 112.162 -178.656 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 17.6 p -64.57 -161.09 0.01 OUTLIER 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 124.372 1.069 . . . . 0.83999999999999997 109.542 168.439 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 85.8 m-20 -51.87 147.51 6.88 Favored 'General case' 0 C--N 1.34 0.165 0 O-C-N 120.699 -1.251 . . . . 1.5900000000000001 111.162 -176.651 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 28.6 tt0 -60.74 -25.0 66.15 Favored 'General case' 0 CA--C 1.536 0.415 0 CA-C-O 121.775 0.798 . . . . 3.3199999999999998 111.094 -175.829 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 64' ' ' ALA . . . . . 0.513 ' HB1' ' CE1' ' A' ' 20' ' ' HIS . . . -58.39 -47.16 84.77 Favored 'General case' 0 N--CA 1.452 -0.374 0 C-N-CA 124.823 1.249 . . . . 0.47999999999999998 112.829 169.86 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 12.3 mt-10 -69.48 -42.52 74.7 Favored 'General case' 0 CA--C 1.514 -0.409 0 O-C-N 121.466 -0.771 . . . . 2.0800000000000001 110.258 179.148 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 66' ' ' PHE . . . . . 0.401 ' CD1' ' HA2' ' A' ' 52' ' ' GLY . 53.9 t80 -49.34 -52.54 27.37 Favored 'General case' 0 N--CA 1.453 -0.297 0 C-N-CA 123.288 0.635 . . . . 0.37 110.814 174.462 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 75.8 t80 -59.78 -43.65 94.3 Favored 'General case' 0 N--CA 1.451 -0.415 0 C-N-CA 122.581 0.352 . . . . 0.39000000000000001 110.842 177.55 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -62.27 -45.62 92.46 Favored 'General case' 0 CA--C 1.54 0.572 0 O-C-N 121.404 -0.81 . . . . 0.28999999999999998 111.762 -176.404 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 15.2 mm-40 -59.93 -43.43 94.95 Favored 'General case' 0 CA--C 1.521 -0.141 0 C-N-CA 123.505 0.722 . . . . 4.1299999999999999 109.651 173.318 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -55.77 -43.51 76.81 Favored 'General case' 0 N--CA 1.451 -0.412 0 N-CA-C 109.791 -0.448 . . . . 0.52000000000000002 109.791 -179.705 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 7.2 t80 -61.28 -50.4 73.16 Favored 'General case' 0 CA--C 1.531 0.232 0 C-N-CA 123.065 0.546 . . . . 2.6099999999999999 111.578 178.332 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 17.2 ttt180 -46.76 -59.36 3.1 Favored 'General case' 0 N--CA 1.468 0.426 0 C-N-CA 124.225 1.01 . . . . 2.2200000000000002 109.789 175.251 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . 0.665 HD12 HG23 ' A' ' 85' ' ' VAL . 0.2 OUTLIER -65.16 -27.78 68.95 Favored 'General case' 0 N--CA 1.451 -0.412 0 C-N-CA 124.729 1.212 . . . . 0.57999999999999996 110.748 -175.351 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 2.0 ttp -58.43 -39.93 81.12 Favored 'General case' 0 C--O 1.234 0.272 0 CA-C-O 121.306 0.574 . . . . 2.5899999999999999 111.552 -178.052 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 15.1 p80 -94.46 -42.96 8.58 Favored 'General case' 0 C--O 1.223 -0.31 0 CA-C-O 116.063 -1.923 . . . . 2.1499999999999999 112.561 178.283 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 53.6 p 3.56 112.58 0.0 OUTLIER 'General case' 0 N--CA 1.472 0.643 0 C-N-CA 128.617 2.767 . . . . 2.2200000000000002 114.602 -171.288 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 2.3 p -41.05 -44.43 2.43 Favored 'General case' 0 N--CA 1.455 -0.209 0 C-N-CA 125.703 1.601 . . . . 1.1899999999999999 111.678 178.677 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 57.1 t0 -76.56 106.31 8.13 Favored 'General case' 0 N--CA 1.452 -0.349 0 C-N-CA 117.072 -1.851 . . . . 2.1099999999999999 108.649 166.886 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 5.3 p-80 -42.44 -35.63 1.09 Allowed 'General case' 0 N--CA 1.454 -0.258 0 C-N-CA 124.474 1.11 . . . . 4.3799999999999999 112.758 171.415 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -56.61 -47.88 78.67 Favored 'General case' 0 N--CA 1.449 -0.485 0 C-N-CA 123.149 0.58 . . . . 0.96999999999999997 110.415 -178.955 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -54.37 -34.36 61.02 Favored 'General case' 0 CA--C 1.515 -0.374 0 C-N-CA 122.489 0.316 . . . . 3.75 111.343 -179.286 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 3.5 mtp-105 -63.28 -51.97 63.96 Favored 'General case' 0 N--CA 1.447 -0.588 0 N-CA-C 108.642 -0.873 . . . . 3.4300000000000002 108.642 177.937 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . 0.403 HD13 ' HA ' ' A' ' 83' ' ' LEU . 2.4 mm? -61.42 -25.81 67.45 Favored 'General case' 0 N--CA 1.453 -0.315 0 CA-C-O 118.092 -0.956 . . . . 0.67000000000000004 112.276 177.908 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 2.4 mptm? -62.53 -46.0 90.42 Favored 'General case' 0 CA--C 1.52 -0.19 0 CA-C-N 120.37 1.441 . . . . 1.4099999999999999 108.504 173.681 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 85' ' ' VAL . . . . . 0.665 HG23 HD12 ' A' ' 73' ' ' LEU . 86.3 t -62.66 -63.75 0.77 Allowed 'Isoleucine or valine' 0 C--O 1.217 -0.652 0 CA-C-O 118.356 -0.831 . . . . 0.56000000000000005 109.795 174.712 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -47.82 -51.01 24.28 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 119.53 1.059 . . . . 1.8500000000000001 111.514 -171.869 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 13.5 pttp -66.06 -40.08 90.63 Favored 'General case' 0 CA--C 1.532 0.276 0 O-C-N 121.991 -0.443 . . . . 3.6499999999999999 110.722 -177.24 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 55.1 m-20 -82.07 -7.43 59.61 Favored 'General case' 0 CA--C 1.534 0.351 0 CA-C-N 118.178 0.445 . . . . 0.94999999999999996 111.244 -179.776 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -158.57 74.51 3.65 Favored Pre-proline 0 N--CA 1.448 -0.553 0 C-N-CA 125.477 1.511 . . . . 0.34999999999999998 108.907 -170.326 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 67.8 Cg_endo -81.6 44.17 1.68 Allowed 'Trans proline' 0 CA--C 1.537 0.641 0 C-N-CA 124.234 3.289 . . . . 1.5900000000000001 111.254 -174.947 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -160.95 -56.31 0.05 Allowed 'General case' 0 N--CA 1.451 -0.382 0 C-N-CA 125.636 1.574 . . . . 2.5699999999999998 108.66 -176.1 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 2.5 m -49.22 -48.6 45.35 Favored 'General case' 0 N--CA 1.464 0.256 0 C-N-CA 123.822 0.849 . . . . 0.34000000000000002 111.359 176.603 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 6.5 t80 -59.55 -51.19 70.89 Favored 'General case' 0 CA--C 1.509 -0.61 0 CA-C-O 121.348 0.594 . . . . 2.0699999999999998 110.561 -179.301 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 32.2 tt0 -59.93 -28.19 67.41 Favored 'General case' 0 N--CA 1.442 -0.847 0 CA-C-N 114.928 -1.033 . . . . 1.8300000000000001 110.207 -178.315 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 8.4 t80 -65.35 -56.93 9.87 Favored 'General case' 0 N--CA 1.452 -0.333 0 C-N-CA 124.068 0.947 . . . . 1.6000000000000001 109.423 -175.136 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 3.4 mp -59.06 -41.51 83.65 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.161 0 N-CA-C 108.924 -0.769 . . . . 0.89000000000000001 108.924 174.832 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -60.13 -30.44 69.29 Favored 'General case' 0 CA--C 1.536 0.419 0 CA-C-N 118.03 0.377 . . . . 1.6899999999999999 111.208 -178.85 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 10.3 t70 -70.69 -45.02 65.78 Favored 'General case' 0 CA--C 1.522 -0.102 0 C-N-CA 123.771 0.828 . . . . 2.3399999999999999 109.302 177.104 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 54.0 mm-40 -63.13 -56.29 18.07 Favored 'General case' 0 N--CA 1.451 -0.405 0 CA-C-N 115.861 -0.609 . . . . 2.7599999999999998 111.088 -176.501 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -74.36 87.54 0.58 Allowed 'Isoleucine or valine' 0 CA--C 1.532 0.256 0 CA-C-O 121.924 0.869 . . . . 4.9699999999999998 110.455 -175.997 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 2.8 mmpt? -115.47 -63.29 1.48 Allowed 'General case' 0 CA--C 1.52 -0.206 0 C-N-CA 123.897 0.879 . . . . 10.67 108.659 176.13 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 102' ' ' PHE . . . . . . . . . . . . . 26.3 m-85 -141.81 121.29 13.25 Favored 'General case' 0 N--CA 1.45 -0.462 0 N-CA-C 106.257 -1.757 . . . . 8.8200000000000003 106.257 172.41 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -133.87 -50.83 0.62 Allowed 'Isoleucine or valine' 0 N--CA 1.455 -0.212 0 N-CA-C 108.011 -1.107 . . . . 6.2400000000000002 108.011 174.328 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 104' ' ' ILE . . . . . . . . . . . . . 9.5 tt -145.59 179.6 1.09 Allowed 'Isoleucine or valine' 0 N--CA 1.452 -0.337 0 N-CA-C 106.543 -1.651 . . . . 7.1500000000000004 106.543 169.618 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 49.9 t30 -137.39 139.71 40.91 Favored 'General case' 0 N--CA 1.455 -0.223 0 N-CA-C 107.994 -1.113 . . . . 11.33 107.994 178.462 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 49.3 m . . . . . 0 C--O 1.249 1.056 0 CA-C-O 116.975 -1.488 . . . . 10.289999999999999 110.384 -159.147 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.47 0.958 0 N-CA-C 107.16 -2.376 . . . . 18.289999999999999 107.16 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 14.8 m 61.44 170.5 0.11 Allowed 'General case' 0 CA--C 1.536 0.441 0 O-C-N 124.393 0.702 . . . . 19.41 110.563 -160.315 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 17.4 ptpt -155.4 158.57 38.85 Favored 'General case' 0 N--CA 1.458 -0.071 0 N-CA-C 108.082 -1.081 . . . . 27.789999999999999 108.082 174.436 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 161.19 162.88 13.23 Favored Glycine 0 N--CA 1.451 -0.313 0 N-CA-C 109.44 -1.464 . . . . 18.16 109.44 176.581 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . 0.514 HG23 HD11 ' A' ' 7' ' ' LEU . 0.2 OUTLIER -74.96 -176.94 0.26 Allowed 'Isoleucine or valine' 0 N--CA 1.445 -0.697 0 CA-C-O 121.184 0.516 . . . . 17.609999999999999 110.392 164.564 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 7.8 pt-20 -108.85 109.69 20.85 Favored 'General case' 0 N--CA 1.44 -0.928 0 C-N-CA 123.865 0.866 . . . . 12.699999999999999 110.331 -170.832 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . 0.514 HD11 HG23 ' A' ' 5' ' ' VAL . 0.0 OUTLIER -150.21 26.18 0.79 Allowed 'General case' 0 N--CA 1.454 -0.271 0 C-N-CA 125.881 1.672 . . . . 11.0 110.974 -175.658 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 41.0 mtp180 -150.35 119.07 6.56 Favored 'General case' 0 N--CA 1.452 -0.352 0 N-CA-C 107.857 -1.164 . . . . 11.289999999999999 107.857 172.889 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 2.3 m120 -51.51 -33.65 32.67 Favored 'General case' 0 C--O 1.221 -0.418 0 C-N-CA 123.739 0.816 . . . . 2.9700000000000002 111.65 169.875 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 7.1 t0 -57.85 -52.13 66.76 Favored 'General case' 0 N--CA 1.447 -0.601 0 C-N-CA 124.04 0.936 . . . . 2.6400000000000001 110.61 175.438 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 13.4 m -69.41 -46.84 65.88 Favored 'General case' 0 CA--C 1.534 0.355 0 O-C-N 120.968 -1.082 . . . . 1.8999999999999999 112.338 -179.764 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 1.9 mt-10 -62.81 -36.29 82.69 Favored 'General case' 0 N--CA 1.464 0.225 0 CA-C-O 122.175 0.988 . . . . 3.2799999999999998 109.8 -179.048 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -65.42 -50.85 53.34 Favored Glycine 0 N--CA 1.449 -0.464 0 N-CA-C 109.231 -1.547 . . . . 0.75 109.231 175.215 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -48.92 -59.11 3.87 Favored 'General case' 0 C--O 1.224 -0.277 0 C-N-CA 124.527 1.131 . . . . 3.71 110.464 -179.114 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 0.5 OUTLIER -61.92 -34.67 64.03 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.348 0 O-C-N 121.709 -0.619 . . . . 0.38 111.948 -176.505 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 6.6 t60 -60.05 -55.52 32.92 Favored 'General case' 0 CA--C 1.532 0.269 0 N-CA-C 107.207 -1.405 . . . . 0.55000000000000004 107.207 178.051 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 31.7 mt-10 -56.87 -38.29 72.53 Favored 'General case' 0 N--CA 1.453 -0.301 0 C-N-CA 124.152 0.981 . . . . 1.9399999999999999 111.832 178.654 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 1.7 m-85 -54.94 -49.17 72.01 Favored 'General case' 0 CA--C 1.517 -0.295 0 CA-C-N 119.42 1.009 . . . . 3.0800000000000001 109.661 176.165 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -50.01 -45.87 41.75 Favored Glycine 0 CA--C 1.525 0.694 0 N-CA-C 110.804 -0.918 . . . . 0.41999999999999998 110.804 174.866 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 20' ' ' HIS . . . . . 0.518 ' CE1' ' HB1' ' A' ' 64' ' ' ALA . 1.8 t60 -62.16 -45.6 92.69 Favored 'General case' 0 N--CA 1.451 -0.398 0 O-C-N 121.896 -0.767 . . . . 1.79 111.783 179.458 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -64.61 -28.0 69.33 Favored 'General case' 0 N--CA 1.454 -0.271 0 O-C-N 121.199 -0.938 . . . . 0.60999999999999999 110.228 179.619 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 92.7 t -71.67 -37.45 63.04 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.168 0 O-C-N 120.921 -1.112 . . . . 0.71999999999999997 109.682 176.242 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 8.6 t70 -56.78 -30.19 63.41 Favored 'General case' 0 C--N 1.334 -0.101 0 CA-C-O 121.179 0.514 . . . . 2.23 111.136 172.895 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 22.7 t70 -68.61 -50.17 53.56 Favored 'General case' 0 N--CA 1.452 -0.346 0 N-CA-C 108.885 -0.783 . . . . 2.1299999999999999 108.885 -176.536 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 44.2 t80 -58.46 -45.28 88.91 Favored 'General case' 0 N--CA 1.455 -0.206 0 CA-C-N 116.127 -0.488 . . . . 3.1000000000000001 110.507 177.665 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -57.77 -35.82 71.28 Favored 'General case' 0 N--CA 1.454 -0.245 0 CA-C-O 119.259 -0.401 . . . . 0.98999999999999999 111.299 176.789 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -62.87 -61.58 6.32 Favored Glycine 0 C--N 1.333 0.376 0 N-CA-C 109.759 -1.336 . . . . 1.22 109.759 176.018 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -50.61 -50.11 54.9 Favored 'General case' 0 N--CA 1.454 -0.247 0 C-N-CA 125.015 1.326 . . . . 2.0299999999999998 111.069 -174.136 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -76.53 -33.87 58.57 Favored 'General case' 0 CA--C 1.514 -0.44 0 N-CA-C 112.851 0.685 . . . . 1.3899999999999999 112.851 -175.701 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 10.1 mt -112.99 33.04 5.28 Favored 'General case' 0 N--CA 1.455 -0.22 0 N-CA-C 108.861 -0.792 . . . . 2.3100000000000001 108.861 -171.127 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 65.8 t0 -57.27 131.42 49.96 Favored 'General case' 0 N--CA 1.452 -0.365 0 C-N-CA 124.362 1.065 . . . . 6.2599999999999998 108.857 179.511 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 5.1 ptmt -176.83 -43.88 0.01 OUTLIER 'General case' 0 CA--C 1.517 -0.295 0 C-N-CA 124.649 1.18 . . . . 8.8399999999999999 109.987 -174.859 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -74.91 164.61 26.38 Favored 'General case' 0 N--CA 1.449 -0.509 0 N-CA-C 108.118 -1.067 . . . . 9.1199999999999992 108.118 175.138 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 1.2 mm-40 -66.3 -27.88 68.26 Favored 'General case' 0 CA--C 1.533 0.319 0 C-N-CA 120.213 -0.595 . . . . 7.29 110.119 172.806 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 3.1 m -59.74 134.1 56.71 Favored 'General case' 0 N--CA 1.449 -0.491 0 C-N-CA 124.522 1.129 . . . . 6.21 112.061 178.165 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 38.5 t70 -67.9 -24.27 65.2 Favored 'General case' 0 CA--C 1.536 0.425 0 C-N-CA 124.9 1.28 . . . . 5.6100000000000003 112.66 179.846 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 4.2 mp -117.62 175.05 5.82 Favored 'General case' 0 CA--C 1.528 0.097 0 N-CA-C 108.266 -1.013 . . . . 1.96 108.266 175.269 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 11.5 p -71.81 9.21 0.34 Allowed 'Isoleucine or valine' 0 CA--C 1.552 1.032 0 O-C-N 121.173 -0.954 . . . . 2.3199999999999998 112.917 -177.036 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 10.0 t -59.53 84.59 0.01 OUTLIER 'General case' 0 CA--C 1.537 0.473 0 C-N-CA 127.971 2.508 . . . . 4.1100000000000003 110.753 175.358 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER 171.2 -35.87 0.0 OUTLIER 'General case' 0 N--CA 1.463 0.22 0 C-N-CA 126.064 1.746 . . . . 6.2699999999999996 111.741 174.102 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 7.6 t -68.88 174.23 4.61 Favored 'General case' 0 CA--C 1.535 0.376 0 CA-C-O 121.314 0.578 . . . . 3.7400000000000002 112.291 -167.432 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 26.9 tptt 70.05 98.78 0.06 Allowed 'General case' 0 CA--C 1.53 0.21 0 C-N-CA 126.999 2.119 . . . . 7.04 108.727 -167.791 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 2.9 mmpt? 49.26 -113.43 0.61 Allowed 'General case' 0 CA--C 1.531 0.245 0 CA-C-O 117.762 -1.113 . . . . 7.1799999999999997 108.269 -166.772 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -142.83 92.62 2.42 Favored 'General case' 0 N--CA 1.453 -0.285 0 CA-C-N 119.684 1.129 . . . . 4.7000000000000002 108.015 176.668 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . 0.259 10.2 tt 49.69 21.18 0.09 OUTLIER 'Isoleucine or valine' 0 CA--C 1.549 0.921 0 C-N-CA 126.562 1.945 . . . . 2.9199999999999999 113.552 177.103 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 6.8 m-20 -65.39 -44.62 86.93 Favored 'General case' 0 N--CA 1.463 0.177 0 O-C-N 120.557 -1.339 . . . . 3.6099999999999999 111.271 -170.389 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 3.2 mm -53.13 -50.96 43.35 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.232 0 C-N-CA 124.268 1.027 . . . . 0.46999999999999997 109.416 -176.259 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 24.6 t80 -64.07 -36.76 85.07 Favored 'General case' 0 N--CA 1.451 -0.378 0 O-C-N 121.614 -0.679 . . . . 0.38 111.396 177.15 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . 0.514 ' HA ' ' HE2' ' A' ' 49' ' ' LYS . 0.3 OUTLIER -60.3 -47.2 87.04 Favored 'General case' 0 C--N 1.33 -0.246 0 C-N-CA 118.791 -1.164 . . . . 1.0900000000000001 111.615 -177.292 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 3.5 tp10 -86.42 -59.64 2.22 Favored 'General case' 0 CA--C 1.532 0.268 0 CA-C-O 121.871 0.843 . . . . 2.8900000000000001 109.598 -176.27 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 19.2 mm-40 -73.57 -28.84 62.06 Favored 'General case' 0 CA--C 1.535 0.402 0 O-C-N 121.654 -0.654 . . . . 2.1899999999999999 110.621 -170.131 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -68.06 40.57 0.26 Allowed Glycine 0 CA--C 1.531 1.05 0 C-N-CA 126.509 2.004 . . . . 0.33000000000000002 114.715 172.332 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 20.9 t -146.45 22.59 1.31 Allowed 'General case' 0 N--CA 1.45 -0.432 0 O-C-N 120.778 -1.425 . . . . 1.8999999999999999 110.019 156.679 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -135.53 -23.3 1.44 Allowed 'General case' 0 C--N 1.342 0.282 0 N-CA-C 113.712 1.005 . . . . 2.2200000000000002 113.712 -167.539 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 22.0 mt -71.48 -41.65 69.09 Favored 'General case' 0 C--N 1.331 -0.233 0 O-C-N 121.404 -0.81 . . . . 0.41999999999999998 109.919 175.99 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 1.7 t 179.13 175.16 0.67 Allowed 'General case' 0 CA--C 1.533 0.305 0 C-N-CA 125.408 1.483 . . . . 0.52000000000000002 107.939 -174.741 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 39.4 t -60.88 -36.02 78.13 Favored 'General case' 0 CA--C 1.532 0.288 0 O-C-N 121.688 -0.632 . . . . 2.1699999999999999 109.781 168.888 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -65.59 -11.64 46.05 Favored 'General case' 0 N--CA 1.465 0.285 0 N-CA-C 112.468 0.544 . . . . 1.01 112.468 174.581 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -88.61 -7.17 72.2 Favored Glycine 0 C--O 1.221 -0.688 0 CA-C-O 119.124 -0.82 . . . . 0.39000000000000001 111.117 176.31 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 64.1 ttt180 -113.52 -14.1 12.72 Favored 'General case' 0 N--CA 1.458 -0.07 0 CA-C-N 118.875 1.337 . . . . 3.48 112.036 -178.672 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 19.9 p -64.48 -159.03 0.01 OUTLIER 'General case' 0 CA--C 1.539 0.536 0 C-N-CA 123.408 0.683 . . . . 0.78000000000000003 109.432 168.582 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 3.8 t-20 -53.05 145.85 12.35 Favored 'General case' 0 CA--C 1.53 0.196 0 O-C-N 120.403 -1.436 . . . . 1.75 110.271 -176.305 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -59.56 -31.87 69.83 Favored 'General case' 0 CA--C 1.535 0.368 0 CA-C-O 121.461 0.648 . . . . 3.3599999999999999 110.663 -176.278 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 64' ' ' ALA . . . . . 0.518 ' HB1' ' CE1' ' A' ' 20' ' ' HIS . . . -58.59 -36.19 73.6 Favored 'General case' 0 N--CA 1.453 -0.311 0 N-CA-C 112.968 0.729 . . . . 0.40999999999999998 112.968 174.531 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 8.1 mt-10 -70.93 -48.57 52.79 Favored 'General case' 0 CA--C 1.511 -0.533 0 CA-C-O 118.301 -0.857 . . . . 2.2200000000000002 110.261 174.599 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 30.6 t80 -46.49 -47.05 19.42 Favored 'General case' 0 CA--C 1.533 0.305 0 C-N-CA 124.385 1.074 . . . . 0.28000000000000003 111.448 175.145 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 78.9 t80 -65.33 -44.38 87.96 Favored 'General case' 0 CA--C 1.537 0.447 0 O-C-N 121.172 -0.955 . . . . 0.45000000000000001 111.12 177.29 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -66.16 -51.34 58.77 Favored 'General case' 0 CA--C 1.539 0.554 0 C-N-CA 123.959 0.904 . . . . 0.28000000000000003 112.668 -174.331 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -60.72 -40.06 90.92 Favored 'General case' 0 C--N 1.332 -0.186 0 O-C-N 120.858 -1.151 . . . . 3.5899999999999999 110.618 172.451 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -56.18 -40.68 74.31 Favored 'General case' 0 C--O 1.222 -0.362 0 CA-C-N 118.727 0.694 . . . . 0.51000000000000001 110.176 174.72 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -55.75 -49.89 71.88 Favored 'General case' 0 N--CA 1.465 0.298 0 C-N-CA 124.513 1.125 . . . . 3.4500000000000002 111.833 172.137 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -50.8 -56.65 11.11 Favored 'General case' 0 CA--C 1.531 0.236 0 N-CA-C 109.222 -0.659 . . . . 3.9300000000000002 109.222 176.739 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . 0.591 ' CB ' HG21 ' A' ' 85' ' ' VAL . 0.1 OUTLIER -66.4 -25.91 66.99 Favored 'General case' 0 C--N 1.327 -0.402 0 C-N-CA 124.346 1.059 . . . . 0.48999999999999999 111.236 -175.511 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 74' ' ' MET . . . . . 0.403 ' HA ' ' CE2' ' A' ' 93' ' ' PHE . 0.2 OUTLIER -63.49 -39.16 93.71 Favored 'General case' 0 C--O 1.231 0.125 0 CA-C-N 118.646 0.657 . . . . 2.3399999999999999 109.912 -179.42 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 7.1 p80 -97.62 -9.72 26.4 Favored 'General case' 0 CA--C 1.531 0.246 0 CA-C-O 116.277 -1.821 . . . . 0.96999999999999997 114.191 179.331 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 5.1 m -36.2 114.88 0.31 Allowed 'General case' 0 CA--C 1.512 -0.511 0 CA-C-N 120.698 1.59 . . . . 1.1200000000000001 111.162 -173.303 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -51.62 -37.25 49.3 Favored 'General case' 0 N--CA 1.448 -0.568 0 CA-C-N 114.259 -1.337 . . . . 1.04 110.7 -173.67 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 53.9 t0 -73.41 107.19 5.57 Favored 'General case' 0 N--CA 1.452 -0.365 0 C-N-CA 116.95 -1.9 . . . . 2.3999999999999999 109.563 164.955 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 20.9 p-80 -38.97 -38.22 0.43 Allowed 'General case' 0 N--CA 1.454 -0.234 0 C-N-CA 125.247 1.419 . . . . 4.5899999999999999 112.5 169.431 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -53.89 -54.67 35.48 Favored 'General case' 0 N--CA 1.449 -0.485 0 CA-C-N 118.197 0.453 . . . . 0.57999999999999996 109.789 -179.23 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -57.06 -35.88 69.86 Favored 'General case' 0 CA--C 1.514 -0.431 0 C-N-CA 122.957 0.503 . . . . 4.5800000000000001 111.852 -175.238 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 22.0 mtp180 -61.97 -50.03 73.74 Favored 'General case' 0 N--CA 1.449 -0.52 0 C-N-CA 119.744 -0.783 . . . . 2.2599999999999998 109.397 175.987 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 1.6 mm? -67.24 -18.54 65.27 Favored 'General case' 0 N--CA 1.456 -0.17 0 CA-C-O 118.093 -0.956 . . . . 0.53000000000000003 113.41 176.743 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 2.5 mptm? -65.44 -50.47 65.27 Favored 'General case' 0 CA--C 1.517 -0.294 0 CA-C-N 120.65 1.568 . . . . 1.4099999999999999 107.413 169.827 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 85' ' ' VAL . . . . . 0.591 HG21 ' CB ' ' A' ' 73' ' ' LEU . 94.4 t -57.39 -50.17 77.81 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.528 0 CA-C-O 118.85 -0.595 . . . . 0.46999999999999997 110.458 176.387 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -62.38 -52.56 63.13 Favored 'General case' 0 N--CA 1.45 -0.432 0 CA-C-N 119.472 1.033 . . . . 2.21 111.223 -173.518 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 29.5 pttt -63.58 -40.25 96.47 Favored 'General case' 0 CA--C 1.53 0.176 0 O-C-N 121.78 -0.575 . . . . 2.4900000000000002 109.96 -175.531 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 50.8 m-20 -72.14 -28.47 63.28 Favored 'General case' 0 C--O 1.224 -0.249 0 C-N-CA 122.763 0.425 . . . . 0.98999999999999999 110.635 -178.855 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -141.43 74.7 23.64 Favored Pre-proline 0 C--O 1.237 0.419 0 C-N-CA 125.901 1.68 . . . . 0.41999999999999998 108.914 -170.559 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 85.5 Cg_endo -78.29 68.55 7.9 Favored 'Trans proline' 0 N--CA 1.457 -0.655 0 C-N-CA 123.874 3.05 . . . . 1.8600000000000001 110.146 -171.307 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 1.2 ptmt 166.47 -55.23 0.0 OUTLIER 'General case' 0 C--O 1.224 -0.272 0 C-N-CA 126.432 1.893 . . . . 2.1800000000000002 111.204 -167.083 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 6.0 m -56.47 -44.03 80.18 Favored 'General case' 0 CA--C 1.518 -0.265 0 CA-C-N 120.071 1.305 . . . . 0.47999999999999998 110.514 -178.404 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 93' ' ' PHE . . . . . 0.403 ' CE2' ' HA ' ' A' ' 74' ' ' MET . 13.9 t80 -57.16 -48.87 77.65 Favored 'General case' 0 CA--C 1.513 -0.475 0 C-N-CA 120.073 -0.651 . . . . 2.0099999999999998 110.68 175.865 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 19.3 tt0 -59.87 -28.97 67.99 Favored 'General case' 0 N--CA 1.443 -0.779 0 CA-C-N 114.93 -1.032 . . . . 1.6399999999999999 110.844 -179.104 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 2.6 t80 -63.26 -57.02 11.81 Favored 'General case' 0 N--CA 1.457 -0.113 0 C-N-CA 124.258 1.023 . . . . 1.1200000000000001 109.133 -176.213 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 3.3 mp -60.24 -42.69 91.35 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.302 0 N-CA-C 108.498 -0.927 . . . . 0.83999999999999997 108.498 177.069 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 12.8 t-20 -56.89 -36.34 70.0 Favored 'General case' 0 CA--C 1.537 0.466 0 CA-C-N 117.836 0.289 . . . . 1.8999999999999999 111.589 -177.892 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -58.79 -49.75 76.5 Favored 'General case' 0 N--CA 1.462 0.144 0 C-N-CA 125.172 1.389 . . . . 2.1299999999999999 109.399 175.756 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 13.3 mm-40 -77.72 84.86 4.04 Favored 'General case' 0 N--CA 1.451 -0.392 0 CA-C-N 115.986 -0.552 . . . . 2.6400000000000001 109.92 179.954 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 2.2 pp -45.26 125.92 1.25 Allowed 'Isoleucine or valine' 0 CA--C 1.535 0.374 0 C-N-CA 124.352 1.061 . . . . 5.4800000000000004 111.664 -178.22 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -77.84 79.32 4.32 Favored 'General case' 0 N--CA 1.457 -0.084 0 O-C-N 121.537 -0.727 . . . . 10.94 110.077 -174.6 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 102' ' ' PHE . . . . . . . . . . . . . 9.4 t80 -142.69 99.93 3.57 Favored 'General case' 0 N--CA 1.454 -0.247 0 O-C-N 121.632 -0.667 . . . . 6.6299999999999999 109.222 178.077 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 6.7 tp -147.18 28.58 0.15 Allowed 'Isoleucine or valine' 0 CA--C 1.535 0.366 0 CA-C-O 121.663 0.744 . . . . 3.73 111.019 -177.946 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 104' ' ' ILE . . . . . . . . . . . . . 16.1 tt -154.92 146.85 13.29 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.241 0 N-CA-C 106.916 -1.513 . . . . 6.4699999999999998 106.916 179.788 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 79.5 m-20 53.4 84.73 0.06 Allowed 'General case' 0 N--CA 1.463 0.207 0 C-N-CA 124.785 1.234 . . . . 7.2000000000000002 110.972 -168.927 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 22.9 t . . . . . 0 C--O 1.25 1.122 0 CA-C-O 115.963 -1.97 . . . . 11.98 107.452 176.353 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.471 0.989 0 N-CA-C 108.804 -1.718 . . . . 19.440000000000001 108.804 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 12.4 m -155.41 172.84 17.56 Favored 'General case' 0 C--N 1.332 -0.163 0 N-CA-C 107.747 -1.205 . . . . 19.329999999999998 107.747 -176.211 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 3.9 ptpp? -155.36 157.08 36.55 Favored 'General case' 0 N--CA 1.457 -0.093 0 N-CA-C 108.861 -0.792 . . . . 25.32 108.861 -179.585 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 118.73 -168.03 13.18 Favored Glycine 0 C--N 1.332 0.326 0 N-CA-C 108.827 -1.709 . . . . 18.41 108.827 -175.092 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 34.4 m -78.72 -177.66 0.33 Allowed 'Isoleucine or valine' 0 N--CA 1.444 -0.756 0 N-CA-C 109.14 -0.689 . . . . 17.420000000000002 109.14 165.76 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 2.8 pm0 -77.7 121.03 23.45 Favored 'General case' 0 N--CA 1.449 -0.498 0 N-CA-C 113.146 0.795 . . . . 11.99 113.146 177.987 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -113.01 19.94 16.8 Favored 'General case' 0 C--N 1.343 0.293 0 C-N-CA 123.798 0.839 . . . . 10.050000000000001 111.263 -179.508 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 20.3 mtp180 -146.51 114.15 6.4 Favored 'General case' 0 N--CA 1.446 -0.656 0 N-CA-C 107.441 -1.318 . . . . 10.51 107.441 -172.799 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -47.18 -34.37 6.22 Favored 'General case' 0 C--O 1.222 -0.374 0 C-N-CA 124.956 1.302 . . . . 2.98 111.228 166.627 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -58.28 -51.81 68.22 Favored 'General case' 0 N--CA 1.449 -0.497 0 C-N-CA 123.523 0.729 . . . . 2.8500000000000001 111.294 173.79 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 17.2 m -65.01 -53.29 48.4 Favored 'General case' 0 CA--C 1.53 0.208 0 CA-C-N 118.971 0.805 . . . . 1.73 111.653 -178.385 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . 0.431 ' HB2' ' CZ ' ' A' ' 72' ' ' ARG . 16.2 pt-20 -70.2 -27.47 64.52 Favored 'General case' 0 CA--C 1.533 0.291 0 CA-C-O 121.707 0.765 . . . . 3.8599999999999999 110.483 -175.25 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -66.63 -47.6 67.58 Favored Glycine 0 N--CA 1.446 -0.698 0 N-CA-C 109.147 -1.581 . . . . 0.60999999999999999 109.147 172.313 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -54.31 -52.32 61.87 Favored 'General case' 0 CA--C 1.52 -0.175 0 CA-C-N 117.794 0.797 . . . . 3.6800000000000002 110.638 -173.712 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 0.7 OUTLIER -64.59 -38.88 83.77 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.303 0 N-CA-C 112.069 0.396 . . . . 0.45000000000000001 112.069 179.354 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 12.4 t60 -59.29 -56.18 25.37 Favored 'General case' 0 CA--C 1.53 0.184 0 N-CA-C 107.741 -1.207 . . . . 0.54000000000000004 107.741 -179.67 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 34.3 mt-10 -57.87 -37.55 74.13 Favored 'General case' 0 N--CA 1.451 -0.418 0 C-N-CA 124.406 1.083 . . . . 2.4199999999999999 111.057 178.507 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -54.47 -52.15 62.77 Favored 'General case' 0 CA--C 1.521 -0.165 0 CA-C-N 119.457 1.026 . . . . 3.48 109.871 173.878 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -47.82 -46.37 25.23 Favored Glycine 0 CA--C 1.526 0.75 0 N-CA-C 110.696 -0.961 . . . . 0.57999999999999996 110.696 173.849 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 20' ' ' HIS . . . . . 0.536 ' CE1' ' HB1' ' A' ' 64' ' ' ALA . 2.6 t60 -65.66 -45.97 80.9 Favored 'General case' 0 N--CA 1.454 -0.248 0 O-C-N 121.951 -0.735 . . . . 1.8 112.272 -177.883 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -61.78 -34.32 75.68 Favored 'General case' 0 N--CA 1.452 -0.353 0 O-C-N 120.925 -1.109 . . . . 1.1000000000000001 109.123 179.298 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 94.2 t -76.77 -26.88 16.48 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.428 0 C-N-CA 120.233 -0.587 . . . . 1.6299999999999999 110.284 179.509 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 34.7 t0 -57.87 -36.93 73.06 Favored 'General case' 0 N--CA 1.456 -0.171 0 CA-C-O 121.953 0.883 . . . . 2.3500000000000001 110.328 172.141 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 17.6 t70 -69.36 -53.13 21.05 Favored 'General case' 0 N--CA 1.449 -0.491 0 CA-C-O 121.78 0.8 . . . . 2.6499999999999999 108.948 -175.876 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 36.1 t80 -65.87 -50.91 62.83 Favored 'General case' 0 N--CA 1.452 -0.326 0 CA-C-N 115.463 -0.789 . . . . 2.3100000000000001 109.494 -173.858 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -53.21 -37.92 62.44 Favored 'General case' 0 N--CA 1.451 -0.388 0 C-N-CA 123.885 0.874 . . . . 1.73 111.264 174.24 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -58.01 -54.4 37.81 Favored Glycine 0 C--N 1.334 0.461 0 N-CA-C 109.762 -1.335 . . . . 2.5699999999999998 109.762 178.484 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 2.1 t80 -63.2 -46.15 88.4 Favored 'General case' 0 CA--C 1.533 0.303 0 CA-C-O 120.906 0.384 . . . . 4.8300000000000001 110.961 -177.036 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -73.8 -27.78 61.3 Favored 'General case' 0 N--CA 1.449 -0.521 0 N-CA-C 114.435 1.272 . . . . 3.0099999999999998 114.435 -171.921 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 38.7 mt -120.42 -70.82 0.77 Allowed 'General case' 0 N--CA 1.463 0.176 0 CA-C-N 119.783 1.174 . . . . 4.9100000000000001 113.073 -161.074 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 23.3 t0 -62.25 122.33 15.37 Favored 'General case' 0 C--N 1.337 0.042 0 N-CA-C 109.458 -0.571 . . . . 7.1500000000000004 109.458 -165.886 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 18.3 tptm -63.0 -19.81 64.71 Favored 'General case' 0 C--O 1.226 -0.152 0 N-CA-C 112.211 0.448 . . . . 9.7100000000000009 112.211 -165.448 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 18.4 t-20 -60.87 -41.19 95.46 Favored 'General case' 0 CA--C 1.531 0.228 0 C-N-CA 123.009 0.524 . . . . 8.4900000000000002 111.031 174.87 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 1.1 tm0? 73.62 -30.79 0.21 Allowed 'General case' 0 CA--C 1.531 0.234 0 C-N-CA 127.183 2.193 . . . . 9.6899999999999995 112.875 -177.425 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 14.3 m -67.36 162.31 23.2 Favored 'General case' 0 CA--C 1.531 0.247 0 CA-C-N 119.191 0.905 . . . . 6.7599999999999998 109.701 171.639 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 64.9 m-20 60.89 -145.65 0.46 Allowed 'General case' 0 CA--C 1.535 0.378 0 C-N-CA 124.726 1.21 . . . . 7.7699999999999996 110.831 -179.361 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 4.2 mp -123.24 -165.16 1.28 Allowed 'General case' 0 CA--C 1.532 0.282 0 N-CA-C 106.986 -1.487 . . . . 3.1000000000000001 106.986 -179.56 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 9.8 p -83.25 43.23 0.05 OUTLIER 'Isoleucine or valine' 0 CA--C 1.538 0.503 0 CA-C-N 120.667 1.576 . . . . 3.3199999999999998 110.089 177.702 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 13.3 t -143.78 139.31 29.31 Favored 'General case' 0 N--CA 1.446 -0.63 0 N-CA-C 104.836 -2.283 . . . . 4.2000000000000002 104.836 169.616 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 5.4 p30 131.39 -48.16 0.01 OUTLIER 'General case' 0 N--CA 1.47 0.545 0 C-N-CA 130.494 3.518 . . . . 6.3799999999999999 108.024 -168.252 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 9.9 t -76.86 179.19 6.3 Favored 'General case' 0 N--CA 1.454 -0.256 0 C-N-CA 124.531 1.132 . . . . 3.7000000000000002 110.997 -168.458 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . 0.43 ' HE3' ' OD2' ' A' ' 98' ' ' ASP . 21.4 tttm 71.05 -53.9 0.67 Allowed 'General case' 0 N--CA 1.467 0.412 0 C-N-CA 126.705 2.002 . . . . 6.8899999999999997 113.016 -177.187 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 9.7 ttmm -139.52 106.39 5.41 Favored 'General case' 0 N--CA 1.454 -0.242 0 N-CA-C 105.272 -2.121 . . . . 7.2000000000000002 105.272 176.106 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -51.44 96.57 0.01 OUTLIER 'General case' 0 N--CA 1.465 0.324 0 C-N-CA 125.637 1.575 . . . . 4.75 112.334 -161.404 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 5.9 tt 38.59 38.45 0.2 Allowed 'Isoleucine or valine' 0 CA--C 1.541 0.605 0 C-N-CA 126.023 1.729 . . . . 2.2799999999999998 111.51 -174.701 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 2.5 m-20 -92.92 -43.3 9.02 Favored 'General case' 0 CA--C 1.521 -0.169 0 O-C-N 120.773 -1.204 . . . . 3.2799999999999998 109.072 -177.162 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 11.3 mm -49.52 -56.6 2.81 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.229 0 C-N-CA 125.329 1.451 . . . . 0.68999999999999995 108.922 -178.443 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 28.9 t80 -61.69 -37.5 84.37 Favored 'General case' 0 N--CA 1.453 -0.311 0 C-N-CA 124.614 1.166 . . . . 0.51000000000000001 112.337 175.551 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . 0.464 ' HA ' ' HE2' ' A' ' 49' ' ' LYS . 0.2 OUTLIER -62.0 -45.17 94.77 Favored 'General case' 0 CA--C 1.519 -0.218 0 CA-C-N 119.652 1.115 . . . . 1.3700000000000001 111.1 -175.502 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 2.9 tp10 -80.19 -67.51 0.76 Allowed 'General case' 0 N--CA 1.451 -0.425 0 CA-C-O 122.387 1.089 . . . . 2.6200000000000001 108.962 179.074 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . 0.583 ' OE2' ' HE2' ' A' ' 91' ' ' LYS . 59.2 mm-40 -76.45 -19.69 57.8 Favored 'General case' 0 N--CA 1.453 -0.293 0 C-N-CA 123.389 0.675 . . . . 3.0499999999999998 111.51 -164.773 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -68.83 36.31 0.28 Allowed Glycine 0 CA--C 1.532 1.145 0 C-N-CA 124.393 0.997 . . . . 0.59999999999999998 113.12 167.684 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 59.9 p -148.84 23.63 0.97 Allowed 'General case' 0 N--CA 1.448 -0.532 0 O-C-N 120.444 -1.621 . . . . 1.8 110.855 161.488 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 58.7 t-20 -135.51 -43.52 0.69 Allowed 'General case' 0 CA--C 1.52 -0.209 0 CA-C-O 120.896 0.379 . . . . 2.3300000000000001 111.444 -160.15 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 20.6 mt -66.14 -37.16 85.0 Favored 'General case' 0 C--N 1.331 -0.205 0 C-N-CA 120.445 -0.502 . . . . 0.47999999999999998 110.674 -179.41 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 2.7 t 175.78 173.1 0.32 Allowed 'General case' 0 CA--C 1.533 0.301 0 C-N-CA 125.269 1.428 . . . . 0.60999999999999999 108.193 -173.136 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 8.8 p -64.04 -36.3 83.54 Favored 'General case' 0 N--CA 1.455 -0.188 0 C-N-CA 123.889 0.876 . . . . 2.29 110.504 172.666 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -64.38 -14.8 58.52 Favored 'General case' 0 N--CA 1.464 0.266 0 N-CA-C 112.041 0.385 . . . . 1.02 112.041 172.247 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -75.57 -13.6 82.8 Favored Glycine 0 N--CA 1.443 -0.885 0 N-CA-C 110.848 -0.901 . . . . 0.42999999999999999 110.848 174.339 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 3.6 tmt_? -113.75 -8.65 13.21 Favored 'General case' 0 CA--C 1.52 -0.174 0 CA-C-N 118.967 1.384 . . . . 2.7999999999999998 113.028 -171.34 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 18.8 p -69.09 -115.21 0.0 OUTLIER 'General case' 0 C--N 1.327 -0.377 0 C-N-CA 124.368 1.067 . . . . 1.3899999999999999 110.042 177.215 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 9.8 t-20 -86.94 154.1 21.07 Favored 'General case' 0 N--CA 1.454 -0.228 0 O-C-N 120.553 -1.342 . . . . 2.3500000000000001 107.724 177.829 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 78.8 tt0 -58.68 -34.57 71.41 Favored 'General case' 0 CA--C 1.535 0.383 0 CA-C-N 118.87 0.759 . . . . 2.9500000000000002 109.731 175.416 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 64' ' ' ALA . . . . . 0.536 ' HB1' ' CE1' ' A' ' 20' ' ' HIS . . . -65.93 -29.04 69.39 Favored 'General case' 0 N--CA 1.455 -0.215 0 N-CA-C 113.128 0.788 . . . . 0.63 113.128 177.521 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 11.9 mt-10 -77.42 -45.68 25.05 Favored 'General case' 0 CA--C 1.513 -0.471 0 O-C-N 121.075 -1.016 . . . . 2.2200000000000002 110.05 175.856 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 49.8 t80 -47.64 -48.71 28.55 Favored 'General case' 0 C--N 1.33 -0.271 0 C-N-CA 125.717 1.607 . . . . 0.56000000000000005 111.27 172.19 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 56.5 t80 -63.26 -43.78 97.0 Favored 'General case' 0 CA--C 1.538 0.517 0 O-C-N 121.174 -0.954 . . . . 0.81000000000000005 110.833 177.013 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -66.49 -52.33 47.22 Favored 'General case' 0 CA--C 1.539 0.534 0 O-C-N 121.114 -0.991 . . . . 0.46999999999999997 112.851 -174.185 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -57.63 -39.8 77.75 Favored 'General case' 0 C--N 1.331 -0.215 0 O-C-N 120.701 -1.249 . . . . 4.0 111.017 170.382 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -56.71 -44.0 81.12 Favored 'General case' 0 N--CA 1.451 -0.416 0 CA-C-O 118.4 -0.81 . . . . 0.47999999999999998 110.251 176.648 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 71.3 t80 -55.92 -49.98 71.95 Favored 'General case' 0 N--CA 1.466 0.371 0 CA-C-N 119.725 1.148 . . . . 3.0699999999999998 111.672 173.517 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 72' ' ' ARG . . . . . 0.431 ' CZ ' ' HB2' ' A' ' 12' ' ' GLU . 64.1 ttt180 -47.98 -57.59 5.55 Favored 'General case' 0 CA--C 1.533 0.325 0 CA-C-N 118.568 0.622 . . . . 2.3700000000000001 109.899 177.537 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . 0.601 ' CB ' HG21 ' A' ' 85' ' ' VAL . 0.1 OUTLIER -67.3 -27.6 67.31 Favored 'General case' 0 C--N 1.327 -0.385 0 C-N-CA 124.538 1.135 . . . . 0.52000000000000002 111.263 -176.476 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 1.2 ttp -62.29 -38.32 88.91 Favored 'General case' 0 N--CA 1.454 -0.244 0 C-N-CA 122.814 0.445 . . . . 2.3999999999999999 109.852 179.763 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 23.1 p80 -91.27 -36.61 13.8 Favored 'General case' 0 N--CA 1.452 -0.334 0 CA-C-O 115.886 -2.007 . . . . 1.01 111.572 -175.083 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 18.6 m -6.11 118.4 0.01 OUTLIER 'General case' 0 C--N 1.347 0.492 0 C-N-CA 128.493 2.717 . . . . 1.01 114.575 -174.655 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 4.9 p -46.21 -47.24 17.91 Favored 'General case' 0 N--CA 1.451 -0.376 0 C-N-CA 125.234 1.414 . . . . 0.96999999999999997 109.638 175.136 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 12.9 t0 -70.36 114.18 8.23 Favored 'General case' 0 N--CA 1.451 -0.393 0 CA-C-O 122.13 0.967 . . . . 2.3900000000000001 109.929 169.7 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 13.2 m170 -63.04 -29.41 70.8 Favored 'General case' 0 N--CA 1.451 -0.377 0 CA-C-N 115.779 -0.646 . . . . 6.0999999999999996 111.189 176.964 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -63.21 -46.1 88.59 Favored 'General case' 0 N--CA 1.453 -0.29 0 CA-C-N 119.313 0.96 . . . . 1.25 110.07 179.369 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -48.66 -41.99 33.09 Favored 'General case' 0 C--O 1.231 0.13 0 C-N-CA 124.554 1.142 . . . . 4.2300000000000004 110.771 175.105 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -64.35 -52.52 57.94 Favored 'General case' 0 C--N 1.33 -0.247 0 N-CA-C 109.417 -0.586 . . . . 3.1600000000000001 109.417 179.39 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . 0.418 HD13 ' HA ' ' A' ' 83' ' ' LEU . 1.3 mm? -66.19 -16.88 64.36 Favored 'General case' 0 CA--C 1.522 -0.128 0 N-CA-C 112.861 0.689 . . . . 1.25 112.861 179.239 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 33.5 mttt -66.4 -51.24 59.04 Favored 'General case' 0 N--CA 1.45 -0.454 0 N-CA-C 106.953 -1.499 . . . . 2.1400000000000001 106.953 168.865 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 85' ' ' VAL . . . . . 0.601 HG21 ' CB ' ' A' ' 73' ' ' LEU . 98.8 t -56.18 -46.3 81.17 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.449 0 CA-C-O 118.195 -0.907 . . . . 0.60999999999999999 111.994 174.557 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 1.6 mt-30 -66.84 -49.89 64.27 Favored 'General case' 0 C--O 1.224 -0.252 0 CA-C-N 120.662 1.574 . . . . 2.21 112.183 -175.589 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 5.3 pttp -68.11 -38.39 82.22 Favored 'General case' 0 C--O 1.226 -0.161 0 O-C-N 121.178 -0.951 . . . . 3.96 109.978 -174.678 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 3.1 m120 -62.38 -45.42 93.24 Favored 'General case' 0 N--CA 1.453 -0.322 0 N-CA-C 108.866 -0.79 . . . . 1.3400000000000001 108.866 175.883 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -128.53 86.19 58.35 Favored Pre-proline 0 N--CA 1.451 -0.385 0 C-N-CA 126.324 1.85 . . . . 0.52000000000000002 109.755 -172.467 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 92.1 Cg_endo -80.46 46.18 2.18 Favored 'Trans proline' 0 CA--C 1.539 0.737 0 C-N-CA 123.361 2.707 . . . . 1.8500000000000001 111.596 -176.899 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 91' ' ' LYS . . . . . 0.583 ' HE2' ' OE2' ' A' ' 51' ' ' GLU . 21.1 pttt -160.88 -53.2 0.05 OUTLIER 'General case' 0 N--CA 1.452 -0.339 0 C-N-CA 125.443 1.497 . . . . 2.6099999999999999 110.743 177.27 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 3.4 m -50.43 -47.06 56.83 Favored 'General case' 0 N--CA 1.464 0.228 0 C-N-CA 123.649 0.78 . . . . 0.66000000000000003 111.781 -178.135 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 12.2 t80 -57.47 -49.56 75.89 Favored 'General case' 0 CA--C 1.516 -0.343 0 CA-C-O 121.793 0.806 . . . . 2.3900000000000001 110.883 178.845 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 1.4 mt-30 -59.69 -26.48 65.61 Favored 'General case' 0 N--CA 1.446 -0.634 0 CA-C-N 114.657 -1.156 . . . . 2.04 110.773 -179.027 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 3.6 t80 -66.93 -58.39 5.07 Favored 'General case' 0 N--CA 1.451 -0.383 0 C-N-CA 123.586 0.755 . . . . 1.05 110.227 -178.16 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 96' ' ' ILE . . . . . 0.402 HD12 ' H ' ' A' ' 96' ' ' ILE . 3.3 mp -55.63 -42.54 69.41 Favored 'Isoleucine or valine' 0 CA--C 1.528 0.098 0 N-CA-C 108.701 -0.852 . . . . 1.1799999999999999 108.701 175.638 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 21.8 t-20 -55.8 -43.91 77.33 Favored 'General case' 0 CA--C 1.537 0.452 0 CA-C-O 120.886 0.374 . . . . 2.3100000000000001 111.181 -179.869 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 98' ' ' ASP . . . . . 0.43 ' OD2' ' HE3' ' A' ' 42' ' ' LYS . 0.2 OUTLIER -55.76 -37.52 68.62 Favored 'General case' 0 CA--C 1.533 0.318 0 C-N-CA 124.44 1.096 . . . . 2.27 110.178 177.523 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -70.2 -55.61 8.9 Favored 'General case' 0 CA--C 1.532 0.266 0 C-N-CA 123.347 0.659 . . . . 5.0300000000000002 111.026 -179.649 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 2.5 pt -76.28 74.24 0.48 Allowed 'Isoleucine or valine' 0 CA--C 1.532 0.287 0 CA-C-O 121.771 0.796 . . . . 5.6299999999999999 111.283 -171.92 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 5.7 tmtm? -133.8 -43.32 0.82 Allowed 'General case' 0 N--CA 1.456 -0.136 0 O-C-N 121.745 -0.597 . . . . 9.8300000000000001 110.74 -169.292 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 102' ' ' PHE . . . . . . . . . . . . . 52.2 t80 -112.45 -32.0 6.63 Favored 'General case' 0 CA--C 1.532 0.265 0 C-N-CA 123.112 0.565 . . . . 9.1500000000000004 111.283 177.382 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -60.47 128.52 21.71 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.343 0 O-C-N 121.853 -0.529 . . . . 5.8399999999999999 109.749 178.402 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 104' ' ' ILE . . . . . . . . . . . . . 5.0 pt -77.37 134.46 28.52 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.171 0 N-CA-C 109.547 -0.538 . . . . 7.0800000000000001 109.547 176.768 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 18.2 p-10 -144.28 155.49 43.86 Favored 'General case' 0 N--CA 1.454 -0.261 0 N-CA-C 109.264 -0.643 . . . . 11.029999999999999 109.264 177.782 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 38.9 m . . . . . 0 C--O 1.247 0.953 0 C-N-CA 126.888 2.075 . . . . 10.73 107.214 173.524 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.471 1.018 0 N-CA-C 111.212 -0.755 . . . . 12.050000000000001 111.212 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 8.2 m -140.71 -32.03 0.59 Allowed 'General case' 0 N--CA 1.465 0.295 0 N-CA-C 113.294 0.85 . . . . 14.050000000000001 113.294 -175.355 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -139.06 160.99 38.47 Favored 'General case' 0 N--CA 1.451 -0.393 0 N-CA-C 107.547 -1.279 . . . . 17.010000000000002 107.547 -179.33 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 118.81 166.91 13.69 Favored Glycine 0 N--CA 1.45 -0.402 0 N-CA-C 107.991 -2.044 . . . . 13.77 107.991 -170.508 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 21.4 m -97.37 -160.63 0.1 OUTLIER 'Isoleucine or valine' 0 N--CA 1.441 -0.896 0 N-CA-C 107.57 -1.27 . . . . 14.24 107.57 163.348 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 5.4 pt-20 -109.13 104.49 13.68 Favored 'General case' 0 N--CA 1.448 -0.574 0 CA-C-O 122.684 1.231 . . . . 10.619999999999999 111.569 -173.555 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 1.1 mm? -98.23 36.21 1.63 Allowed 'General case' 0 N--CA 1.452 -0.328 0 O-C-N 121.395 -0.816 . . . . 9.5999999999999996 109.763 -173.076 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 14.4 mmm180 69.17 -71.16 0.12 Allowed 'General case' 0 N--CA 1.467 0.378 0 C-N-CA 124.87 1.268 . . . . 6.4000000000000004 109.366 -170.67 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 9.7 m-80 -50.14 -37.39 34.2 Favored 'General case' 0 CA--C 1.51 -0.589 0 C-N-CA 125.099 1.36 . . . . 3.4100000000000001 112.733 175.758 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 24.8 t70 -64.85 -41.44 95.69 Favored 'General case' 0 C--O 1.218 -0.577 0 C-N-CA 118.324 -1.351 . . . . 3.9700000000000002 110.53 179.401 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -67.43 -55.09 15.1 Favored 'General case' 0 CA--C 1.535 0.381 0 CA-C-N 119.052 0.842 . . . . 2.5299999999999998 110.444 179.738 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 6.3 tp10 -71.68 -17.55 62.23 Favored 'General case' 0 CA--C 1.537 0.469 0 CA-C-O 121.993 0.902 . . . . 5.8499999999999996 110.233 -175.42 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -80.75 -37.11 20.7 Favored Glycine 0 CA--C 1.526 0.76 0 C-N-CA 125.039 1.304 . . . . 0.93999999999999995 110.951 168.935 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 9.2 t80 -55.7 -49.2 73.64 Favored 'General case' 0 C--O 1.219 -0.541 0 C-N-CA 124.403 1.081 . . . . 2.73 108.71 -172.664 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -59.19 -37.16 67.01 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.389 0 N-CA-C 113.087 0.773 . . . . 0.39000000000000001 113.087 176.421 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 6.4 t60 -61.03 -54.01 50.09 Favored 'General case' 0 N--CA 1.465 0.277 0 N-CA-C 106.354 -1.721 . . . . 0.46999999999999997 106.354 177.775 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 67.9 mt-10 -53.26 -40.64 64.8 Favored 'General case' 0 C--O 1.223 -0.333 0 C-N-CA 122.698 0.399 . . . . 2.5499999999999998 110.512 176.988 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -60.84 -50.17 74.54 Favored 'General case' 0 CA--C 1.518 -0.251 0 C-N-CA 125.173 1.389 . . . . 2.0600000000000001 109.379 -175.291 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -49.04 -46.33 33.11 Favored Glycine 0 CA--C 1.528 0.9 0 N-CA-C 110.447 -1.061 . . . . 0.42999999999999999 110.447 173.161 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 20' ' ' HIS . . . . . 0.539 ' CE1' ' HB1' ' A' ' 64' ' ' ALA . 2.1 t60 -63.34 -42.15 98.93 Favored 'General case' 0 N--CA 1.451 -0.417 0 O-C-N 122.035 -0.685 . . . . 1.8 111.784 179.571 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -65.5 -30.42 71.18 Favored 'General case' 0 N--CA 1.452 -0.372 0 O-C-N 121.378 -0.826 . . . . 0.65000000000000002 109.956 -179.938 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 82.5 t -70.01 -40.05 78.1 Favored 'Isoleucine or valine' 0 C--O 1.232 0.165 0 O-C-N 121.328 -0.857 . . . . 0.88 109.609 176.355 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 3.6 m-20 -59.76 -22.85 62.67 Favored 'General case' 0 C--N 1.334 -0.099 0 N-CA-C 112.047 0.388 . . . . 2.5 112.047 172.375 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 11.6 t70 -67.45 -50.02 61.04 Favored 'General case' 0 N--CA 1.452 -0.348 0 N-CA-C 108.565 -0.902 . . . . 1.8100000000000001 108.565 179.695 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -58.73 -57.45 12.95 Favored 'General case' 0 N--CA 1.456 -0.172 0 C-N-CA 123.21 0.604 . . . . 3.71 110.547 177.343 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -58.15 -32.89 68.62 Favored 'General case' 0 N--CA 1.453 -0.292 0 O-C-N 121.824 -0.547 . . . . 0.93999999999999995 111.333 -178.705 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -59.72 -59.87 9.75 Favored Glycine 0 CA--C 1.521 0.439 0 N-CA-C 110.833 -0.907 . . . . 1.0900000000000001 110.833 173.101 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -53.85 -29.52 41.49 Favored 'General case' 0 CA--C 1.533 0.301 0 C-N-CA 124.882 1.273 . . . . 2.3799999999999999 112.385 -173.449 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 2.9 mm? -94.32 -21.69 18.83 Favored 'General case' 0 N--CA 1.445 -0.683 0 N-CA-C 114.25 1.204 . . . . 1.6599999999999999 114.25 -179.779 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 28.6 mt -127.07 49.07 2.12 Favored 'General case' 0 CA--C 1.534 0.362 0 CA-C-N 120.052 1.296 . . . . 2.3700000000000001 111.042 -166.696 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 22.5 p-10 -120.54 87.58 2.78 Favored 'General case' 0 CA--C 1.532 0.279 0 C-N-CA 125.248 1.419 . . . . 6.0099999999999998 111.483 -166.694 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 49.3 mttm -64.43 -57.34 9.54 Favored 'General case' 0 N--CA 1.465 0.302 0 O-C-N 119.987 -1.695 . . . . 7.7999999999999998 111.216 175.456 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 4.2 t-20 -163.72 158.51 20.38 Favored 'General case' 0 N--CA 1.455 -0.219 0 N-CA-C 108.179 -1.045 . . . . 7.25 108.179 177.391 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 27.1 tt0 42.67 34.91 0.62 Allowed 'General case' 0 CA--C 1.537 0.475 0 C-N-CA 126.819 2.048 . . . . 9.6500000000000004 113.733 172.693 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 6.7 t -160.77 80.37 0.64 Allowed 'General case' 0 N--CA 1.453 -0.277 0 N-CA-C 107.069 -1.456 . . . . 6.6500000000000004 107.069 179.548 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 70.8 m-20 -72.34 -45.63 59.03 Favored 'General case' 0 N--CA 1.462 0.158 0 CA-C-O 121.699 0.761 . . . . 5.6699999999999999 109.81 -173.738 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 2.5 mt -86.3 141.29 29.35 Favored 'General case' 0 N--CA 1.454 -0.254 0 N-CA-C 107.087 -1.449 . . . . 2.21 107.087 172.387 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 9.9 p -63.94 116.42 3.51 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.312 0 N-CA-C 105.435 -2.061 . . . . 3.3500000000000001 105.435 173.28 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 18.7 p -129.02 85.48 2.33 Favored 'General case' 0 N--CA 1.452 -0.359 0 N-CA-C 106.332 -1.729 . . . . 3.6299999999999999 106.332 -179.228 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 9.4 t-20 64.38 -74.63 0.05 OUTLIER 'General case' 0 CA--C 1.53 0.194 0 C-N-CA 125.892 1.677 . . . . 7.79 110.958 -166.796 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 6.3 t 67.96 158.86 0.15 Allowed 'General case' 0 N--CA 1.453 -0.318 0 C-N-CA 126.487 1.915 . . . . 3.0 110.948 -175.32 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 49.2 tttm 70.8 -63.03 0.43 Allowed 'General case' 0 CA--C 1.532 0.279 0 C-N-CA 125.177 1.391 . . . . 7.5800000000000001 111.843 -174.563 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -86.75 168.21 13.74 Favored 'General case' 0 N--CA 1.457 -0.088 0 CA-C-N 119.287 0.948 . . . . 6.8700000000000001 109.421 174.307 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -85.1 58.74 5.2 Favored 'General case' 0 CA--C 1.533 0.292 0 C-N-CA 123.606 0.762 . . . . 6.75 109.279 -175.648 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 3.8 pt 39.01 39.21 0.22 Allowed 'Isoleucine or valine' 0 CA--C 1.541 0.624 0 C-N-CA 125.459 1.504 . . . . 3.9300000000000002 112.369 -175.719 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 12.8 t70 -60.68 -44.04 96.99 Favored 'General case' 0 N--CA 1.465 0.308 0 C-N-CA 124.716 1.206 . . . . 2.3700000000000001 111.032 -173.874 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 47' ' ' ILE . . . . . 0.474 HD13 ' HE3' ' A' ' 91' ' ' LYS . 5.7 mm -50.63 -52.59 15.81 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.308 0 C-N-CA 124.559 1.144 . . . . 0.62 108.677 177.461 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 20.0 t80 -67.52 -33.7 75.6 Favored 'General case' 0 N--CA 1.452 -0.332 0 C-N-CA 123.403 0.681 . . . . 0.78000000000000003 112.043 177.201 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . 0.508 ' HE2' ' N ' ' A' ' 49' ' ' LYS . 0.6 OUTLIER -61.93 -49.16 77.25 Favored 'General case' 0 CA--C 1.519 -0.235 0 CA-C-N 119.899 1.227 . . . . 1.8300000000000001 109.195 -174.44 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 7.3 mm-40 -80.08 -66.17 0.91 Allowed 'General case' 0 N--CA 1.448 -0.563 0 CA-C-O 122.14 0.971 . . . . 2.79 109.089 -178.461 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 17.8 mm-40 -73.79 -21.52 60.14 Favored 'General case' 0 C--O 1.235 0.298 0 C-N-CA 123.442 0.697 . . . . 2.5699999999999998 110.659 -164.791 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -68.2 37.52 0.25 Allowed Glycine 0 CA--C 1.531 1.064 0 C-N-CA 125.429 1.49 . . . . 0.34999999999999998 113.454 169.073 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 61.5 p -148.94 23.25 0.97 Allowed 'General case' 0 N--CA 1.446 -0.663 0 O-C-N 120.673 -1.486 . . . . 2.04 110.839 163.388 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 3.2 t-20 -136.19 -39.84 0.67 Allowed 'General case' 0 CA--C 1.517 -0.301 0 N-CA-C 113.147 0.795 . . . . 1.5600000000000001 113.147 -164.799 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . 0.643 HD22 HG22 ' A' ' 85' ' ' VAL . 16.2 mt -66.96 -36.86 83.15 Favored 'General case' 0 C--N 1.332 -0.194 0 C-N-CA 120.214 -0.594 . . . . 0.35999999999999999 110.473 -178.533 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 1.2 t 178.83 170.3 0.87 Allowed 'General case' 0 C--N 1.331 -0.206 0 C-N-CA 125.451 1.5 . . . . 0.48999999999999999 107.637 -178.581 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 9.6 m -57.56 -35.35 70.22 Favored 'General case' 0 N--CA 1.453 -0.279 0 C-N-CA 123.175 0.59 . . . . 0.92000000000000004 110.554 170.056 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -58.5 -33.84 70.27 Favored 'General case' 0 C--N 1.34 0.154 0 CA-C-N 117.837 0.289 . . . . 1.1699999999999999 110.418 173.842 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -63.96 -16.36 59.48 Favored Glycine 0 C--O 1.22 -0.74 0 CA-C-O 119.106 -0.83 . . . . 0.54000000000000004 111.792 178.481 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 50.7 ttt-85 -104.6 -8.55 18.88 Favored 'General case' 0 N--CA 1.457 -0.111 0 CA-C-N 119.184 1.492 . . . . 2.1299999999999999 113.735 178.942 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 44.0 p -67.65 -139.12 0.0 OUTLIER 'General case' 0 CA--C 1.54 0.596 0 CA-C-O 121.205 0.526 . . . . 0.97999999999999998 110.585 174.567 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 1.1 t-20 -65.22 149.48 49.86 Favored 'General case' 0 N--CA 1.453 -0.307 0 O-C-N 120.067 -1.646 . . . . 1.95 108.703 178.473 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 3.4 tm-20 -60.58 -32.69 71.78 Favored 'General case' 0 CA--C 1.532 0.282 0 O-C-N 121.915 -0.491 . . . . 3.1499999999999999 110.259 179.454 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 64' ' ' ALA . . . . . 0.539 ' HB1' ' CE1' ' A' ' 20' ' ' HIS . . . -61.62 -29.76 70.26 Favored 'General case' 0 N--CA 1.454 -0.246 0 N-CA-C 113.798 1.036 . . . . 0.62 113.798 175.166 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 2.1 mt-10 -81.44 -41.03 22.44 Favored 'General case' 0 CA--C 1.508 -0.653 0 O-C-N 121.169 -0.957 . . . . 2.52 110.597 176.776 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 37.3 t80 -50.42 -47.7 56.52 Favored 'General case' 0 N--CA 1.45 -0.437 0 C-N-CA 124.194 0.997 . . . . 0.31 111.155 170.283 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 42.1 t80 -64.59 -46.02 84.48 Favored 'General case' 0 CA--C 1.538 0.504 0 O-C-N 121.34 -0.85 . . . . 0.68000000000000005 109.98 176.979 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -61.28 -54.61 41.88 Favored 'General case' 0 CA--C 1.539 0.53 0 O-C-N 121.082 -1.011 . . . . 0.26000000000000001 113.061 -174.297 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -57.28 -39.86 76.56 Favored 'General case' 0 C--N 1.331 -0.211 0 O-C-N 121.008 -1.057 . . . . 3.8999999999999999 110.86 171.511 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -56.69 -42.18 78.64 Favored 'General case' 0 N--CA 1.453 -0.316 0 CA-C-N 119.15 0.886 . . . . 0.35999999999999999 110.806 175.995 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 76.7 t80 -58.53 -49.66 76.59 Favored 'General case' 0 N--CA 1.464 0.261 0 CA-C-N 119.912 1.233 . . . . 3.0699999999999998 111.633 172.821 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 22.8 ttp180 -47.84 -57.75 5.24 Favored 'General case' 0 N--CA 1.465 0.284 0 CA-C-N 119.238 0.926 . . . . 2.6299999999999999 110.203 177.449 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -63.6 -30.15 71.3 Favored 'General case' 0 C--N 1.326 -0.414 0 C-N-CA 124.838 1.255 . . . . 0.45000000000000001 111.104 -177.153 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 1.2 ttp -59.2 -42.23 90.45 Favored 'General case' 0 C--O 1.233 0.227 0 C-N-CA 122.756 0.422 . . . . 2.5 110.488 -179.938 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 8.9 p80 -96.7 -6.12 37.17 Favored 'General case' 0 N--CA 1.455 -0.183 0 CA-C-O 116.365 -1.779 . . . . 0.89000000000000001 113.68 -177.181 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 16.6 m -36.94 126.93 0.91 Allowed 'General case' 0 N--CA 1.453 -0.29 0 CA-C-O 123.267 1.508 . . . . 1.02 111.905 -171.697 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 7.8 p -52.83 -44.95 67.08 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 112.849 -1.978 . . . . 1.1799999999999999 108.207 177.133 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 13.0 t0 -65.68 107.52 1.78 Allowed 'General case' 0 N--CA 1.45 -0.459 0 CA-C-O 121.863 0.84 . . . . 2.1400000000000001 108.91 166.687 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -57.58 -33.01 67.74 Favored 'General case' 0 N--CA 1.454 -0.266 0 CA-C-N 116.068 -0.515 . . . . 5.4100000000000001 110.432 177.452 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -61.95 -47.4 85.06 Favored 'General case' 0 N--CA 1.451 -0.38 0 CA-C-N 118.567 0.621 . . . . 0.67000000000000004 110.745 179.952 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 5.7 mt-10 -49.1 -41.44 35.66 Favored 'General case' 0 CA--C 1.519 -0.245 0 C-N-CA 123.943 0.897 . . . . 2.6000000000000001 110.908 178.444 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 2.2 mtp180 -62.45 -50.2 72.4 Favored 'General case' 0 C--N 1.327 -0.396 0 N-CA-C 109.056 -0.72 . . . . 2.8599999999999999 109.056 178.484 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 1.3 mm? -64.99 -18.18 65.06 Favored 'General case' 0 N--CA 1.451 -0.398 0 CA-C-O 117.682 -1.152 . . . . 0.45000000000000001 113.487 176.51 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 6.6 mttt -69.32 -48.8 60.38 Favored 'General case' 0 C--O 1.224 -0.27 0 CA-C-N 121.404 1.911 . . . . 1.27 107.511 168.774 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 85' ' ' VAL . . . . . 0.643 HG22 HD22 ' A' ' 55' ' ' LEU . 33.4 t -58.57 -42.61 85.19 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.596 0 CA-C-O 118.112 -0.947 . . . . 0.46999999999999997 111.449 176.237 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 1.3 mt-30 -69.44 -52.77 23.67 Favored 'General case' 0 C--O 1.224 -0.255 0 CA-C-N 121.253 1.842 . . . . 1.95 111.741 -179.949 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 35.6 tttt -51.96 -50.8 60.52 Favored 'General case' 0 N--CA 1.451 -0.393 0 C-N-CA 123.436 0.694 . . . . 2.2000000000000002 110.075 -177.661 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 4.0 m-20 -65.93 -46.08 79.51 Favored 'General case' 0 N--CA 1.449 -0.479 0 C-N-CA 123.389 0.676 . . . . 1.52 109.565 179.276 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -130.63 78.1 74.55 Favored Pre-proline 0 C--O 1.238 0.45 0 C-N-CA 125.672 1.589 . . . . 0.42999999999999999 110.847 -168.634 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 73.9 Cg_endo -74.7 15.9 0.66 Allowed 'Trans proline' 0 CA--C 1.536 0.594 0 C-N-CA 123.062 2.508 . . . . 1.51 112.683 -175.233 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 91' ' ' LYS . . . . . 0.474 ' HE3' HD13 ' A' ' 47' ' ' ILE . 7.9 ptmt -128.69 -46.43 1.29 Allowed 'General case' 0 N--CA 1.451 -0.421 0 C-N-CA 125.773 1.629 . . . . 2.6600000000000001 109.526 -177.751 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 3.3 m -54.61 -49.4 70.56 Favored 'General case' 0 N--CA 1.464 0.242 0 CA-C-N 119.533 1.061 . . . . 0.33000000000000002 111.067 176.227 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 22.5 t80 -59.01 -50.48 73.92 Favored 'General case' 0 CA--C 1.51 -0.583 0 C-N-CA 119.927 -0.709 . . . . 1.8400000000000001 110.428 -179.724 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 22.4 tt0 -57.72 -29.63 64.89 Favored 'General case' 0 N--CA 1.444 -0.732 0 CA-C-N 114.69 -1.141 . . . . 2.4199999999999999 110.1 -177.158 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 13.1 t80 -66.07 -58.42 5.52 Favored 'General case' 0 N--CA 1.45 -0.45 0 C-N-CA 123.358 0.663 . . . . 1.45 109.34 -177.882 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 3.2 mp -55.02 -41.99 62.03 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.217 0 N-CA-C 109.297 -0.631 . . . . 0.83999999999999997 109.297 175.718 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 14.0 t-20 -60.98 -35.73 77.58 Favored 'General case' 0 N--CA 1.455 -0.187 0 C-N-CA 123.382 0.673 . . . . 2.29 111.772 -175.957 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 27.0 t70 -70.83 -40.24 72.54 Favored 'General case' 0 CA--C 1.528 0.126 0 C-N-CA 123.585 0.754 . . . . 2.1699999999999999 110.333 174.481 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -68.38 -58.33 4.52 Favored 'General case' 0 CA--C 1.534 0.353 0 C-N-CA 124.066 0.946 . . . . 4.0199999999999996 110.431 -170.317 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 1.1 pt -74.44 129.23 36.72 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.238 0 O-C-N 121.471 -0.768 . . . . 5.7000000000000002 109.225 179.107 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -147.52 -59.83 0.27 Allowed 'General case' 0 CA--C 1.518 -0.268 0 O-C-N 121.414 -0.804 . . . . 10.02 109.843 -175.265 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 102' ' ' PHE . . . . . . . . . . . . . 8.7 t80 -152.83 89.08 1.36 Allowed 'General case' 0 N--CA 1.453 -0.304 0 N-CA-C 108.051 -1.092 . . . . 7.0899999999999999 108.051 172.19 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 11.1 tp -134.31 62.78 0.28 Allowed 'Isoleucine or valine' 0 C--O 1.227 -0.121 0 CA-C-O 122.685 1.231 . . . . 4.9400000000000004 108.66 -177.664 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 104' ' ' ILE . . . . . . . . . . . . . 1.1 pt -136.74 156.14 34.65 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.546 0 N-CA-C 107.884 -1.154 . . . . 8.4900000000000002 107.884 178.685 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 60.5 t30 -145.11 149.43 35.0 Favored 'General case' 0 N--CA 1.449 -0.501 0 N-CA-C 105.708 -1.96 . . . . 8.0899999999999999 105.708 172.156 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 48.7 m . . . . . 0 C--O 1.248 1.012 0 CA-C-O 116.738 -1.601 . . . . 9.5500000000000007 108.604 -177.074 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . 0.429 ' HA3' ' OE1' ' A' ' 17' ' ' GLU . . . . . . . . 0 N--CA 1.471 1.016 0 CA-C-O 119.639 -0.534 . . . . 11.050000000000001 113.783 . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 6.0 m -155.34 -85.24 0.06 Allowed 'General case' 0 N--CA 1.454 -0.272 0 CA-C-N 119.36 1.58 . . . . 12.19 107.77 174.252 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 9.6 ttmt -173.89 163.92 4.17 Favored 'General case' 0 N--CA 1.458 -0.052 0 N-CA-C 109.04 -0.726 . . . . 16.239999999999998 109.04 178.907 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 104.79 -153.98 17.39 Favored Glycine 0 C--N 1.333 0.411 0 N-CA-C 110.226 -1.149 . . . . 12.449999999999999 110.226 177.264 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 31.8 m -80.02 -156.59 0.04 OUTLIER 'Isoleucine or valine' 0 N--CA 1.445 -0.72 0 N-CA-C 108.069 -1.086 . . . . 13.31 108.069 167.859 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -96.28 124.87 40.43 Favored 'General case' 0 N--CA 1.446 -0.657 0 CA-C-O 121.889 0.852 . . . . 8.5999999999999996 109.885 169.268 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 1.9 mm? -111.18 39.23 2.33 Favored 'General case' 0 N--CA 1.447 -0.585 0 C-N-CA 124.455 1.102 . . . . 8.6899999999999995 108.091 179.945 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 11.3 mmm180 68.96 -76.37 0.06 Allowed 'General case' 0 N--CA 1.467 0.385 0 C-N-CA 123.555 0.742 . . . . 6.8300000000000001 109.483 -174.217 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 7.0 m-20 -45.49 -43.66 11.8 Favored 'General case' 0 CA--C 1.513 -0.449 0 C-N-CA 124.9 1.28 . . . . 2.6699999999999999 111.303 173.45 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 8.4 t70 -66.07 -38.76 89.11 Favored 'General case' 0 N--CA 1.449 -0.49 0 C-N-CA 118.168 -1.413 . . . . 3.5899999999999999 111.315 -176.085 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -65.91 -59.63 3.66 Favored 'General case' 0 CA--C 1.53 0.2 0 C-N-CA 124.471 1.108 . . . . 1.55 110.532 177.481 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . 0.493 ' HA ' HD11 ' A' ' 15' ' ' ILE . 8.9 pt-20 -68.85 -25.8 64.83 Favored 'General case' 0 C--O 1.234 0.286 0 O-C-N 121.529 -0.732 . . . . 3.23 110.37 -172.27 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -72.34 -46.56 33.15 Favored Glycine 0 CA--C 1.526 0.765 0 C-N-CA 124.897 1.237 . . . . 0.76000000000000001 110.881 170.75 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 16.0 t80 -58.21 -55.9 29.05 Favored 'General case' 0 C--O 1.223 -0.303 0 CA-C-N 118.576 1.188 . . . . 3.3700000000000001 109.504 -176.956 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . 0.493 HD11 ' HA ' ' A' ' 12' ' ' GLU . 0.8 OUTLIER -60.74 -33.9 56.86 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.328 0 O-C-N 121.724 -0.61 . . . . 0.60999999999999999 111.708 -179.894 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 13.6 t60 -61.7 -51.56 67.88 Favored 'General case' 0 CA--C 1.536 0.442 0 N-CA-C 107.796 -1.186 . . . . 0.72999999999999998 107.796 177.607 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . 0.429 ' OE1' ' HA3' ' A' ' 1' ' ' GLY . 43.6 mt-10 -54.13 -40.69 67.61 Favored 'General case' 0 C--O 1.225 -0.22 0 O-C-N 121.013 -1.054 . . . . 2.29 110.668 175.173 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 1.3 t80 -58.23 -41.37 83.96 Favored 'General case' 0 N--CA 1.453 -0.314 0 C-N-CA 123.244 0.618 . . . . 2.3700000000000001 109.931 178.752 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -49.87 -49.71 34.4 Favored Glycine 0 CA--C 1.529 0.927 0 N-CA-C 111.226 -0.75 . . . . 0.68999999999999995 111.226 170.47 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 70.8 m-70 -57.15 -52.16 66.42 Favored 'General case' 0 C--O 1.227 -0.11 0 CA-C-N 117.93 0.865 . . . . 3.7999999999999998 110.917 176.833 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -60.59 -27.42 67.71 Favored 'General case' 0 N--CA 1.454 -0.226 0 CA-C-N 117.802 0.273 . . . . 0.81000000000000005 111.691 -177.904 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 54.2 t -71.83 -40.12 68.71 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.212 0 O-C-N 121.15 -0.969 . . . . 1.02 109.563 176.51 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 23' ' ' ASP . . . . . 0.467 ' OD1' HG12 ' A' ' 38' ' ' VAL . 3.2 t0 -66.51 -12.86 59.61 Favored 'General case' 0 N--CA 1.451 -0.419 0 N-CA-C 112.215 0.45 . . . . 2.4900000000000002 112.215 179.837 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 17.1 t70 -59.02 -51.31 70.61 Favored 'General case' 0 N--CA 1.454 -0.26 0 N-CA-C 108.497 -0.927 . . . . 3.8100000000000001 108.497 177.672 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -55.73 -43.58 76.74 Favored 'General case' 0 N--CA 1.453 -0.307 0 C-N-CA 123.473 0.709 . . . . 2.6800000000000002 110.518 177.922 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -57.74 -40.82 80.54 Favored 'General case' 0 N--CA 1.447 -0.603 0 CA-C-O 118.714 -0.66 . . . . 1.47 110.434 179.768 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -70.79 -52.97 12.65 Favored Glycine 0 CA--C 1.526 0.754 0 N-CA-C 110.751 -0.94 . . . . 1.48 110.751 179.966 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -45.03 -47.77 11.64 Favored 'General case' 0 C--O 1.235 0.301 0 C-N-CA 125.083 1.353 . . . . 2.5800000000000001 110.556 -177.374 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 3.3 mm? -79.19 -42.83 25.16 Favored 'General case' 0 N--CA 1.443 -0.82 0 C-N-CA 123.915 0.886 . . . . 2.8100000000000001 112.238 177.938 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 6.4 mt -119.7 99.14 6.47 Favored 'General case' 0 CA--C 1.534 0.357 0 C-N-CA 123.772 0.829 . . . . 2.7799999999999998 109.131 -165.967 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 5.8 t0 88.32 85.94 0.02 OUTLIER 'General case' 0 N--CA 1.47 0.564 0 C-N-CA 126.775 2.03 . . . . 4.96 107.151 -175.669 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.38 165.02 2.23 Favored 'General case' 0 N--CA 1.467 0.412 0 C-N-CA 123.093 0.557 . . . . 7.8899999999999997 110.404 -171.887 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 54.6 t30 -34.71 89.76 0.0 OUTLIER 'General case' 0 N--CA 1.465 0.322 0 C-N-CA 126.804 2.042 . . . . 10.300000000000001 113.307 -174.091 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 48.3 tt0 -162.73 -44.49 0.04 OUTLIER 'General case' 0 C--N 1.334 -0.097 0 C-N-CA 124.262 1.025 . . . . 8.1099999999999994 108.734 -169.858 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -120.09 148.24 43.85 Favored 'General case' 0 N--CA 1.449 -0.515 0 N-CA-C 106.092 -1.818 . . . . 5.4299999999999997 106.092 160.964 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 38.8 t0 -93.88 132.76 37.98 Favored 'General case' 0 N--CA 1.454 -0.256 0 N-CA-C 107.605 -1.257 . . . . 7.0999999999999996 107.605 -179.652 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 5.9 mp 64.68 177.15 0.19 Allowed 'General case' 0 CA--C 1.544 0.739 0 C-N-CA 124.891 1.276 . . . . 2.79 110.399 -167.594 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . 0.467 HG12 ' OD1' ' A' ' 23' ' ' ASP . 2.7 p -89.26 40.41 0.07 OUTLIER 'Isoleucine or valine' 0 N--CA 1.471 0.605 0 O-C-N 119.707 -1.87 . . . . 2.54 110.227 -176.713 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 8.8 t -63.48 162.14 13.19 Favored 'General case' 0 N--CA 1.452 -0.359 0 O-C-N 121.375 -0.828 . . . . 3.9500000000000002 110.082 179.831 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 5.2 m120 62.26 -84.52 0.02 OUTLIER 'General case' 0 N--CA 1.447 -0.607 0 C-N-CA 126.273 1.829 . . . . 6.9500000000000002 109.9 -176.801 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 9.8 t 64.96 120.37 0.02 OUTLIER 'General case' 0 CA--C 1.538 0.517 0 CA-C-O 123.595 1.664 . . . . 3.9300000000000002 111.412 -176.27 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -67.26 135.36 53.27 Favored 'General case' 0 N--CA 1.455 -0.187 0 O-C-N 120.142 -1.599 . . . . 13.609999999999999 108.411 -174.057 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER 51.99 35.4 15.95 Favored 'General case' 0 CA--C 1.535 0.381 0 C-N-CA 124.655 1.182 . . . . 9.9100000000000001 111.138 -175.278 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 1.9 m-85 -139.4 -31.98 0.67 Allowed 'General case' 0 N--CA 1.455 -0.197 0 C-N-CA 123.67 0.788 . . . . 10.99 110.817 177.435 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 9.9 tt -48.74 -26.32 1.5 Allowed 'Isoleucine or valine' 0 CA--C 1.535 0.388 0 C-N-CA 124.147 0.979 . . . . 2.6200000000000001 112.818 178.639 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 94.7 m-20 -42.49 -45.85 4.6 Favored 'General case' 0 N--CA 1.465 0.291 0 C-N-CA 125.878 1.671 . . . . 3.8100000000000001 111.11 173.873 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 8.8 mm -47.65 -60.58 0.59 Allowed 'Isoleucine or valine' 0 CA--C 1.536 0.406 0 C-N-CA 125.692 1.597 . . . . 0.75 108.955 175.963 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 23.7 t80 -65.35 -30.6 71.45 Favored 'General case' 0 N--CA 1.454 -0.257 0 O-C-N 121.031 -1.043 . . . . 0.64000000000000001 112.304 178.185 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -65.22 -49.55 69.26 Favored 'General case' 0 N--CA 1.454 -0.251 0 O-C-N 120.256 -1.527 . . . . 1.21 109.76 -176.942 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 26.8 mm-40 -85.94 -57.14 3.15 Favored 'General case' 0 N--CA 1.449 -0.499 0 CA-C-O 121.452 0.644 . . . . 4.3300000000000001 109.557 -171.98 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 37.3 mt-10 -80.95 -23.32 38.92 Favored 'General case' 0 C--O 1.235 0.329 0 O-C-N 121.775 -0.578 . . . . 3.54 110.502 -171.692 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . 0.42 ' HA2' ' CD1' ' A' ' 66' ' ' PHE . . . -71.17 43.52 0.67 Allowed Glycine 0 CA--C 1.531 1.039 0 C-N-CA 125.791 1.662 . . . . 0.39000000000000001 113.776 168.934 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 34.6 t -160.25 35.79 0.17 Allowed 'General case' 0 N--CA 1.447 -0.62 0 C-N-CA 125.022 1.329 . . . . 1.79 108.023 162.9 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 31.9 t30 -146.34 -34.76 0.29 Allowed 'General case' 0 C--N 1.341 0.228 0 N-CA-C 113.589 0.959 . . . . 1.8700000000000001 113.589 -169.699 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 18.8 mt -64.01 -41.28 97.52 Favored 'General case' 0 CA--C 1.53 0.187 0 O-C-N 121.4 -0.813 . . . . 0.55000000000000004 110.124 174.912 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 1.6 t 177.7 174.67 0.5 Allowed 'General case' 0 CA--C 1.534 0.337 0 C-N-CA 125.907 1.683 . . . . 0.65000000000000002 107.67 -177.116 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 74.5 m -59.57 -31.5 69.49 Favored 'General case' 0 CA--C 1.529 0.166 0 O-C-N 121.584 -0.697 . . . . 0.96999999999999997 110.472 166.935 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -64.65 -19.87 65.97 Favored 'General case' 0 CA--C 1.535 0.403 0 CA-C-N 118.066 0.394 . . . . 1.8899999999999999 111.755 176.112 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -84.29 -11.9 77.21 Favored Glycine 0 N--CA 1.446 -0.642 0 CA-C-O 119.177 -0.791 . . . . 0.40999999999999998 111.394 176.494 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 3.9 tmt_? -107.18 -13.85 15.05 Favored 'General case' 0 N--CA 1.455 -0.194 0 CA-C-N 118.29 1.045 . . . . 2.6699999999999999 112.132 -178.106 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 1.1 p -62.73 -165.76 0.01 OUTLIER 'General case' 0 CA--C 1.538 0.501 0 C-N-CA 123.752 0.821 . . . . 1.0700000000000001 110.162 164.987 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 14.6 m-20 -49.52 148.53 2.77 Favored 'General case' 0 CA--C 1.528 0.122 0 O-C-N 121.268 -0.895 . . . . 2.1400000000000001 110.879 -178.679 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 60.4 tt0 -62.83 -27.86 69.61 Favored 'General case' 0 CA--C 1.533 0.322 0 CA-C-O 121.298 0.57 . . . . 2.6400000000000001 111.117 -177.547 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -54.46 -40.43 68.42 Favored 'General case' 0 N--CA 1.455 -0.201 0 O-C-N 121.553 -0.717 . . . . 0.68999999999999995 112.152 169.429 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 1.3 mt-10 -78.25 -39.37 40.39 Favored 'General case' 0 CA--C 1.507 -0.68 0 CA-C-O 118.418 -0.801 . . . . 2.8500000000000001 110.022 -178.059 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 66' ' ' PHE . . . . . 0.42 ' CD1' ' HA2' ' A' ' 52' ' ' GLY . 56.5 t80 -51.47 -50.87 58.98 Favored 'General case' 0 N--CA 1.452 -0.354 0 C-N-CA 123.863 0.865 . . . . 0.46999999999999997 111.354 171.735 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 79.1 t80 -62.89 -44.23 96.65 Favored 'General case' 0 CA--C 1.541 0.619 0 O-C-N 121.473 -0.767 . . . . 0.55000000000000004 110.132 177.426 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -64.57 -55.54 19.79 Favored 'General case' 0 CA--C 1.537 0.448 0 N-CA-C 113.795 1.035 . . . . 0.29999999999999999 113.795 -174.438 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -54.8 -39.44 68.47 Favored 'General case' 0 C--N 1.33 -0.244 0 O-C-N 120.665 -1.272 . . . . 3.8500000000000001 111.404 169.047 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -59.02 -35.58 73.52 Favored 'General case' 0 CA--C 1.534 0.345 0 CA-C-N 119.63 1.104 . . . . 0.40000000000000002 110.789 174.465 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -61.52 -53.33 57.87 Favored 'General case' 0 C--O 1.233 0.194 0 CA-C-N 119.085 0.857 . . . . 3.71 111.481 171.202 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 2.3 ttt180 -45.39 -64.53 0.7 Allowed 'General case' 0 CA--C 1.528 0.129 0 C-N-CA 123.202 0.601 . . . . 2.4300000000000002 109.966 177.548 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . 0.427 HD12 HG23 ' A' ' 85' ' ' VAL . 0.2 OUTLIER -51.08 -53.51 33.4 Favored 'General case' 0 C--N 1.326 -0.448 0 C-N-CA 126.363 1.865 . . . . 0.84999999999999998 110.063 -179.296 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -61.92 -30.15 70.7 Favored 'General case' 0 CA--C 1.535 0.37 0 O-C-N 121.742 -0.599 . . . . 2.8799999999999999 112.238 -172.43 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 1.7 p80 -90.9 -18.71 24.3 Favored 'General case' 0 N--CA 1.463 0.201 0 CA-C-O 118.049 -0.977 . . . . 1.2 112.215 176.115 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 5.1 m -55.36 112.69 1.16 Allowed 'General case' 0 N--CA 1.446 -0.63 0 CA-C-N 119.82 1.191 . . . . 1.8700000000000001 107.963 -173.989 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -44.74 -37.43 3.74 Favored 'General case' 0 C--N 1.325 -0.497 0 C-N-CA 125.684 1.593 . . . . 2.4300000000000002 110.908 -178.051 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 19.1 t0 -55.33 99.23 0.03 OUTLIER 'General case' 0 N--CA 1.449 -0.493 0 CA-C-O 122.721 1.248 . . . . 2.1400000000000001 111.439 168.348 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 14.2 p-80 -44.42 -36.73 3.01 Favored 'General case' 0 N--CA 1.449 -0.482 0 CA-C-N 114.467 -1.242 . . . . 4.9000000000000004 112.558 171.251 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -63.23 -53.71 48.84 Favored 'General case' 0 N--CA 1.449 -0.507 0 CA-C-N 119.365 0.984 . . . . 0.88 110.746 -178.202 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -50.21 -44.37 53.16 Favored 'General case' 0 N--CA 1.465 0.276 0 CA-C-N 119.235 0.925 . . . . 3.5600000000000001 109.525 178.287 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 44.0 mtp180 -62.59 -56.64 16.01 Favored 'General case' 0 N--CA 1.452 -0.327 0 CA-C-N 115.99 -0.55 . . . . 3.0299999999999998 110.576 -177.812 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 1.1 mm? -63.72 -17.81 63.38 Favored 'General case' 0 N--CA 1.448 -0.538 0 C-N-CA 123.516 0.727 . . . . 0.68000000000000005 112.634 179.491 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 45.5 mttt -70.09 -45.64 66.55 Favored 'General case' 0 CA--C 1.511 -0.552 0 CA-C-N 119.835 1.198 . . . . 1.1699999999999999 108.567 170.51 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 85' ' ' VAL . . . . . 0.427 HG23 HD12 ' A' ' 73' ' ' LEU . 57.2 t -54.28 -51.52 47.38 Favored 'Isoleucine or valine' 0 C--O 1.214 -0.791 0 C-N-CA 119.538 -0.865 . . . . 0.62 109.241 170.062 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 4.2 tm0? -67.06 -51.59 52.71 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 119.583 1.083 . . . . 2.8799999999999999 111.927 -167.598 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 7.8 ttmm -55.38 -44.81 76.45 Favored 'General case' 0 C--N 1.331 -0.22 0 C-N-CA 124.651 1.18 . . . . 2.6000000000000001 110.828 175.427 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 15.9 m-20 -77.63 -22.45 50.72 Favored 'General case' 0 CA--C 1.532 0.266 0 C-N-CA 122.732 0.413 . . . . 0.94999999999999996 111.458 -177.068 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -155.9 69.7 5.14 Favored Pre-proline 0 C--O 1.238 0.459 0 C-N-CA 125.492 1.517 . . . . 0.53000000000000003 109.365 -165.367 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 30.8 Cg_endo -61.22 -34.82 87.83 Favored 'Trans proline' 0 N--CA 1.449 -1.126 0 C-N-CA 121.873 1.716 . . . . 2.2000000000000002 109.911 -175.388 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 11.1 tttt -79.45 -44.05 22.1 Favored 'General case' 0 N--CA 1.448 -0.545 0 C-N-CA 124.974 1.31 . . . . 4.6200000000000001 110.414 -174.375 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 7.2 m -58.16 -47.4 83.49 Favored 'General case' 0 N--CA 1.464 0.269 0 CA-C-N 119.217 0.917 . . . . 0.56999999999999995 108.983 176.384 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 12.9 t80 -59.59 -45.39 92.01 Favored 'General case' 0 CA--C 1.501 -0.931 0 O-C-N 122.018 -0.426 . . . . 2.0 111.543 -178.265 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 46.8 tt0 -48.99 -44.26 40.97 Favored 'General case' 0 N--CA 1.443 -0.795 0 O-C-N 124.332 1.02 . . . . 3.0299999999999998 109.333 176.511 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 4.0 t80 -61.99 -54.31 43.46 Favored 'General case' 0 CA--C 1.529 0.148 0 N-CA-C 109.695 -0.483 . . . . 1.6299999999999999 109.695 -177.378 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 34.8 mm -59.72 -29.41 42.77 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.199 0 C-N-CA 123.518 0.727 . . . . 1.53 111.512 -178.361 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -78.36 -33.89 48.71 Favored 'General case' 0 N--CA 1.453 -0.282 0 O-C-N 121.195 -0.941 . . . . 1.6699999999999999 110.324 178.863 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -61.09 -56.13 24.49 Favored 'General case' 0 CA--C 1.53 0.199 0 C-N-CA 124.747 1.219 . . . . 2.1299999999999999 108.799 177.404 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 42.9 mm-40 -78.14 96.92 5.29 Favored 'General case' 0 N--CA 1.452 -0.362 0 O-C-N 121.622 -0.674 . . . . 2.52 109.951 178.119 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 37.7 mt -46.38 130.92 3.06 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.37 0 C-N-CA 125.105 1.362 . . . . 4.6500000000000004 110.45 179.244 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 1.4 mppt? -83.69 165.74 18.68 Favored 'General case' 0 N--CA 1.454 -0.244 0 N-CA-C 109.712 -0.477 . . . . 11.369999999999999 109.712 -177.909 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 102' ' ' PHE . . . . . . . . . . . . . 79.2 m-85 73.27 83.71 0.12 Allowed 'General case' 0 N--CA 1.464 0.226 0 C-N-CA 126.821 2.048 . . . . 12.050000000000001 110.903 179.865 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 5.0 tp -84.9 -35.78 10.49 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.405 0 CA-C-N 116.596 -0.274 . . . . 4.2599999999999998 111.585 -175.149 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 104' ' ' ILE . . . . . . . . . . . . . 84.8 mt -78.77 -63.2 1.16 Allowed 'Isoleucine or valine' 0 CA--C 1.532 0.273 0 N-CA-C 108.128 -1.064 . . . . 7.6299999999999999 108.128 176.313 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER 58.85 83.99 0.12 Allowed 'General case' 0 CA--C 1.533 0.324 0 C-N-CA 125.942 1.697 . . . . 8.1699999999999999 113.305 177.39 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 51.1 m . . . . . 0 C--O 1.247 0.973 0 C-N-CA 128.358 2.663 . . . . 8.0 107.614 -178.422 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.471 1.026 0 N-CA-C 108.948 -1.661 . . . . 12.57 108.948 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 67.7 m -118.99 -176.09 3.04 Favored 'General case' 0 C--N 1.332 -0.194 0 N-CA-C 107.956 -1.127 . . . . 12.960000000000001 107.956 174.856 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 30.2 ttmt -130.93 -42.54 1.11 Allowed 'General case' 0 C--O 1.226 -0.157 0 C-N-CA 122.494 0.318 . . . . 16.25 110.86 -171.612 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -87.96 -174.23 47.87 Favored Glycine 0 C--N 1.334 0.424 0 N-CA-C 109.601 -1.4 . . . . 11.9 109.601 164.501 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 31.7 m -77.15 -159.59 0.04 OUTLIER 'Isoleucine or valine' 0 N--CA 1.446 -0.672 0 N-CA-C 109.142 -0.688 . . . . 12.23 109.142 169.102 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 28.6 mt-10 -103.16 111.24 23.51 Favored 'General case' 0 N--CA 1.447 -0.591 0 CA-C-O 121.474 0.654 . . . . 9.6199999999999992 111.154 -176.653 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 1.2 mm? -96.33 34.76 1.56 Allowed 'General case' 0 N--CA 1.455 -0.209 0 C-N-CA 122.881 0.473 . . . . 7.5700000000000003 109.741 -173.804 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 14.7 mtp85 68.84 -71.76 0.11 Allowed 'General case' 0 C--O 1.219 -0.509 0 C-N-CA 123.878 0.871 . . . . 7.4299999999999997 109.253 -166.837 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 1.1 m120 -44.38 -38.61 4.09 Favored 'General case' 0 C--O 1.226 -0.158 0 N-CA-C 113.635 0.976 . . . . 2.8799999999999999 113.635 177.205 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 10.3 t70 -73.23 -40.83 64.36 Favored 'General case' 0 C--O 1.225 -0.207 0 CA-C-N 118.296 0.498 . . . . 2.73 111.667 -179.752 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 4.9 t -64.7 -60.57 2.96 Favored 'General case' 0 N--CA 1.458 -0.036 0 N-CA-C 108.998 -0.741 . . . . 2.48 108.998 176.724 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . 0.575 ' HA ' HD11 ' A' ' 15' ' ' ILE . 1.1 mp0 -59.99 -36.75 77.85 Favored 'General case' 0 N--CA 1.451 -0.392 0 C-N-CA 124.327 1.051 . . . . 3.7999999999999998 109.73 -175.215 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -60.91 -54.04 40.17 Favored Glycine 0 CA--C 1.527 0.824 0 N-CA-C 111.062 -0.815 . . . . 0.93000000000000005 111.062 173.917 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 72.8 t80 -57.33 -54.89 41.66 Favored 'General case' 0 N--CA 1.455 -0.22 0 C-N-CA 123.924 0.889 . . . . 2.4199999999999999 110.31 -176.344 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . 0.575 HD11 ' HA ' ' A' ' 12' ' ' GLU . 0.8 OUTLIER -66.29 -28.95 45.1 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.259 0 O-C-N 121.177 -0.952 . . . . 0.81999999999999995 112.745 179.105 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 1.6 t-160 -58.82 -53.76 54.75 Favored 'General case' 0 C--N 1.342 0.248 0 N-CA-C 105.938 -1.875 . . . . 0.67000000000000004 105.938 174.607 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 7.4 mt-10 -53.74 -43.01 68.77 Favored 'General case' 0 C--O 1.223 -0.308 0 CA-C-O 118.824 -0.607 . . . . 2.5600000000000001 111.175 177.208 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 7.2 t80 -56.83 -44.94 82.58 Favored 'General case' 0 C--N 1.333 -0.137 0 CA-C-N 119.156 0.889 . . . . 2.1099999999999999 111.228 178.498 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -51.49 -49.64 44.89 Favored Glycine 0 CA--C 1.524 0.645 0 N-CA-C 110.198 -1.161 . . . . 0.57999999999999996 110.198 170.837 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 20' ' ' HIS . . . . . 0.506 ' CE1' ' HB1' ' A' ' 64' ' ' ALA . 2.0 t60 -59.28 -44.46 92.47 Favored 'General case' 0 N--CA 1.45 -0.473 0 O-C-N 121.59 -0.947 . . . . 1.75 111.641 -178.72 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -61.29 -32.56 72.4 Favored 'General case' 0 N--CA 1.452 -0.343 0 CA-C-N 118.398 0.544 . . . . 0.59999999999999998 109.849 178.212 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 3.5 t -67.16 -38.66 81.53 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.213 0 O-C-N 121.191 -0.943 . . . . 1.01 111.501 175.122 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 6.8 t0 -60.46 -27.75 67.77 Favored 'General case' 0 C--N 1.333 -0.149 0 CA-C-O 120.9 0.381 . . . . 1.99 110.702 175.02 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 13.8 t70 -65.26 -54.37 30.31 Favored 'General case' 0 N--CA 1.454 -0.253 0 N-CA-C 108.191 -1.04 . . . . 2.2999999999999998 108.191 -177.137 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 25' ' ' TYR . . . . . 0.717 ' HB2' HD12 ' A' ' 103' ' ' ILE . 10.9 t80 -59.56 -48.83 80.14 Favored 'General case' 0 CA--C 1.517 -0.32 0 CA-C-N 116.098 -0.501 . . . . 2.7200000000000002 110.503 179.77 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -57.53 -39.67 77.11 Favored 'General case' 0 N--CA 1.448 -0.527 0 CA-C-O 118.646 -0.692 . . . . 1.2 111.014 -179.322 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -64.92 -59.18 8.36 Favored Glycine 0 C--O 1.223 -0.541 0 N-CA-C 109.725 -1.35 . . . . 1.6899999999999999 109.725 177.767 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -47.97 -44.01 30.06 Favored 'General case' 0 CA--C 1.531 0.233 0 C-N-CA 124.942 1.297 . . . . 2.0099999999999998 110.989 -174.26 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -82.96 -32.77 26.92 Favored 'General case' 0 N--CA 1.449 -0.499 0 N-CA-C 113.303 0.853 . . . . 1.54 113.303 179.537 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 13.7 mt -129.23 70.67 1.41 Allowed 'General case' 0 N--CA 1.456 -0.157 0 CA-C-N 119.115 0.87 . . . . 2.77 109.689 -166.623 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -131.65 153.3 50.11 Favored 'General case' 0 CA--C 1.518 -0.285 0 N-CA-C 108.917 -0.772 . . . . 4.6600000000000001 108.917 176.305 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 4.3 ttmt -87.55 -69.55 0.68 Allowed 'General case' 0 C--O 1.226 -0.155 0 N-CA-C 108.011 -1.107 . . . . 10.619999999999999 108.011 176.909 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 56.0 t30 -160.32 149.67 17.5 Favored 'General case' 0 N--CA 1.449 -0.523 0 N-CA-C 108.373 -0.973 . . . . 7.1200000000000001 108.373 169.826 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 35.8 tt0 43.53 42.8 4.22 Favored 'General case' 0 CA--C 1.537 0.476 0 C-N-CA 125.543 1.537 . . . . 8.2200000000000006 113.185 167.277 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 66.1 m -144.42 46.6 1.4 Allowed 'General case' 0 C--O 1.223 -0.334 0 O-C-N 121.778 -0.576 . . . . 7.0300000000000002 110.625 -176.897 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -44.12 121.19 2.39 Favored 'General case' 0 CA--C 1.531 0.23 0 C-N-CA 125.385 1.474 . . . . 4.9500000000000002 113.08 -172.617 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 11.1 mp 101.52 139.33 0.01 OUTLIER 'General case' 0 N--CA 1.467 0.375 1 C-N-CA 131.715 4.006 . . . . 2.25 108.659 173.381 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 9.1 p -64.92 -31.82 55.55 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.223 0 C-N-CA 119.733 -0.787 . . . . 2.3900000000000001 110.202 -175.053 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 10.3 t -53.52 -62.2 1.81 Allowed 'General case' 0 CA--C 1.537 0.471 0 C-N-CA 122.876 0.47 . . . . 4.3499999999999996 111.345 -179.427 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 43.9 t30 -89.38 57.51 4.03 Favored 'General case' 0 N--CA 1.462 0.152 0 O-C-N 121.156 -0.965 . . . . 6.1399999999999997 109.221 -175.121 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 23.2 t -166.84 -47.66 0.02 OUTLIER 'General case' 0 N--CA 1.454 -0.271 0 O-C-N 121.883 -0.51 . . . . 4.1200000000000001 110.717 -174.465 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 7.8 tptt -55.4 121.04 8.08 Favored 'General case' 0 CA--C 1.532 0.256 0 O-C-N 121.385 -0.822 . . . . 6.9199999999999999 109.26 179.877 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 24.4 mttm 56.76 -89.72 0.02 OUTLIER 'General case' 0 N--CA 1.463 0.208 0 C-N-CA 123.507 0.723 . . . . 6.3399999999999999 110.139 -170.75 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 26.7 p90 -172.17 156.94 4.09 Favored 'General case' 0 N--CA 1.45 -0.461 0 C-N-CA 125.425 1.49 . . . . 7.9100000000000001 107.388 -178.656 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 45' ' ' ILE . . . . . 0.571 HG22 ' OE1' ' A' ' 63' ' ' GLU . 0.1 OUTLIER -42.97 106.19 0.03 OUTLIER 'Isoleucine or valine' 0 CA--C 1.545 0.783 0 C-N-CA 123.842 0.857 . . . . 3.3700000000000001 112.048 169.411 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 5.8 t70 -148.61 -60.04 0.23 Allowed 'General case' 0 N--CA 1.47 0.561 0 C-N-CA 124.554 1.141 . . . . 2.3199999999999998 109.483 -179.891 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 47' ' ' ILE . . . . . 0.46 ' HA ' ' HE2' ' A' ' 91' ' ' LYS . 3.4 mm -50.99 -52.0 19.13 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.238 0 C-N-CA 124.989 1.316 . . . . 0.47999999999999998 107.989 -179.967 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 28.5 t80 -61.82 -36.18 80.41 Favored 'General case' 0 N--CA 1.45 -0.469 0 C-N-CA 124.852 1.261 . . . . 0.40000000000000002 113.665 173.845 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . 0.468 ' HA ' ' HE2' ' A' ' 49' ' ' LYS . 1.0 OUTLIER -59.54 -49.15 78.91 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 120.025 1.284 . . . . 1.0 110.926 -175.23 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 9.5 mm-40 -81.94 -64.02 1.27 Allowed 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 121.902 0.858 . . . . 2.3399999999999999 109.302 178.708 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 25.6 mm-40 -75.04 -24.05 58.24 Favored 'General case' 0 C--O 1.235 0.341 0 O-C-N 121.703 -0.623 . . . . 2.8199999999999998 111.208 -164.933 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -72.79 45.2 1.05 Allowed Glycine 0 N--CA 1.442 -0.956 0 C-N-CA 124.622 1.106 . . . . 0.34999999999999998 112.551 168.716 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 22.2 t -153.2 32.9 0.47 Allowed 'General case' 0 N--CA 1.449 -0.492 0 O-C-N 121.147 -1.208 . . . . 2.3199999999999998 109.058 151.89 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 2.2 t-20 -133.71 -45.56 0.81 Allowed 'General case' 0 CA--C 1.521 -0.171 0 CA-C-O 120.638 0.256 . . . . 1.5800000000000001 111.276 -168.433 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . 0.535 HD22 HG22 ' A' ' 85' ' ' VAL . 21.2 mt -59.86 -37.22 78.69 Favored 'General case' 0 CA--C 1.529 0.147 0 O-C-N 122.128 -0.357 . . . . 0.67000000000000004 111.273 -177.275 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER 178.27 173.15 0.66 Allowed 'General case' 0 CA--C 1.533 0.294 0 C-N-CA 126.031 1.733 . . . . 0.68999999999999995 107.171 -177.889 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 15.5 m -61.94 -35.08 77.38 Favored 'General case' 0 N--CA 1.455 -0.188 0 O-C-N 121.6 -0.687 . . . . 0.93000000000000005 110.719 169.178 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 1.1 m-85 -69.31 -8.05 42.68 Favored 'General case' 0 N--CA 1.467 0.401 0 O-C-N 121.804 -0.56 . . . . 1.23 112.096 172.32 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -80.65 -18.39 70.77 Favored Glycine 0 N--CA 1.445 -0.72 0 N-CA-C 110.693 -0.963 . . . . 0.45000000000000001 110.693 170.544 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -104.09 -16.34 15.3 Favored 'General case' 0 CA--C 1.518 -0.254 0 CA-C-N 118.719 1.259 . . . . 2.4500000000000002 113.128 -176.132 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 41.6 p -64.43 -161.17 0.01 OUTLIER 'General case' 0 CA--C 1.539 0.535 0 N-CA-C 108.972 -0.751 . . . . 0.89000000000000001 108.972 169.925 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 39.6 m-80 -51.47 145.53 8.57 Favored 'General case' 0 CA--C 1.53 0.21 0 O-C-N 120.369 -1.457 . . . . 1.95 111.011 -176.867 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . 0.571 ' OE1' HG22 ' A' ' 45' ' ' ILE . 47.4 tt0 -60.21 -19.37 53.98 Favored 'General case' 0 CA--C 1.541 0.623 0 C-N-CA 124.223 1.009 . . . . 2.9500000000000002 111.938 -177.703 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 64' ' ' ALA . . . . . 0.506 ' HB1' ' CE1' ' A' ' 20' ' ' HIS . . . -61.24 -47.92 83.84 Favored 'General case' 0 N--CA 1.453 -0.315 0 C-N-CA 125.973 1.709 . . . . 0.46999999999999997 112.022 168.688 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 5.2 mt-10 -70.39 -42.23 71.99 Favored 'General case' 0 CA--C 1.51 -0.587 0 O-C-N 121.548 -0.72 . . . . 1.7 111.036 177.935 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 63.6 t80 -45.89 -53.26 10.12 Favored 'General case' 0 N--CA 1.45 -0.45 0 C-N-CA 123.397 0.679 . . . . 0.35999999999999999 110.896 172.385 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 82.0 t80 -64.35 -41.14 96.9 Favored 'General case' 0 CA--C 1.534 0.332 0 O-C-N 122.131 -0.356 . . . . 0.96999999999999997 111.62 176.523 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -61.38 -50.56 72.4 Favored 'General case' 0 CA--C 1.537 0.462 0 O-C-N 121.022 -1.049 . . . . 0.26000000000000001 111.262 -174.935 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 5.4 mm-40 -53.69 -43.71 69.17 Favored 'General case' 0 CA--C 1.521 -0.157 0 C-N-CA 124.653 1.181 . . . . 4.1699999999999999 110.466 168.524 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -55.87 -39.93 72.22 Favored 'General case' 0 N--CA 1.453 -0.3 0 CA-C-N 118.487 0.585 . . . . 0.53000000000000003 110.214 179.437 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 2.7 t80 -65.04 -51.59 60.64 Favored 'General case' 0 CA--C 1.53 0.2 0 CA-C-N 119.239 0.927 . . . . 2.2799999999999998 110.921 175.247 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 12.5 ttt180 -43.72 -56.87 3.52 Favored 'General case' 0 N--CA 1.469 0.499 0 C-N-CA 123.849 0.86 . . . . 2.4900000000000002 110.558 177.134 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . 0.461 HD12 HG23 ' A' ' 85' ' ' VAL . 0.2 OUTLIER -59.67 -52.91 63.5 Favored 'General case' 0 N--CA 1.452 -0.371 0 C-N-CA 125.664 1.585 . . . . 1.1599999999999999 109.819 179.679 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 0.6 OUTLIER -58.26 -37.57 75.22 Favored 'General case' 0 CA--C 1.531 0.22 0 CA-C-N 118.94 0.791 . . . . 2.6699999999999999 111.899 -171.667 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 75' ' ' HIS . . . . . 0.45 ' CE1' HD12 ' A' ' 15' ' ' ILE . 2.6 p80 -85.49 -14.9 44.59 Favored 'General case' 0 N--CA 1.461 0.091 0 CA-C-O 118.356 -0.83 . . . . 1.6000000000000001 111.735 -179.849 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 1.1 t -56.5 117.05 3.48 Favored 'General case' 0 N--CA 1.443 -0.809 0 N-CA-C 106.616 -1.624 . . . . 2.3399999999999999 106.616 -174.65 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -53.39 -32.83 51.31 Favored 'General case' 0 C--N 1.319 -0.757 0 CA-C-N 115.351 -0.84 . . . . 2.6600000000000001 110.997 -178.838 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 24.4 t0 -55.51 106.26 0.23 Allowed 'General case' 0 N--CA 1.447 -0.584 0 CA-C-O 122.73 1.252 . . . . 2.0299999999999998 110.247 165.312 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 32.7 m80 -63.12 -29.31 70.7 Favored 'General case' 0 N--CA 1.449 -0.514 0 CA-C-N 115.151 -0.931 . . . . 5.5 110.189 178.985 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -59.81 -56.69 18.66 Favored 'General case' 0 N--CA 1.448 -0.557 0 CA-C-N 119.093 0.86 . . . . 0.78000000000000003 109.714 177.323 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -43.47 -47.62 7.13 Favored 'General case' 0 C--O 1.232 0.15 0 C-N-CA 124.98 1.312 . . . . 2.7799999999999998 110.778 179.13 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 35.8 mtp180 -63.83 -54.14 39.64 Favored 'General case' 0 N--CA 1.451 -0.407 0 CA-C-N 114.857 -1.065 . . . . 2.2999999999999998 110.036 -177.721 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . 0.423 HD13 ' HA ' ' A' ' 83' ' ' LEU . 0.9 OUTLIER -63.35 -17.67 62.84 Favored 'General case' 0 N--CA 1.45 -0.46 0 CA-C-O 117.97 -1.014 . . . . 0.85999999999999999 112.603 176.439 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 2.0 mptm? -66.39 -46.64 75.93 Favored 'General case' 0 CA--C 1.516 -0.329 0 CA-C-N 121.29 1.859 . . . . 1.3300000000000001 107.731 169.066 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 85' ' ' VAL . . . . . 0.535 HG22 HD22 ' A' ' 55' ' ' LEU . 56.4 t -56.36 -50.93 69.62 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.657 0 CA-C-O 117.607 -1.187 . . . . 0.81000000000000005 109.822 174.7 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 1.9 mt-30 -59.12 -57.23 13.96 Favored 'General case' 0 N--CA 1.466 0.374 0 CA-C-N 121.475 1.943 . . . . 2.25 112.304 -178.684 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 11.4 tttm -57.25 -38.27 73.6 Favored 'General case' 0 C--N 1.329 -0.292 0 C-N-CA 123.41 0.684 . . . . 2.4700000000000002 111.602 -175.116 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 17.0 m-80 -84.51 -20.88 30.92 Favored 'General case' 0 C--O 1.222 -0.372 0 CA-C-O 118.476 -0.774 . . . . 1.98 110.705 179.387 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -144.68 81.48 10.93 Favored Pre-proline 0 C--O 1.237 0.403 0 C-N-CA 125.417 1.487 . . . . 0.54000000000000004 109.907 -174.152 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 84.5 Cg_endo -78.53 35.35 0.54 Allowed 'Trans proline' 0 CA--C 1.54 0.805 0 C-N-CA 123.509 2.806 . . . . 1.8200000000000001 112.476 -175.205 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 91' ' ' LYS . . . . . 0.46 ' HE2' ' HA ' ' A' ' 47' ' ' ILE . 14.4 ptmt -149.87 -52.41 0.15 Allowed 'General case' 0 N--CA 1.454 -0.232 0 C-N-CA 125.72 1.608 . . . . 2.79 109.628 -179.655 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 3.3 m -50.36 -47.21 56.17 Favored 'General case' 0 N--CA 1.462 0.149 0 O-C-N 121.419 -0.801 . . . . 0.51000000000000001 111.379 178.2 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 16.6 t80 -58.64 -49.28 78.12 Favored 'General case' 0 CA--C 1.508 -0.659 0 C-N-CA 120.277 -0.569 . . . . 1.9199999999999999 112.095 -177.901 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 39.8 tt0 -53.02 -36.57 60.66 Favored 'General case' 0 N--CA 1.446 -0.647 0 CA-C-N 115.115 -0.948 . . . . 1.46 109.507 -179.88 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -60.61 -59.87 4.7 Favored 'General case' 0 N--CA 1.45 -0.43 0 C-N-CA 123.296 0.639 . . . . 1.1599999999999999 109.424 -178.455 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 23.4 mm -47.98 -46.59 12.61 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.249 0 C-N-CA 124.01 0.924 . . . . 1.5 110.428 175.728 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 1.4 t30 -61.21 -35.29 76.81 Favored 'General case' 0 CA--C 1.53 0.186 0 C-N-CA 123.413 0.685 . . . . 1.6000000000000001 111.175 -176.969 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 35.7 t0 -61.81 -62.22 1.95 Allowed 'General case' 0 CA--C 1.52 -0.2 0 C-N-CA 124.152 0.981 . . . . 2.1400000000000001 108.855 174.919 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 20.8 pt20 -90.93 73.75 6.47 Favored 'General case' 0 N--CA 1.446 -0.659 0 C-N-CA 120.227 -0.589 . . . . 4.9299999999999997 111.08 -171.055 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 25.9 pt -48.23 -44.43 12.63 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.352 0 C-N-CA 123.072 0.549 . . . . 4.25 111.437 -176.305 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 4.5 mmtm 59.41 154.64 0.02 OUTLIER 'General case' 0 C--O 1.224 -0.272 0 C-N-CA 126.952 2.101 . . . . 9.8800000000000008 113.06 -176.375 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 102' ' ' PHE . . . . . . . . . . . . . 30.1 p90 -162.76 48.58 0.16 Allowed 'General case' 0 N--CA 1.453 -0.317 0 CA-C-N 115.0 -1.0 . . . . 7.7199999999999998 108.589 -170.797 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 103' ' ' ILE . . . . . 0.717 HD12 ' HB2' ' A' ' 25' ' ' TYR . 12.6 tt -51.63 -43.05 31.8 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.389 0 O-C-N 121.62 -0.675 . . . . 4.8899999999999997 110.33 179.435 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 104' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -149.18 132.59 7.6 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.764 0 N-CA-C 105.326 -2.101 . . . . 5.7599999999999998 105.326 171.97 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 4.0 t-20 69.47 175.71 0.28 Allowed 'General case' 0 CA--C 1.533 0.312 0 C-N-CA 124.722 1.209 . . . . 7.3499999999999996 112.121 178.843 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 30.7 m . . . . . 0 C--O 1.251 1.156 0 C-N-CA 126.164 1.786 . . . . 11.75 108.177 175.294 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.471 1.025 0 N-CA-C 110.2 -1.16 . . . . 19.600000000000001 110.2 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -160.65 167.65 26.55 Favored 'General case' 0 CA--C 1.529 0.141 0 CA-C-N 118.703 1.252 . . . . 19.129999999999999 108.806 177.499 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 4.2 ptpt -168.13 159.81 11.3 Favored 'General case' 0 N--CA 1.464 0.243 0 C-N-CA 125.192 1.397 . . . . 24.510000000000002 107.741 175.397 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 138.0 -131.48 5.46 Favored Glycine 0 C--N 1.333 0.363 0 N-CA-C 109.736 -1.346 . . . . 17.149999999999999 109.736 175.985 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 27.7 m -72.46 -161.59 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.447 -0.612 0 C-N-CA 123.057 0.543 . . . . 15.98 109.577 172.423 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 11.2 pt-20 -80.31 121.96 26.31 Favored 'General case' 0 N--CA 1.449 -0.498 0 O-C-N 121.13 -0.981 . . . . 10.210000000000001 111.529 177.134 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 3.2 mt -122.35 34.52 5.13 Favored 'General case' 0 N--CA 1.452 -0.364 0 N-CA-C 107.875 -1.157 . . . . 11.050000000000001 107.875 -175.852 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 81.9 mtt180 65.07 44.29 3.43 Favored 'General case' 0 C--O 1.225 -0.199 0 C-N-CA 124.982 1.313 . . . . 9.3800000000000008 111.679 -173.123 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 2.5 m-20 -47.82 -41.79 24.66 Favored 'General case' 0 CA--C 1.515 -0.388 0 C-N-CA 124.618 1.167 . . . . 3.77 113.752 178.526 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 29.5 t70 -57.32 -50.78 71.86 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 118.226 0.466 . . . . 2.4500000000000002 110.201 178.684 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 74.4 m -63.1 -51.79 65.18 Favored 'General case' 0 N--CA 1.452 -0.352 0 C-N-CA 122.927 0.491 . . . . 1.74 111.288 178.828 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . 0.47 ' HA ' HD11 ' A' ' 15' ' ' ILE . 11.0 mt-10 -59.37 -37.18 77.28 Favored 'General case' 0 N--CA 1.455 -0.197 0 C-N-CA 123.071 0.548 . . . . 3.8500000000000001 110.507 -176.029 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -59.33 -58.99 11.49 Favored Glycine 0 CA--C 1.527 0.834 0 N-CA-C 110.256 -1.137 . . . . 0.67000000000000004 110.256 171.623 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 25.5 t80 -55.38 -51.44 66.8 Favored 'General case' 0 N--CA 1.454 -0.239 0 C-N-CA 124.032 0.933 . . . . 2.2999999999999998 111.487 -173.216 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . 0.47 HD11 ' HA ' ' A' ' 12' ' ' GLU . 0.7 OUTLIER -66.02 -32.34 57.68 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.217 0 O-C-N 121.232 -0.918 . . . . 0.44 111.934 179.001 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 3.4 t60 -58.4 -52.28 66.29 Favored 'General case' 0 C--N 1.342 0.279 0 N-CA-C 106.993 -1.484 . . . . 0.48999999999999999 106.993 176.064 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 44.7 mt-10 -57.47 -41.49 80.74 Favored 'General case' 0 N--CA 1.454 -0.258 0 CA-C-O 118.69 -0.671 . . . . 2.0099999999999998 111.108 179.298 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -51.66 -47.29 63.84 Favored 'General case' 0 N--CA 1.464 0.269 0 CA-C-N 119.126 0.875 . . . . 3.04 111.72 175.396 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -48.0 -49.91 22.61 Favored Glycine 0 CA--C 1.528 0.895 0 N-CA-C 110.482 -1.047 . . . . 0.44 110.482 174.328 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 20' ' ' HIS . . . . . 0.567 ' CE1' ' HB1' ' A' ' 64' ' ' ALA . 1.7 t-160 -62.11 -40.64 96.59 Favored 'General case' 0 N--CA 1.451 -0.408 0 O-C-N 122.033 -0.687 . . . . 1.8999999999999999 111.817 178.701 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -60.5 -32.5 71.5 Favored 'General case' 0 N--CA 1.454 -0.244 0 O-C-N 121.002 -1.061 . . . . 0.59999999999999998 109.971 179.452 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 58.0 t -70.67 -34.43 56.84 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.222 0 O-C-N 121.293 -0.879 . . . . 0.81000000000000005 111.142 178.041 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 80.0 m-20 -59.86 -29.45 68.3 Favored 'General case' 0 N--CA 1.468 0.441 0 CA-C-N 118.744 0.702 . . . . 2.4199999999999999 111.33 172.205 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 17.9 t70 -68.45 -48.05 65.56 Favored 'General case' 0 N--CA 1.452 -0.34 0 N-CA-C 108.643 -0.873 . . . . 1.99 108.643 -174.756 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 18.4 t80 -55.53 -46.75 77.02 Favored 'General case' 0 N--CA 1.453 -0.313 0 CA-C-N 115.658 -0.701 . . . . 2.6400000000000001 110.298 173.325 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -58.93 -28.95 66.72 Favored 'General case' 0 C--O 1.22 -0.476 0 CA-C-O 118.585 -0.722 . . . . 1.1699999999999999 112.439 176.879 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -71.77 -25.41 75.04 Favored Glycine 0 CA--C 1.525 0.687 0 CA-C-N 119.429 1.013 . . . . 1.7 112.497 179.217 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 1.0 OUTLIER -91.95 -43.82 9.24 Favored 'General case' 0 CA--C 1.53 0.209 0 O-C-N 121.92 -0.753 . . . . 2.8599999999999999 111.175 -179.828 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -78.66 -38.37 39.66 Favored 'General case' 0 CA--C 1.512 -0.505 0 C-N-CA 124.227 1.011 . . . . 1.6000000000000001 112.169 -176.666 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 7.9 mt -113.7 175.84 5.29 Favored 'General case' 0 N--CA 1.441 -0.892 0 N-CA-C 104.872 -2.27 . . . . 2.6000000000000001 104.872 179.326 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 65.4 m-20 63.39 124.91 0.01 OUTLIER 'General case' 0 CA--C 1.536 0.422 0 CA-C-O 123.436 1.588 . . . . 4.96 112.113 -179.239 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 65.0 mttt -92.7 50.15 1.55 Allowed 'General case' 0 N--CA 1.464 0.249 0 O-C-N 119.047 -2.283 . . . . 7.79 110.541 -164.453 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 2.1 t30 -161.86 103.07 1.16 Allowed 'General case' 0 N--CA 1.451 -0.415 0 C-N-CA 125.409 1.484 . . . . 6.7599999999999998 107.937 -179.349 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 10.7 mp0 -50.81 -41.93 57.85 Favored 'General case' 0 N--CA 1.466 0.326 0 CA-C-N 119.065 0.848 . . . . 12.789999999999999 112.752 -173.127 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 18.8 m -83.43 63.2 7.18 Favored 'General case' 0 N--CA 1.454 -0.265 0 O-C-N 121.717 -0.614 . . . . 9.4900000000000002 110.224 -179.617 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 36' ' ' ASP . . . . . 0.431 ' C ' HD12 ' A' ' 37' ' ' LEU . 8.6 t0 -154.82 174.29 15.27 Favored 'General case' 0 CA--C 1.532 0.26 0 N-CA-C 108.445 -0.946 . . . . 6.1299999999999999 108.445 173.934 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . 0.431 HD12 ' C ' ' A' ' 36' ' ' ASP . 3.7 mp -141.46 142.1 33.66 Favored 'General case' 0 C--O 1.234 0.266 0 N-CA-C 107.487 -1.301 . . . . 2.5499999999999998 107.487 178.103 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 1.0 OUTLIER -62.91 114.63 1.7 Allowed 'Isoleucine or valine' 0 C--O 1.226 -0.17 0 N-CA-C 108.172 -1.047 . . . . 3.4900000000000002 108.172 -176.537 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 9.7 p -139.46 3.22 2.1 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 121.36 0.6 . . . . 3.6600000000000001 110.425 -178.894 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 9.5 m-80 -163.31 93.69 0.78 Allowed 'General case' 0 N--CA 1.453 -0.312 0 O-C-N 120.689 -1.257 . . . . 4.8700000000000001 107.839 173.423 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 22.1 t -151.15 -175.26 5.09 Favored 'General case' 0 N--CA 1.452 -0.354 0 N-CA-C 108.57 -0.9 . . . . 3.8199999999999998 108.57 173.427 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . 0.448 ' HE3' ' OD1' ' A' ' 98' ' ' ASP . 10.8 tmtt? 51.27 -79.49 0.01 OUTLIER 'General case' 0 N--CA 1.462 0.16 0 C-N-CA 127.68 2.392 . . . . 7.4800000000000004 112.468 -176.479 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -72.82 -28.15 62.38 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-O 117.614 -1.184 . . . . 6.4299999999999997 111.865 177.289 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 13.2 m-85 58.89 102.58 0.02 OUTLIER 'General case' 0 C--N 1.34 0.193 0 C-N-CA 127.023 2.129 . . . . 7.0099999999999998 112.356 -173.071 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . 0.332 1.7 tt 43.92 -140.17 0.02 OUTLIER 'Isoleucine or valine' 0 CA--C 1.538 0.516 0 CA-C-O 116.511 -1.709 . . . . 4.1100000000000003 109.812 -177.693 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 20.0 t70 64.28 -68.47 0.1 Allowed 'General case' 0 N--CA 1.479 0.98 0 C-N-CA 127.034 2.134 . . . . 3.0299999999999998 112.517 -176.949 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 10.5 mm -38.05 -65.66 0.07 OUTLIER 'Isoleucine or valine' 0 N--CA 1.449 -0.521 0 C-N-CA 129.84 3.256 . . . . 0.97999999999999998 109.912 173.453 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 24.2 t80 -64.74 -26.67 68.46 Favored 'General case' 0 N--CA 1.453 -0.3 0 O-C-N 120.98 -1.075 . . . . 0.46000000000000002 112.363 179.775 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . 0.568 ' HA ' ' HE2' ' A' ' 49' ' ' LYS . 10.2 mmpt? -69.4 -47.79 63.1 Favored 'General case' 0 N--CA 1.452 -0.362 0 O-C-N 120.092 -1.63 . . . . 1.04 111.07 -176.195 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -89.31 -63.36 1.3 Allowed 'General case' 0 C--N 1.33 -0.274 0 N-CA-C 108.077 -1.082 . . . . 3.3599999999999999 108.077 -177.721 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 7.8 mm-40 -67.16 -33.05 74.59 Favored 'General case' 0 CA--C 1.532 0.278 0 N-CA-C 109.193 -0.669 . . . . 2.2000000000000002 109.193 -169.221 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -68.13 39.97 0.26 Allowed Glycine 0 CA--C 1.531 1.036 0 C-N-CA 125.836 1.684 . . . . 0.32000000000000001 114.308 167.646 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 26.4 m -146.75 24.36 1.21 Allowed 'General case' 0 CA--C 1.533 0.29 0 O-C-N 120.771 -1.429 . . . . 2.1099999999999999 110.66 154.026 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -131.14 -36.67 1.3 Allowed 'General case' 0 C--N 1.341 0.218 0 N-CA-C 113.283 0.845 . . . . 2.77 113.283 -170.81 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . 0.561 HD22 HG22 ' A' ' 85' ' ' VAL . 32.7 mt -66.23 -35.47 80.52 Favored 'General case' 0 N--CA 1.465 0.281 0 CA-C-N 119.383 0.992 . . . . 0.55000000000000004 110.876 -176.873 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 1.3 t 177.98 172.87 0.62 Allowed 'General case' 0 CA--C 1.531 0.246 0 C-N-CA 125.403 1.481 . . . . 0.58999999999999997 107.837 -178.438 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 6.4 m -57.91 -34.98 70.41 Favored 'General case' 0 N--CA 1.452 -0.34 0 C-N-CA 123.364 0.666 . . . . 0.93999999999999995 110.544 166.851 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -65.89 -16.54 63.94 Favored 'General case' 0 CA--C 1.534 0.349 0 N-CA-C 112.253 0.464 . . . . 1.0 112.253 175.312 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -85.29 -11.48 75.44 Favored Glycine 0 N--CA 1.444 -0.776 0 N-CA-C 110.786 -0.926 . . . . 0.37 110.786 175.334 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 4.5 tmt_? -105.81 -19.88 13.62 Favored 'General case' 0 C--O 1.228 -0.062 0 CA-C-N 119.025 1.412 . . . . 3.3399999999999999 112.112 179.556 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 1.6 p -59.46 -164.12 0.01 OUTLIER 'General case' 0 CA--C 1.536 0.442 0 C-N-CA 124.998 1.319 . . . . 0.80000000000000004 110.723 170.88 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 50.9 t30 -54.46 149.58 10.2 Favored 'General case' 0 CA--C 1.529 0.172 0 O-C-N 120.635 -1.29 . . . . 2.1600000000000001 110.158 -176.429 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 14.8 tm-20 -56.85 -39.46 74.32 Favored 'General case' 0 C--O 1.222 -0.348 0 CA-C-O 120.995 0.426 . . . . 3.5699999999999998 110.24 -173.492 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 64' ' ' ALA . . . . . 0.567 ' HB1' ' CE1' ' A' ' 20' ' ' HIS . . . -56.83 -29.18 62.56 Favored 'General case' 0 C--N 1.328 -0.333 0 N-CA-C 113.421 0.897 . . . . 0.51000000000000001 113.421 178.857 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 6.2 mt-10 -76.95 -42.87 37.39 Favored 'General case' 0 N--CA 1.452 -0.365 0 O-C-N 121.085 -1.009 . . . . 2.1499999999999999 110.499 175.839 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 27.8 t80 -52.51 -49.63 64.4 Favored 'General case' 0 CA--C 1.532 0.261 0 C-N-CA 125.03 1.332 . . . . 0.28000000000000003 111.299 172.585 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 47.8 t80 -64.65 -47.01 80.06 Favored 'General case' 0 CA--C 1.534 0.361 0 O-C-N 120.898 -1.126 . . . . 0.52000000000000002 110.239 177.031 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -57.68 -56.14 25.73 Favored 'General case' 0 CA--C 1.536 0.412 0 O-C-N 121.243 -0.911 . . . . 0.29999999999999999 111.927 -175.198 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -59.99 -34.0 72.74 Favored 'General case' 0 CA--C 1.53 0.208 0 C-N-CA 123.713 0.805 . . . . 3.7000000000000002 111.7 174.384 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -56.27 -46.19 79.81 Favored 'General case' 0 C--O 1.221 -0.443 0 CA-C-N 119.155 0.889 . . . . 0.44 109.856 172.211 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 2.2 t80 -55.73 -49.02 74.18 Favored 'General case' 0 N--CA 1.463 0.202 0 CA-C-N 119.355 0.979 . . . . 2.8500000000000001 111.371 179.539 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 32.6 ttt180 -47.93 -59.67 3.17 Favored 'General case' 0 N--CA 1.466 0.363 0 N-CA-C 109.419 -0.585 . . . . 2.23 109.419 174.04 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . 0.48 ' CB ' HG21 ' A' ' 85' ' ' VAL . 0.1 OUTLIER -63.1 -30.62 71.73 Favored 'General case' 0 C--N 1.33 -0.252 0 C-N-CA 124.594 1.158 . . . . 0.41999999999999998 111.579 -175.043 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -62.92 -41.42 99.46 Favored 'General case' 0 C--N 1.328 -0.366 0 C-N-CA 124.416 1.086 . . . . 3.02 110.14 -175.282 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 75' ' ' HIS . . . . . 0.414 ' CE1' HD12 ' A' ' 15' ' ' ILE . 7.9 p80 -95.81 -4.11 44.42 Favored 'General case' 0 N--CA 1.452 -0.342 0 CA-C-O 116.312 -1.804 . . . . 0.88 112.928 -179.19 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 3.2 m -37.73 125.74 1.15 Allowed 'General case' 0 CA--C 1.516 -0.336 0 CA-C-N 120.296 1.407 . . . . 1.02 111.645 -166.781 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -51.94 -40.57 61.02 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 113.418 -1.719 . . . . 1.04 109.38 178.987 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 78' ' ' ASP . . . . . 0.515 ' OD2' ' HB3' ' A' ' 80' ' ' ALA . 14.6 t0 -72.19 110.44 6.64 Favored 'General case' 0 N--CA 1.446 -0.651 0 C-N-CA 119.357 -0.937 . . . . 1.8200000000000001 109.448 163.793 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 1.8 p80 -47.44 -39.61 16.07 Favored 'General case' 0 N--CA 1.454 -0.246 0 CA-C-N 115.82 -0.627 . . . . 4.5899999999999999 112.091 170.869 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 80' ' ' ALA . . . . . 0.515 ' HB3' ' OD2' ' A' ' 78' ' ' ASP . . . -61.6 -48.3 81.56 Favored 'General case' 0 N--CA 1.452 -0.374 0 CA-C-N 118.127 0.422 . . . . 0.59999999999999998 110.036 -174.873 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 32.1 mt-10 -48.17 -39.39 20.67 Favored 'General case' 0 N--CA 1.452 -0.368 0 C-N-CA 124.22 1.008 . . . . 2.75 111.644 176.588 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 4.8 mtp180 -65.64 -47.26 76.19 Favored 'General case' 0 C--N 1.326 -0.415 0 C-N-CA 119.604 -0.838 . . . . 2.6699999999999999 108.878 179.545 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 1.5 mm? -61.79 -26.57 68.17 Favored 'General case' 0 N--CA 1.453 -0.285 0 CA-C-O 117.674 -1.155 . . . . 0.55000000000000004 112.321 174.779 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -62.77 -42.05 99.51 Favored 'General case' 0 C--O 1.224 -0.257 0 CA-C-N 121.231 1.832 . . . . 1.3700000000000001 108.329 172.773 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 85' ' ' VAL . . . . . 0.561 HG22 HD22 ' A' ' 55' ' ' LEU . 56.0 t -63.41 -61.79 1.5 Allowed 'Isoleucine or valine' 0 C--O 1.22 -0.48 0 CA-C-O 117.425 -1.274 . . . . 0.39000000000000001 111.148 173.273 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 3.9 mt-30 -49.33 -49.71 42.87 Favored 'General case' 0 N--CA 1.466 0.328 0 CA-C-N 121.024 1.738 . . . . 2.2400000000000002 111.103 -175.258 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 37.1 tttt -56.85 -53.27 59.79 Favored 'General case' 0 N--CA 1.447 -0.606 0 C-N-CA 123.764 0.826 . . . . 1.95 111.192 178.243 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 56.1 m-20 -88.43 9.75 22.46 Favored 'General case' 0 C--N 1.332 -0.166 0 C-N-CA 122.696 0.398 . . . . 1.3999999999999999 111.245 -172.986 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 89' ' ' ALA . . . . . 0.493 ' HB2' HD21 ' A' ' 55' ' ' LEU . . . -164.82 68.91 1.39 Allowed Pre-proline 0 N--CA 1.446 -0.642 0 C-N-CA 124.52 1.128 . . . . 0.5 109.013 -177.385 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 93.0 Cg_endo -80.86 57.51 6.57 Favored 'Trans proline' 0 CA--C 1.535 0.535 0 C-N-CA 124.737 3.625 . . . . 2.0899999999999999 111.939 -170.556 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 5.0 ptmt 174.72 -47.48 0.01 OUTLIER 'General case' 0 CA--C 1.533 0.315 0 C-N-CA 128.299 2.639 . . . . 2.3199999999999998 109.847 -170.268 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 13.8 m -55.56 -45.81 77.25 Favored 'General case' 0 N--CA 1.465 0.321 0 O-C-N 121.093 -1.004 . . . . 0.37 111.067 176.627 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 29.4 t80 -55.16 -47.24 75.41 Favored 'General case' 0 CA--C 1.513 -0.462 0 CA-C-O 121.584 0.707 . . . . 2.1000000000000001 110.595 176.684 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 4.3 mt-30 -57.49 -29.2 64.07 Favored 'General case' 0 N--CA 1.443 -0.783 0 CA-C-N 114.427 -1.26 . . . . 2.4199999999999999 111.443 178.787 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 8.3 t80 -62.91 -55.29 27.37 Favored 'General case' 0 CA--C 1.528 0.119 0 CA-C-N 118.939 0.791 . . . . 1.3100000000000001 110.093 -179.468 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 3.6 mp -61.2 -41.47 89.64 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.186 0 N-CA-C 108.34 -0.985 . . . . 0.87 108.34 177.121 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 7.0 t30 -58.93 -37.78 77.48 Favored 'General case' 0 CA--C 1.532 0.255 0 N-CA-C 111.884 0.327 . . . . 2.0800000000000001 111.884 -178.125 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 98' ' ' ASP . . . . . 0.448 ' OD1' ' HE3' ' A' ' 42' ' ' LYS . 0.2 OUTLIER -61.5 -52.76 63.18 Favored 'General case' 0 C--N 1.333 -0.143 0 C-N-CA 125.729 1.611 . . . . 2.73 109.04 175.045 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 21.0 mm100 -77.89 77.64 4.4 Favored 'General case' 0 N--CA 1.454 -0.256 0 C-N-CA 122.91 0.484 . . . . 2.8300000000000001 110.756 -177.553 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 2.0 pt -73.7 76.25 0.36 Allowed 'Isoleucine or valine' 0 CA--C 1.537 0.466 0 CA-C-O 123.324 1.535 . . . . 5.7000000000000002 110.11 172.339 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -138.03 157.61 46.0 Favored 'General case' 0 N--CA 1.448 -0.537 0 N-CA-C 107.251 -1.388 . . . . 8.5199999999999996 107.251 179.833 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 102' ' ' PHE . . . . . . . . . . . . . 28.5 p90 -153.17 171.47 18.43 Favored 'General case' 0 N--CA 1.442 -0.83 0 N-CA-C 105.994 -1.854 . . . . 6.5700000000000003 105.994 -175.879 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -135.05 139.97 46.16 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.5 0 N-CA-C 104.85 -2.278 . . . . 5.1600000000000001 104.85 176.001 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 104' ' ' ILE . . . . . . . . . . . . . 3.0 pt -127.49 150.93 33.74 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.294 0 N-CA-C 108.035 -1.098 . . . . 5.79 108.035 -178.425 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 35.7 t30 71.73 101.87 0.07 Allowed 'General case' 0 CA--C 1.53 0.209 0 C-N-CA 125.454 1.501 . . . . 9.7799999999999994 109.956 -179.753 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 10.8 p . . . . . 0 C--O 1.247 0.957 0 CA-C-O 116.811 -1.566 . . . . 12.66 109.284 -175.005 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.469 0.858 0 N-CA-C 109.927 -1.269 . . . . 13.82 109.927 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 14.7 m -62.54 -82.6 0.02 OUTLIER 'General case' 0 C--O 1.226 -0.133 0 CA-C-N 118.475 1.138 . . . . 16.91 112.679 -177.784 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 29.4 ttpt -156.6 137.34 13.3 Favored 'General case' 0 N--CA 1.45 -0.427 0 N-CA-C 107.522 -1.288 . . . . 21.18 107.522 179.768 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 171.05 -176.75 44.31 Favored Glycine 0 CA--C 1.519 0.322 0 N-CA-C 109.073 -1.611 . . . . 15.119999999999999 109.073 -174.726 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 18.5 m -78.09 -160.97 0.05 OUTLIER 'Isoleucine or valine' 0 N--CA 1.45 -0.453 0 C-N-CA 122.769 0.428 . . . . 15.199999999999999 110.282 -178.405 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -78.25 110.84 13.62 Favored 'General case' 0 N--CA 1.445 -0.685 0 CA-C-O 123.049 1.404 . . . . 11.369999999999999 112.021 170.24 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . 0.543 ' H ' HD22 ' A' ' 7' ' ' LEU . 0.0 OUTLIER -140.78 42.77 1.84 Allowed 'General case' 0 N--CA 1.447 -0.584 0 C-N-CA 125.887 1.675 . . . . 9.4700000000000006 107.698 172.542 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 30.8 mtp85 69.24 36.59 2.31 Favored 'General case' 0 C--O 1.224 -0.282 0 C-N-CA 125.161 1.384 . . . . 7.25 113.088 179.016 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 37.3 m-20 -46.45 -43.55 16.67 Favored 'General case' 0 N--CA 1.468 0.436 0 N-CA-C 113.903 1.075 . . . . 3.0899999999999999 113.903 -177.712 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 31.2 t70 -67.13 -44.33 80.14 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 118.011 0.369 . . . . 2.29 111.398 -178.775 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 4.2 m -64.28 -55.54 20.72 Favored 'General case' 0 CA--C 1.531 0.221 0 O-C-N 121.45 -0.781 . . . . 1.4099999999999999 111.059 178.133 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . 0.434 ' HA ' HD11 ' A' ' 15' ' ' ILE . 5.4 pt-20 -61.56 -37.83 85.27 Favored 'General case' 0 CA--C 1.527 0.088 0 N-CA-C 108.902 -0.777 . . . . 4.25 108.902 -176.61 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -54.73 -58.84 11.66 Favored Glycine 0 C--N 1.337 0.589 0 N-CA-C 109.281 -1.527 . . . . 0.93000000000000005 109.281 173.105 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 8.5 t80 -54.96 -52.88 61.65 Favored 'General case' 0 N--CA 1.452 -0.345 0 C-N-CA 123.837 0.855 . . . . 2.5699999999999998 111.122 -171.934 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . 0.467 HD12 ' CE1' ' A' ' 75' ' ' HIS . 0.5 OUTLIER -67.47 -33.69 63.92 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.314 0 O-C-N 121.538 -0.726 . . . . 0.48999999999999999 112.205 -179.597 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 8.2 t60 -62.21 -55.89 24.06 Favored 'General case' 0 CA--C 1.53 0.183 0 N-CA-C 107.351 -1.351 . . . . 0.55000000000000004 107.351 179.558 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 41.6 mt-10 -55.03 -39.33 69.03 Favored 'General case' 0 N--CA 1.449 -0.493 0 C-N-CA 126.051 1.74 . . . . 2.3199999999999998 110.823 178.222 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 36.4 t80 -56.69 -52.41 65.03 Favored 'General case' 0 C--N 1.333 -0.144 0 CA-C-N 119.222 0.919 . . . . 2.8900000000000001 109.813 175.828 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -48.15 -45.61 27.17 Favored Glycine 0 CA--C 1.526 0.756 0 N-CA-C 111.498 -0.641 . . . . 0.56999999999999995 111.498 172.375 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 20' ' ' HIS . . . . . 0.597 ' CE1' ' HB1' ' A' ' 64' ' ' ALA . 3.0 t60 -61.67 -49.96 74.42 Favored 'General case' 0 N--CA 1.448 -0.56 0 O-C-N 121.631 -0.923 . . . . 1.9099999999999999 111.456 -179.68 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -59.83 -31.7 69.97 Favored 'General case' 0 N--CA 1.449 -0.479 0 C-N-CA 123.825 0.85 . . . . 0.58999999999999997 109.643 -176.592 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 93.3 t -62.88 -51.9 66.19 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.24 0 C-N-CA 120.309 -0.556 . . . . 0.72999999999999998 109.844 177.409 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -65.79 -17.89 64.95 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.361 -0.381 . . . . 3.1499999999999999 111.376 179.072 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 4.5 t70 -75.42 -51.0 14.1 Favored 'General case' 0 N--CA 1.451 -0.404 0 N-CA-C 107.928 -1.138 . . . . 3.4900000000000002 107.928 -174.169 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -53.41 -48.86 68.34 Favored 'General case' 0 N--CA 1.453 -0.293 0 CA-C-N 114.44 -1.254 . . . . 4.0499999999999998 109.369 173.32 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -54.14 -40.86 67.81 Favored 'General case' 0 N--CA 1.453 -0.276 0 C-N-CA 122.836 0.454 . . . . 1.1399999999999999 111.74 178.273 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -58.03 -56.42 25.27 Favored Glycine 0 CA--C 1.522 0.483 0 N-CA-C 110.313 -1.115 . . . . 1.0900000000000001 110.313 179.268 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 1.8 t80 -58.03 -40.88 81.98 Favored 'General case' 0 CA--C 1.532 0.266 0 O-C-N 122.069 -0.665 . . . . 2.8399999999999999 111.386 -174.888 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 1.9 mm? -74.23 -24.93 59.39 Favored 'General case' 0 N--CA 1.447 -0.586 0 N-CA-C 113.956 1.095 . . . . 1.6299999999999999 113.956 -176.919 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 26.5 mt -118.64 -155.38 0.6 Allowed 'General case' 0 CA--C 1.535 0.376 0 N-CA-C 108.379 -0.971 . . . . 3.0699999999999998 108.379 -168.506 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 13.6 t0 -72.16 151.22 43.11 Favored 'General case' 0 C--O 1.231 0.117 0 N-CA-C 107.193 -1.41 . . . . 4.9199999999999999 107.193 161.426 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . 0.536 ' HA ' ' HE2' ' A' ' 32' ' ' LYS . 11.7 mmpt? 93.75 83.2 0.01 OUTLIER 'General case' 0 CA--C 1.521 -0.136 0 C-N-CA 128.331 2.652 . . . . 11.32 108.586 174.328 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 48.4 t30 -137.68 151.3 48.11 Favored 'General case' 0 N--CA 1.452 -0.369 0 N-CA-C 107.453 -1.314 . . . . 9.6400000000000006 107.453 179.856 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER 40.34 37.48 0.44 Allowed 'General case' 0 CA--C 1.537 0.476 0 C-N-CA 127.258 2.223 . . . . 9.5800000000000001 113.746 -177.289 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 4.2 m -163.45 -56.23 0.04 OUTLIER 'General case' 0 C--O 1.226 -0.162 0 N-CA-C 108.301 -1.0 . . . . 6.1200000000000001 108.301 178.366 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 4.2 m-20 -138.56 176.6 8.56 Favored 'General case' 0 N--CA 1.456 -0.174 0 C-N-CA 125.49 1.516 . . . . 7.6900000000000004 107.149 -175.814 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 2.0 mm? -113.61 178.17 4.37 Favored 'General case' 0 CA--C 1.531 0.224 0 C-N-CA 124.862 1.265 . . . . 2.3900000000000001 108.299 173.684 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 9.5 p -57.02 -29.19 30.76 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.541 0 CA-C-O 118.958 -0.544 . . . . 2.2599999999999998 111.968 -174.805 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 8.9 t -70.34 63.43 0.25 Allowed 'General case' 0 CA--C 1.538 0.516 0 C-N-CA 124.555 1.142 . . . . 3.8700000000000001 112.206 172.291 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 23.1 t-20 -158.31 -72.69 0.09 Allowed 'General case' 0 CA--C 1.533 0.317 0 O-C-N 121.079 -1.013 . . . . 6.4500000000000002 108.616 176.552 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 41' ' ' SER . . . . . 0.53 ' O ' ' HE2' ' A' ' 42' ' ' LYS . 48.0 m -75.09 77.46 2.26 Favored 'General case' 0 N--CA 1.462 0.171 0 O-C-N 121.603 -0.686 . . . . 5.1900000000000004 110.115 175.25 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . 0.53 ' HE2' ' O ' ' A' ' 41' ' ' SER . 8.7 mmpt? -132.29 -70.0 0.57 Allowed 'General case' 0 CA--C 1.515 -0.381 0 N-CA-C 109.03 -0.73 . . . . 7.4400000000000004 109.03 -177.97 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 36.7 mttp -140.18 98.95 3.55 Favored 'General case' 0 N--CA 1.447 -0.585 0 N-CA-C 102.99 -2.967 . . . . 6.9100000000000001 102.99 169.022 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 1.9 t80 -2.61 70.14 0.0 OUTLIER 'General case' 0 CA--C 1.537 0.48 0 C-N-CA 130.259 3.424 . . . . 6.4699999999999998 113.614 -177.32 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 22.4 pt 28.62 73.24 0.02 OUTLIER 'Isoleucine or valine' 0 CA--C 1.541 0.603 0 C-N-CA 125.42 1.488 . . . . 2.4399999999999999 113.514 -167.258 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 6.8 m-20 -97.13 -64.65 1.02 Allowed 'General case' 0 N--CA 1.464 0.267 0 N-CA-C 108.374 -0.973 . . . . 3.25 108.374 177.585 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 11.9 mm -48.18 -52.97 6.64 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.243 0 C-N-CA 125.298 1.439 . . . . 0.45000000000000001 109.292 -177.743 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 33.1 t80 -64.42 -33.98 77.14 Favored 'General case' 0 N--CA 1.449 -0.487 0 N-CA-C 112.821 0.674 . . . . 0.45000000000000001 112.821 179.407 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . 0.554 ' HA ' ' HE2' ' A' ' 49' ' ' LYS . 9.4 mmpt? -67.85 -46.28 72.19 Favored 'General case' 0 C--N 1.331 -0.228 0 O-C-N 119.938 -1.726 . . . . 1.29 110.669 -177.994 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 11.8 mm-40 -82.27 -65.97 0.95 Allowed 'General case' 0 N--CA 1.452 -0.359 0 N-CA-C 108.429 -0.952 . . . . 3.9300000000000002 108.429 -175.887 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 3.7 mm-40 -68.44 -35.37 77.51 Favored 'General case' 0 N--CA 1.451 -0.405 0 C-N-CA 123.935 0.894 . . . . 2.9500000000000002 109.432 -169.567 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -67.29 38.23 0.21 Allowed Glycine 0 CA--C 1.532 1.136 0 C-N-CA 126.286 1.898 . . . . 0.44 114.035 170.231 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 60.6 p -146.62 22.43 1.29 Allowed 'General case' 0 N--CA 1.449 -0.503 0 O-C-N 120.342 -1.681 . . . . 2.1699999999999999 112.07 159.747 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -127.29 -46.17 1.5 Allowed 'General case' 0 CA--C 1.518 -0.267 0 CA-C-O 118.936 -0.554 . . . . 2.8900000000000001 111.62 -176.558 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 29.2 mt -57.13 -35.97 70.11 Favored 'General case' 0 N--CA 1.467 0.395 0 CA-C-N 118.802 0.728 . . . . 0.45000000000000001 110.896 -169.187 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER 179.53 175.72 0.7 Allowed 'General case' 0 C--O 1.233 0.221 0 C-N-CA 125.508 1.523 . . . . 0.51000000000000001 107.203 175.233 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 7.9 m -55.86 -32.66 63.84 Favored 'General case' 0 N--CA 1.452 -0.326 0 O-C-N 121.597 -0.689 . . . . 0.93000000000000005 110.582 165.15 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -63.28 -26.77 68.93 Favored 'General case' 0 C--N 1.342 0.271 0 CA-C-O 121.142 0.496 . . . . 1.22 111.828 175.304 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -75.32 -8.83 84.09 Favored Glycine 0 N--CA 1.442 -0.958 0 CA-C-O 118.24 -1.311 . . . . 0.51000000000000001 111.465 176.704 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 10.9 ttt-85 -113.06 -17.21 12.48 Favored 'General case' 0 CA--C 1.522 -0.097 0 CA-C-N 119.564 1.682 . . . . 2.7000000000000002 112.579 -177.493 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -61.27 -168.14 0.01 OUTLIER 'General case' 0 CA--C 1.534 0.358 0 C-N-CA 123.537 0.735 . . . . 1.1200000000000001 110.115 163.503 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -47.51 148.78 1.3 Allowed 'General case' 0 N--CA 1.464 0.244 0 O-C-N 121.561 -0.712 . . . . 2.0499999999999998 111.665 -174.311 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 5.0 mt-10 -55.56 -30.26 60.46 Favored 'General case' 0 CA--C 1.534 0.361 0 CA-C-O 121.285 0.564 . . . . 4.6799999999999997 110.759 -179.862 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 64' ' ' ALA . . . . . 0.597 ' HB1' ' CE1' ' A' ' 20' ' ' HIS . . . -66.18 -35.08 79.53 Favored 'General case' 0 N--CA 1.453 -0.281 0 C-N-CA 124.044 0.938 . . . . 0.63 113.056 176.484 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 6.4 mt-10 -76.27 -41.37 49.14 Favored 'General case' 0 CA--C 1.516 -0.331 0 O-C-N 121.48 -0.763 . . . . 1.8899999999999999 110.626 176.943 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 50.4 t80 -50.41 -51.85 42.71 Favored 'General case' 0 N--CA 1.451 -0.395 0 C-N-CA 124.441 1.097 . . . . 0.5 110.68 170.024 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 58.0 t80 -65.79 -46.63 77.98 Favored 'General case' 0 CA--C 1.537 0.457 0 O-C-N 121.34 -0.85 . . . . 0.59999999999999998 110.824 -179.472 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -61.27 -48.97 78.96 Favored 'General case' 0 CA--C 1.535 0.392 0 O-C-N 121.195 -0.94 . . . . 0.34999999999999998 112.045 -175.345 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -61.96 -37.54 85.14 Favored 'General case' 0 N--CA 1.454 -0.245 0 O-C-N 121.346 -0.846 . . . . 3.5800000000000001 110.58 173.487 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -55.26 -42.79 73.97 Favored 'General case' 0 C--O 1.22 -0.472 0 CA-C-N 119.009 0.822 . . . . 0.40000000000000002 109.979 175.329 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -55.8 -51.11 68.57 Favored 'General case' 0 N--CA 1.466 0.339 0 CA-C-N 119.263 0.938 . . . . 3.5600000000000001 112.147 172.464 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 23.3 ttt180 -50.88 -57.14 9.23 Favored 'General case' 0 CA--C 1.535 0.374 0 N-CA-C 109.409 -0.589 . . . . 2.2599999999999998 109.409 179.007 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . 0.462 ' HB3' HG21 ' A' ' 85' ' ' VAL . 0.1 OUTLIER -66.37 -28.42 68.64 Favored 'General case' 0 C--N 1.326 -0.423 0 C-N-CA 125.128 1.371 . . . . 0.46000000000000002 111.686 -177.197 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 2.1 ttp -64.66 -36.45 84.32 Favored 'General case' 0 N--CA 1.452 -0.372 0 O-C-N 121.98 -0.45 . . . . 2.98 109.971 -178.832 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 75' ' ' HIS . . . . . 0.467 ' CE1' HD12 ' A' ' 15' ' ' ILE . 26.2 p80 -88.04 -39.85 14.31 Favored 'General case' 0 N--CA 1.452 -0.369 0 CA-C-O 115.827 -2.035 . . . . 1.1299999999999999 110.591 -178.977 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 21.9 m -5.51 113.37 0.01 OUTLIER 'General case' 0 C--N 1.346 0.443 0 C-N-CA 128.254 2.621 . . . . 1.03 114.361 -171.403 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 3.0 p -47.07 -44.61 21.09 Favored 'General case' 0 N--CA 1.451 -0.401 0 C-N-CA 124.975 1.31 . . . . 1.1599999999999999 110.27 179.692 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 9.9 t0 -65.86 106.58 1.58 Allowed 'General case' 0 N--CA 1.449 -0.482 0 CA-C-O 121.827 0.822 . . . . 1.9099999999999999 109.141 166.105 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 54.8 m170 -57.11 -33.04 66.93 Favored 'General case' 0 N--CA 1.454 -0.27 0 CA-C-O 118.974 -0.536 . . . . 5.3099999999999996 111.04 177.667 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -59.65 -46.74 88.1 Favored 'General case' 0 N--CA 1.45 -0.451 0 CA-C-N 118.713 0.688 . . . . 0.78000000000000003 110.397 -179.743 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 5.7 mt-10 -48.71 -41.64 32.47 Favored 'General case' 0 C--O 1.232 0.148 0 C-N-CA 123.901 0.88 . . . . 2.6800000000000002 111.008 176.952 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -64.37 -47.52 78.97 Favored 'General case' 0 C--N 1.329 -0.31 0 N-CA-C 108.518 -0.919 . . . . 3.0600000000000001 108.518 179.123 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 1.3 mm? -64.99 -18.9 65.69 Favored 'General case' 0 N--CA 1.453 -0.285 0 CA-C-O 117.119 -1.419 . . . . 0.48999999999999999 113.087 175.573 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -63.69 -49.83 71.61 Favored 'General case' 0 CA--C 1.519 -0.24 0 CA-C-N 122.077 2.217 . . . . 1.6000000000000001 107.034 167.516 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 85' ' ' VAL . . . . . 0.462 HG21 ' HB3' ' A' ' 73' ' ' LEU . 58.9 t -55.07 -41.33 58.75 Favored 'Isoleucine or valine' 0 C--O 1.214 -0.776 0 CA-C-O 118.486 -0.768 . . . . 0.44 110.846 175.747 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 2.2 tm0? -77.94 -47.61 18.2 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 120.434 1.47 . . . . 3.04 111.844 -171.027 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 20.8 ttmt -54.58 -49.29 70.75 Favored 'General case' 0 C--O 1.226 -0.137 0 O-C-N 121.6 -0.688 . . . . 2.3100000000000001 109.905 175.721 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 17.2 m120 -72.73 -41.3 65.32 Favored 'General case' 0 C--O 1.225 -0.213 0 CA-C-O 119.703 -0.189 . . . . 2.25 111.159 -177.728 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -129.56 75.62 79.64 Favored Pre-proline 0 C--O 1.238 0.478 0 C-N-CA 125.832 1.653 . . . . 0.35999999999999999 110.236 -173.509 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 27.2 Cg_endo -59.58 -33.28 96.92 Favored 'Trans proline' 0 N--CA 1.446 -1.284 0 C-N-CA 121.341 1.361 . . . . 2.02 110.288 -177.244 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 9.1 tttp -80.44 -51.6 8.63 Favored 'General case' 0 N--CA 1.45 -0.47 0 C-N-CA 125.177 1.391 . . . . 5.1500000000000004 111.13 -173.524 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 5.7 m -54.19 -42.77 70.09 Favored 'General case' 0 N--CA 1.469 0.523 0 CA-C-N 119.378 0.99 . . . . 0.51000000000000001 110.801 -179.53 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 21.0 t80 -57.52 -47.14 82.78 Favored 'General case' 0 CA--C 1.509 -0.626 0 CA-C-O 121.19 0.519 . . . . 2.1600000000000001 111.644 179.32 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 21.0 tt0 -56.03 -36.18 67.71 Favored 'General case' 0 N--CA 1.443 -0.798 0 CA-C-N 115.02 -0.991 . . . . 1.75 109.929 178.993 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 9.1 t80 -66.45 -53.59 33.74 Favored 'General case' 0 N--CA 1.455 -0.187 0 C-N-CA 124.158 0.983 . . . . 1.01 110.275 -176.175 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 44.3 mm -59.4 -42.19 86.79 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.209 0 O-C-N 121.828 -0.545 . . . . 1.46 109.78 179.083 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 9.2 m-20 -58.36 -36.19 73.09 Favored 'General case' 0 CA--C 1.528 0.127 0 O-C-N 122.128 -0.357 . . . . 2.3500000000000001 111.306 177.96 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 1.6 t0 -57.91 -54.75 43.34 Favored 'General case' 0 CA--C 1.53 0.188 0 CA-C-O 121.963 0.887 . . . . 2.0099999999999998 109.327 177.466 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 25.6 mm100 -86.37 93.52 9.13 Favored 'General case' 0 N--CA 1.452 -0.325 0 O-C-N 121.601 -0.687 . . . . 2.5800000000000001 110.393 -175.96 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 4.7 pt -53.51 151.37 1.3 Allowed 'Isoleucine or valine' 0 CA--C 1.534 0.353 0 CA-C-O 122.467 1.127 . . . . 4.9100000000000001 112.938 -178.191 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 20.5 pttp -87.99 103.63 15.88 Favored 'General case' 0 N--CA 1.453 -0.279 0 O-C-N 121.661 -0.649 . . . . 11.18 110.286 -179.822 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 102' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -152.47 117.1 5.04 Favored 'General case' 0 N--CA 1.454 -0.23 0 N-CA-C 106.947 -1.501 . . . . 6.9299999999999997 106.947 168.153 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 2.9 tp -152.31 150.51 12.86 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.516 0 N-CA-C 107.386 -1.339 . . . . 3.8599999999999999 107.386 176.356 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 104' ' ' ILE . . . . . . . . . . . . . 2.4 pp -70.91 164.39 3.25 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.203 0 N-CA-C 109.87 -0.419 . . . . 7.8399999999999999 109.87 178.848 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -131.79 164.7 25.45 Favored 'General case' 0 C--N 1.332 -0.153 0 N-CA-C 108.305 -0.998 . . . . 9.1500000000000004 108.305 179.972 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 11.1 t . . . . . 0 C--O 1.251 1.183 0 CA-C-O 115.05 -2.405 . . . . 13.630000000000001 110.87 -171.461 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.471 0.971 0 CA-C-O 119.867 -0.407 . . . . 15.6 112.308 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 63.7 m -148.85 -66.76 0.23 Allowed 'General case' 0 CA--C 1.522 -0.12 0 CA-C-N 118.983 1.391 . . . . 17.640000000000001 108.007 172.452 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -170.51 -90.42 0.01 OUTLIER 'General case' 0 N--CA 1.452 -0.358 0 N-CA-C 106.675 -1.602 . . . . 17.190000000000001 106.675 171.84 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 81.28 -176.43 54.45 Favored Glycine 0 CA--C 1.521 0.42 0 N-CA-C 109.318 -1.513 . . . . 16.359999999999999 109.318 -167.444 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . 0.504 HG23 HD11 ' A' ' 7' ' ' LEU . 0.2 OUTLIER -75.38 -172.84 0.13 Allowed 'Isoleucine or valine' 0 CA--C 1.533 0.314 0 C-N-CA 123.385 0.674 . . . . 17.579999999999998 111.026 178.304 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -94.48 111.64 23.39 Favored 'General case' 0 N--CA 1.445 -0.678 0 CA-C-O 123.342 1.544 . . . . 12.970000000000001 111.968 179.962 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . 0.504 HD11 HG23 ' A' ' 5' ' ' VAL . 0.0 OUTLIER -147.87 62.13 1.13 Allowed 'General case' 0 N--CA 1.441 -0.902 0 C-N-CA 126.081 1.752 . . . . 11.16 106.395 171.07 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER 57.78 46.68 16.69 Favored 'General case' 0 C--O 1.226 -0.145 0 CA-C-N 114.963 -1.017 . . . . 6.7300000000000004 111.183 179.559 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -51.09 -34.34 29.98 Favored 'General case' 0 C--O 1.217 -0.613 0 C-N-CA 123.235 0.614 . . . . 5.2000000000000002 111.9 179.441 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 2.1 t70 -59.78 -55.88 28.72 Favored 'General case' 0 N--CA 1.447 -0.577 0 C-N-CA 124.062 0.945 . . . . 2.54 111.869 174.307 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 9.2 t -72.09 -48.16 46.02 Favored 'General case' 0 C--N 1.33 -0.245 0 O-C-N 121.849 -0.532 . . . . 1.7 109.843 -170.434 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -69.05 -31.18 69.77 Favored 'General case' 0 C--O 1.221 -0.426 0 N-CA-C 107.306 -1.368 . . . . 5.7199999999999998 107.306 178.176 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -60.78 -50.55 66.32 Favored Glycine 0 C--O 1.22 -0.725 0 N-CA-C 110.473 -1.051 . . . . 1.1499999999999999 110.473 178.961 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -51.86 -57.86 8.15 Favored 'General case' 0 C--N 1.333 -0.118 0 CA-C-N 118.565 1.183 . . . . 3.0699999999999998 110.884 -177.683 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . 0.424 HD12 ' CE1' ' A' ' 75' ' ' HIS . 0.4 OUTLIER -67.09 -33.46 63.35 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.434 0 O-C-N 121.99 -0.443 . . . . 0.51000000000000001 111.314 -176.733 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 3.7 t-160 -62.63 -52.95 61.35 Favored 'General case' 0 N--CA 1.45 -0.472 0 N-CA-C 107.584 -1.265 . . . . 0.95999999999999996 107.584 -178.765 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 20.2 mt-10 -60.51 -34.51 74.19 Favored 'General case' 0 N--CA 1.45 -0.456 0 C-N-CA 124.244 1.018 . . . . 2.8300000000000001 110.566 179.132 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -52.3 -54.03 36.61 Favored 'General case' 0 CA--C 1.517 -0.29 0 CA-C-N 119.288 0.949 . . . . 2.4100000000000001 110.512 171.429 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -47.63 -50.29 19.63 Favored Glycine 0 C--N 1.336 0.535 0 N-CA-C 110.277 -1.129 . . . . 0.72999999999999998 110.277 172.459 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 20' ' ' HIS . . . . . 0.544 ' CE1' ' HB1' ' A' ' 64' ' ' ALA . 1.8 t-160 -62.26 -35.96 80.57 Favored 'General case' 0 N--CA 1.452 -0.341 0 O-C-N 121.918 -0.754 . . . . 2.02 112.676 -177.555 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -65.68 -32.2 73.64 Favored 'General case' 0 N--CA 1.45 -0.475 0 CA-C-N 119.068 0.849 . . . . 1.3400000000000001 109.194 178.291 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 17.6 t -66.08 -38.64 82.46 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.239 0 C-N-CA 118.14 -1.424 . . . . 1.49 111.417 173.975 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 11.7 t70 -57.15 -32.62 66.58 Favored 'General case' 0 N--CA 1.464 0.267 0 CA-C-O 121.863 0.84 . . . . 2.54 110.647 173.689 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 36.8 t0 -70.78 -50.21 38.3 Favored 'General case' 0 N--CA 1.448 -0.556 0 N-CA-C 107.93 -1.137 . . . . 2.1299999999999999 107.93 -172.634 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 25' ' ' TYR . . . . . 0.488 ' CD2' HD11 ' A' ' 103' ' ' ILE . 71.1 t80 -56.89 -50.81 71.39 Favored 'General case' 0 CA--C 1.52 -0.207 0 O-C-N 122.184 -0.322 . . . . 4.1900000000000004 110.576 178.23 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -55.26 -39.38 69.73 Favored 'General case' 0 N--CA 1.449 -0.479 0 C-N-CA 120.645 -0.422 . . . . 1.29 110.874 -178.045 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -68.85 -50.63 34.23 Favored Glycine 0 C--N 1.334 0.468 0 N-CA-C 110.93 -0.868 . . . . 1.1399999999999999 110.93 179.597 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -47.34 -46.51 25.61 Favored 'General case' 0 N--CA 1.454 -0.232 0 C-N-CA 124.933 1.293 . . . . 2.7400000000000002 110.738 -178.607 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -75.58 -38.84 58.86 Favored 'General case' 0 N--CA 1.447 -0.588 0 C-N-CA 124.653 1.181 . . . . 1.74 112.567 178.648 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 13.8 mt -110.0 57.62 0.61 Allowed 'General case' 0 N--CA 1.448 -0.542 0 N-CA-C 106.783 -1.562 . . . . 2.6600000000000001 106.783 -172.43 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -61.22 152.68 28.22 Favored 'General case' 0 C--O 1.235 0.327 0 CA-C-O 121.856 0.836 . . . . 6.8200000000000003 110.893 -165.328 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -141.47 76.46 1.55 Allowed 'General case' 0 N--CA 1.446 -0.638 0 C-N-CA 119.896 -0.722 . . . . 7.3700000000000001 109.356 172.289 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 40.8 t30 36.35 77.14 0.04 OUTLIER 'General case' 0 N--CA 1.464 0.234 0 C-N-CA 125.928 1.691 . . . . 7.6100000000000003 112.646 171.191 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 3.7 tm0? 95.12 -19.21 0.07 Allowed 'General case' 0 N--CA 1.467 0.384 0 C-N-CA 127.511 2.324 . . . . 8.6699999999999999 111.183 179.2 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 40.4 m -71.24 98.4 1.72 Allowed 'General case' 0 N--CA 1.456 -0.166 0 O-C-N 121.523 -0.735 . . . . 5.0 109.887 173.974 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 27.3 m-20 -66.46 -38.47 87.42 Favored 'General case' 0 N--CA 1.464 0.238 0 C-N-CA 123.902 0.881 . . . . 7.3700000000000001 111.116 174.87 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 3.0 mp -111.53 159.52 18.04 Favored 'General case' 0 C--N 1.339 0.114 0 C-N-CA 124.056 0.942 . . . . 2.6099999999999999 108.643 -174.549 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 8.0 p -77.33 17.74 0.15 Allowed 'Isoleucine or valine' 0 N--CA 1.468 0.47 0 CA-C-N 118.651 0.66 . . . . 2.6099999999999999 112.254 -179.44 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 9.5 t -66.53 162.57 20.51 Favored 'General case' 0 N--CA 1.444 -0.75 0 O-C-N 121.171 -0.955 . . . . 4.8600000000000003 109.996 174.281 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 41.8 t-20 63.2 -79.46 0.03 OUTLIER 'General case' 0 CA--C 1.533 0.324 0 C-N-CA 125.837 1.655 . . . . 7.79 111.628 175.245 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 69.2 m -72.27 81.94 1.02 Allowed 'General case' 0 N--CA 1.452 -0.343 0 C-N-CA 123.504 0.722 . . . . 7.3499999999999996 111.187 177.054 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 7.8 tmtt? -134.66 -66.44 0.6 Allowed 'General case' 0 C--O 1.226 -0.169 0 N-CA-C 108.671 -0.862 . . . . 6.0999999999999996 108.671 166.935 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . 0.449 ' HE2' ' O ' ' A' ' 43' ' ' LYS . 0.2 OUTLIER -152.74 61.84 0.8 Allowed 'General case' 0 C--O 1.223 -0.293 0 N-CA-C 108.608 -0.886 . . . . 6.5599999999999996 108.608 179.841 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 34.3 m-85 41.42 41.86 1.69 Allowed 'General case' 0 N--CA 1.468 0.464 0 C-N-CA 124.08 0.952 . . . . 5.8899999999999997 111.951 -172.407 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER 37.12 42.89 0.23 Allowed 'Isoleucine or valine' 0 CA--C 1.546 0.793 0 C-N-CA 125.067 1.347 . . . . 4.2300000000000004 112.709 -177.99 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 5.0 t70 -57.56 -46.65 83.69 Favored 'General case' 0 N--CA 1.464 0.271 0 C-N-CA 127.653 2.381 . . . . 2.3100000000000001 111.445 -176.248 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 6.1 mm -58.6 -54.42 33.57 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.402 0 CA-C-N 115.046 -0.979 . . . . 0.93000000000000005 108.547 179.14 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 28.8 t80 -60.9 -28.95 69.28 Favored 'General case' 0 C--O 1.226 -0.182 0 C-N-CA 124.967 1.307 . . . . 0.51000000000000001 111.86 176.758 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . 0.421 ' CA ' ' HE2' ' A' ' 49' ' ' LYS . 0.1 OUTLIER -66.48 -46.86 74.88 Favored 'General case' 0 N--CA 1.453 -0.324 0 O-C-N 120.854 -1.154 . . . . 1.1599999999999999 110.191 -172.643 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 6.4 tp10 -84.0 -57.72 3.08 Favored 'General case' 0 N--CA 1.451 -0.412 0 CA-C-O 121.903 0.859 . . . . 2.3100000000000001 108.984 -179.712 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 20.6 mm-40 -82.62 -20.83 35.62 Favored 'General case' 0 C--O 1.234 0.279 0 O-C-N 121.631 -0.668 . . . . 2.6499999999999999 111.385 -165.132 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -73.13 41.97 0.93 Allowed Glycine 0 CA--C 1.529 0.953 0 C-N-CA 124.729 1.157 . . . . 0.41999999999999998 113.365 172.116 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 27.9 m -152.69 33.93 0.49 Allowed 'General case' 0 N--CA 1.453 -0.318 0 C-N-CA 126.57 1.948 . . . . 1.8300000000000001 107.789 160.508 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 9.7 t-20 -144.73 -38.72 0.27 Allowed 'General case' 0 C--N 1.341 0.213 0 N-CA-C 113.242 0.83 . . . . 2.3599999999999999 113.242 -161.928 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 16.2 mt -72.01 -38.59 69.58 Favored 'General case' 0 C--N 1.33 -0.257 0 O-C-N 122.236 -0.29 . . . . 0.68000000000000005 110.947 179.167 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 4.4 t 171.03 172.72 0.07 Allowed 'General case' 0 N--CA 1.467 0.377 0 C-N-CA 125.579 1.551 . . . . 0.91000000000000003 108.709 -171.412 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 7.6 m -61.56 -36.49 80.78 Favored 'General case' 0 N--CA 1.455 -0.224 0 C-N-CA 124.228 1.011 . . . . 1.3400000000000001 111.037 172.587 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -65.86 -17.8 64.9 Favored 'General case' 0 CA--C 1.535 0.377 0 CA-C-N 118.107 0.412 . . . . 1.1299999999999999 111.456 173.818 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -78.8 -12.81 83.79 Favored Glycine 0 N--CA 1.443 -0.85 0 CA-C-O 118.938 -0.923 . . . . 0.44 111.31 174.512 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 4.2 tmt_? -110.08 -15.6 13.99 Favored 'General case' 0 CA--C 1.523 -0.092 0 CA-C-N 119.149 1.475 . . . . 2.6600000000000001 112.661 -176.946 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 1.3 p -61.8 -168.38 0.01 OUTLIER 'General case' 0 CA--C 1.537 0.447 0 C-N-CA 123.397 0.679 . . . . 1.1100000000000001 109.798 162.332 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 9.7 m-20 -48.17 145.75 3.03 Favored 'General case' 0 N--CA 1.463 0.222 0 O-C-N 121.359 -0.838 . . . . 2.1899999999999999 110.882 -177.95 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -50.51 -31.99 16.99 Favored 'General case' 0 CA--C 1.534 0.349 0 C-N-CA 123.99 0.916 . . . . 5.5599999999999996 111.884 175.177 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 64' ' ' ALA . . . . . 0.544 ' HB1' ' CE1' ' A' ' 20' ' ' HIS . . . -61.11 -42.06 97.83 Favored 'General case' 0 N--CA 1.451 -0.418 0 C-N-CA 124.263 1.025 . . . . 0.52000000000000002 110.438 178.311 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 7.9 mt-10 -69.82 -45.26 68.24 Favored 'General case' 0 N--CA 1.448 -0.528 0 CA-C-O 117.921 -1.038 . . . . 1.8899999999999999 110.477 177.073 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 35.7 t80 -51.45 -45.01 62.53 Favored 'General case' 0 CA--C 1.533 0.315 0 C-N-CA 126.041 1.737 . . . . 0.35999999999999999 112.005 175.303 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 90.4 t80 -69.23 -45.81 68.87 Favored 'General case' 0 C--N 1.328 -0.349 0 O-C-N 120.859 -1.151 . . . . 0.46000000000000002 109.847 178.267 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -65.02 -39.4 93.36 Favored 'General case' 0 CA--C 1.542 0.65 0 O-C-N 121.495 -0.753 . . . . 0.35999999999999999 112.058 -174.806 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -72.15 -33.78 68.01 Favored 'General case' 0 C--N 1.333 -0.135 0 O-C-N 121.092 -1.005 . . . . 3.7999999999999998 110.266 175.233 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -54.01 -42.42 69.06 Favored 'General case' 0 C--O 1.223 -0.313 0 CA-C-N 119.114 0.87 . . . . 0.38 110.419 171.706 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 47.4 t80 -56.65 -49.94 73.55 Favored 'General case' 0 N--CA 1.466 0.357 0 CA-C-N 119.954 1.252 . . . . 4.1500000000000004 111.315 171.667 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -49.45 -58.77 4.55 Favored 'General case' 0 C--N 1.34 0.157 0 CA-C-N 118.649 0.659 . . . . 3.73 109.791 -179.98 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . 0.574 ' CB ' HG21 ' A' ' 85' ' ' VAL . 0.1 OUTLIER -63.78 -27.89 69.5 Favored 'General case' 0 N--CA 1.45 -0.454 0 C-N-CA 124.888 1.275 . . . . 0.54000000000000004 110.997 -175.429 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 1.5 tmt? -68.64 -36.03 78.06 Favored 'General case' 0 N--CA 1.448 -0.558 0 C-N-CA 122.695 0.398 . . . . 2.6200000000000001 111.725 -178.988 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 75' ' ' HIS . . . . . 0.424 ' CE1' HD12 ' A' ' 15' ' ' ILE . 10.8 p80 -93.94 -10.6 33.23 Favored 'General case' 0 C--O 1.231 0.08 0 CA-C-O 117.384 -1.293 . . . . 1.2 113.169 -179.535 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 60.1 m -39.01 126.9 1.63 Allowed 'General case' 0 N--CA 1.449 -0.505 0 CA-C-O 123.028 1.394 . . . . 1.01 112.554 -169.488 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 4.1 p -53.53 -44.48 69.22 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 113.254 -1.793 . . . . 1.3300000000000001 108.588 176.404 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 12.3 t0 -65.8 107.23 1.74 Allowed 'General case' 0 N--CA 1.447 -0.612 0 N-CA-C 108.717 -0.846 . . . . 2.3700000000000001 108.717 167.151 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -55.9 -33.19 64.42 Favored 'General case' 0 N--CA 1.454 -0.267 0 CA-C-N 116.028 -0.533 . . . . 5.1900000000000004 110.626 176.304 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -61.06 -49.51 77.06 Favored 'General case' 0 N--CA 1.447 -0.615 0 CA-C-O 118.205 -0.902 . . . . 0.83999999999999997 110.323 -179.831 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 1.2 mt-10 -46.58 -42.56 16.2 Favored 'General case' 0 C--N 1.34 0.185 0 CA-C-N 119.263 0.938 . . . . 2.7400000000000002 110.061 179.371 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 2.2 mtp180 -64.87 -54.0 37.89 Favored 'General case' 0 CA--C 1.517 -0.314 0 CA-C-N 115.714 -0.675 . . . . 2.9900000000000002 109.556 -179.268 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 1.4 mm? -65.68 -17.33 64.52 Favored 'General case' 0 N--CA 1.452 -0.344 0 CA-C-O 117.774 -1.108 . . . . 0.5 112.774 179.89 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 2.5 mptm? -67.54 -48.12 67.9 Favored 'General case' 0 CA--C 1.517 -0.297 0 CA-C-N 121.175 1.807 . . . . 1.5600000000000001 107.407 168.49 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 85' ' ' VAL . . . . . 0.574 HG21 ' CB ' ' A' ' 73' ' ' LEU . 93.0 t -57.37 -45.62 85.38 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.692 0 C-N-CA 120.452 -0.499 . . . . 0.51000000000000001 110.689 175.942 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -71.18 -48.76 49.78 Favored 'General case' 0 N--CA 1.45 -0.447 0 CA-C-N 119.667 1.122 . . . . 1.77 110.857 -172.487 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 51.2 tttt -55.41 -51.81 65.63 Favored 'General case' 0 N--CA 1.451 -0.384 0 C-N-CA 124.34 1.056 . . . . 2.6000000000000001 110.506 177.92 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 12.2 m-20 -64.64 -40.42 95.42 Favored 'General case' 0 N--CA 1.454 -0.262 0 C-N-CA 123.174 0.59 . . . . 1.54 109.967 -179.813 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -137.83 74.21 45.23 Favored Pre-proline 0 C--O 1.238 0.498 0 C-N-CA 125.961 1.705 . . . . 0.46999999999999997 111.173 -165.136 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 40.5 Cg_endo -64.24 -16.79 56.95 Favored 'Trans proline' 0 N--CA 1.453 -0.908 0 C-N-CA 122.315 2.01 . . . . 1.98 111.934 -175.547 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 22.5 pttt -95.48 -40.28 9.55 Favored 'General case' 0 CA--C 1.531 0.231 0 C-N-CA 123.203 0.601 . . . . 3.4199999999999999 112.352 -179.125 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 3.3 m -62.46 -45.3 93.69 Favored 'General case' 0 CA--C 1.521 -0.135 0 O-C-N 120.739 -1.225 . . . . 0.35999999999999999 110.628 -179.522 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 10.3 t80 -61.22 -45.37 94.86 Favored 'General case' 0 CA--C 1.508 -0.659 0 C-N-CA 119.965 -0.694 . . . . 1.8500000000000001 110.946 -179.906 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 36.7 tt0 -53.88 -37.56 63.84 Favored 'General case' 0 N--CA 1.44 -0.938 0 CA-C-N 114.995 -1.002 . . . . 1.8899999999999999 110.097 177.212 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 4.9 t80 -60.69 -56.99 14.67 Favored 'General case' 0 N--CA 1.453 -0.276 0 N-CA-C 109.135 -0.691 . . . . 1.25 109.135 -177.74 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 33.9 mm -53.4 -44.07 53.88 Favored 'Isoleucine or valine' 0 C--O 1.227 -0.118 0 O-C-N 121.992 -0.443 . . . . 1.52 110.201 178.05 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 14.7 t30 -62.36 -30.81 71.45 Favored 'General case' 0 CA--C 1.531 0.225 0 C-N-CA 122.886 0.474 . . . . 1.48 111.999 -178.075 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 26.9 t70 -69.8 -43.31 72.36 Favored 'General case' 0 C--O 1.231 0.095 0 C-N-CA 123.124 0.57 . . . . 2.6400000000000001 110.273 174.989 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 92.7 mm-40 -70.16 -56.03 7.88 Favored 'General case' 0 N--CA 1.45 -0.427 0 CA-C-N 115.862 -0.608 . . . . 2.96 110.886 -172.235 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 1.5 pp -70.35 108.67 2.45 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.268 0 CA-C-O 121.489 0.662 . . . . 6.0700000000000003 109.232 -174.379 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 38.9 ttmt -145.83 -70.54 0.26 Allowed 'General case' 0 C--O 1.224 -0.238 0 N-CA-C 108.623 -0.881 . . . . 9.5600000000000005 108.623 -177.663 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 102' ' ' PHE . . . . . . . . . . . . . 3.8 m-85 -142.5 107.68 4.98 Favored 'General case' 0 N--CA 1.451 -0.423 0 N-CA-C 106.053 -1.832 . . . . 6.9900000000000002 106.053 173.16 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 103' ' ' ILE . . . . . 0.488 HD11 ' CD2' ' A' ' 25' ' ' TYR . 7.0 tp -149.61 149.07 15.02 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.717 0 N-CA-C 108.494 -0.928 . . . . 4.7999999999999998 108.494 173.566 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 104' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -152.32 138.15 11.6 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.343 0 N-CA-C 105.516 -2.031 . . . . 5.4800000000000004 105.516 175.828 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 64.9 t30 -151.06 160.5 43.87 Favored 'General case' 0 C--O 1.234 0.237 0 N-CA-C 107.959 -1.126 . . . . 11.220000000000001 107.959 172.607 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 71.5 m . . . . . 0 C--O 1.247 0.939 0 CA-C-O 116.617 -1.659 . . . . 11.859999999999999 108.606 176.199 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.531 1.093 0 CA-C-O 115.658 -2.745 . . . . 12.4 115.549 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 37.0 m 23.54 91.86 0.01 OUTLIER 'General case' 0 N--CA 1.47 0.527 0 C-N-CA 128.332 2.653 . . . . 12.92 115.55 -176.815 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 14.3 ptpt -151.07 53.26 0.86 Allowed 'General case' 0 C--O 1.226 -0.162 0 C-N-CA 122.548 0.339 . . . . 17.039999999999999 111.104 -177.45 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 170.06 -169.0 41.88 Favored Glycine 0 C--N 1.333 0.405 0 N-CA-C 110.627 -0.989 . . . . 11.98 110.627 177.872 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 33.3 m -82.84 -159.83 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.447 -0.581 0 N-CA-C 108.916 -0.772 . . . . 12.59 108.916 171.292 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 9.8 pt-20 -76.36 119.39 20.17 Favored 'General case' 0 N--CA 1.451 -0.392 0 CA-C-O 122.017 0.913 . . . . 9.6799999999999997 110.869 171.048 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -157.26 42.52 0.33 Allowed 'General case' 0 N--CA 1.449 -0.518 0 C-N-CA 124.252 1.021 . . . . 8.3300000000000001 110.288 178.628 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 14.0 mmm-85 78.95 -63.43 0.28 Allowed 'General case' 0 N--CA 1.472 0.63 0 C-N-CA 125.49 1.516 . . . . 7.9000000000000004 109.934 176.675 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 2.8 m120 -50.33 -29.65 10.35 Favored 'General case' 0 CA--C 1.514 -0.421 0 C-N-CA 124.925 1.29 . . . . 3.1099999999999999 113.129 175.52 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 1.2 t70 -63.97 -53.45 49.89 Favored 'General case' 0 C--N 1.322 -0.61 0 C-N-CA 122.767 0.427 . . . . 2.5899999999999999 110.653 172.893 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 8.2 m -60.52 -52.91 63.19 Favored 'General case' 0 N--CA 1.453 -0.311 0 CA-C-N 118.615 0.643 . . . . 2.1699999999999999 110.799 -176.853 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . 0.48 ' HA ' HD11 ' A' ' 15' ' ' ILE . 6.7 pt-20 -71.64 -25.15 62.02 Favored 'General case' 0 CA--C 1.531 0.224 0 O-C-N 121.766 -0.584 . . . . 3.4100000000000001 110.967 179.313 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -60.31 -46.3 94.54 Favored Glycine 0 CA--C 1.523 0.556 0 N-CA-C 110.416 -1.074 . . . . 0.68000000000000005 110.416 172.105 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -59.87 -56.71 18.35 Favored 'General case' 0 C--N 1.331 -0.233 0 C-N-CA 125.189 1.396 . . . . 3.04 109.319 -172.603 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . 0.48 HD11 ' HA ' ' A' ' 12' ' ' GLU . 0.7 OUTLIER -64.56 -32.28 57.15 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.302 0 O-C-N 121.334 -0.854 . . . . 0.37 111.768 177.807 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 5.0 t60 -59.96 -47.68 84.82 Favored 'General case' 0 CA--C 1.532 0.268 0 N-CA-C 107.828 -1.175 . . . . 0.56999999999999995 107.828 176.353 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 20.3 mt-10 -60.8 -38.55 85.72 Favored 'General case' 0 N--CA 1.454 -0.248 0 C-N-CA 124.321 1.048 . . . . 2.5899999999999999 110.157 179.527 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 1.3 t80 -53.07 -45.99 68.36 Favored 'General case' 0 C--N 1.332 -0.169 0 C-N-CA 123.155 0.582 . . . . 2.2599999999999998 110.028 172.856 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -48.57 -50.3 25.16 Favored Glycine 0 CA--C 1.529 0.94 0 N-CA-C 111.473 -0.651 . . . . 0.5 111.473 171.923 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 40.6 m-70 -58.84 -50.49 73.78 Favored 'General case' 0 C--O 1.224 -0.247 0 O-C-N 121.148 -1.207 . . . . 3.23 112.205 176.931 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -59.78 -27.92 66.97 Favored 'General case' 0 N--CA 1.453 -0.286 0 CA-C-N 118.227 0.467 . . . . 0.73999999999999999 110.854 -176.938 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 53.9 t -69.11 -45.18 80.26 Favored 'Isoleucine or valine' 0 C--O 1.232 0.153 0 O-C-N 121.208 -0.933 . . . . 0.78000000000000003 109.935 174.042 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 1.9 t0 -60.87 -19.7 60.61 Favored 'General case' 0 C--N 1.327 -0.38 0 C-N-CA 124.453 1.101 . . . . 1.8600000000000001 111.78 178.0 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 9.8 t70 -72.33 -51.79 19.08 Favored 'General case' 0 N--CA 1.455 -0.177 0 C-N-CA 124.806 1.242 . . . . 1.8899999999999999 109.556 -173.488 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -57.1 -48.37 78.77 Favored 'General case' 0 N--CA 1.457 -0.095 0 CA-C-N 115.544 -0.753 . . . . 3.0699999999999998 109.418 -178.791 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -64.19 -24.67 67.76 Favored 'General case' 0 N--CA 1.453 -0.299 0 N-CA-C 112.441 0.534 . . . . 1.3200000000000001 112.441 176.63 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -66.48 -30.75 77.05 Favored Glycine 0 CA--C 1.524 0.655 0 CA-C-N 118.964 0.802 . . . . 1.6699999999999999 111.49 174.461 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -89.94 -44.82 9.63 Favored 'General case' 0 CA--C 1.529 0.165 0 CA-C-N 118.014 0.907 . . . . 2.7400000000000002 110.973 -177.817 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 3.2 mm? -77.85 -37.68 47.81 Favored 'General case' 0 N--CA 1.452 -0.337 0 C-N-CA 124.201 1.0 . . . . 1.5700000000000001 112.432 -175.559 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 13.0 mt -108.4 -143.2 0.38 Allowed 'General case' 0 N--CA 1.447 -0.585 0 N-CA-C 106.317 -1.734 . . . . 2.3100000000000001 106.317 -174.465 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER 6.15 94.34 0.0 OUTLIER 'General case' 0 N--CA 1.469 0.52 0 C-N-CA 128.502 2.721 . . . . 6.1200000000000001 115.339 178.061 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -62.91 157.36 21.83 Favored 'General case' 0 C--O 1.225 -0.221 0 O-C-N 121.651 -0.656 . . . . 6.6500000000000004 110.415 -169.601 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -46.35 88.26 0.0 OUTLIER 'General case' 0 CA--C 1.533 0.31 0 C-N-CA 126.081 1.752 . . . . 7.0800000000000001 112.673 -170.244 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 6.3 tp-100 -153.53 -53.26 0.1 Allowed 'General case' 0 N--CA 1.454 -0.268 0 C-N-CA 124.89 1.276 . . . . 9.3900000000000006 107.673 -172.339 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 22.8 t -123.1 145.47 48.54 Favored 'General case' 0 N--CA 1.449 -0.523 0 N-CA-C 106.208 -1.775 . . . . 6.1500000000000004 106.208 165.348 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 2.8 t70 -84.53 141.97 30.35 Favored 'General case' 0 N--CA 1.449 -0.523 0 N-CA-C 107.019 -1.475 . . . . 5.8700000000000001 107.019 173.639 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 4.5 mp 63.81 150.99 0.04 OUTLIER 'General case' 0 CA--C 1.544 0.724 0 C-N-CA 126.506 1.922 . . . . 2.3599999999999999 111.938 -171.17 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 11.6 p -79.73 77.83 0.9 Allowed 'Isoleucine or valine' 0 CA--C 1.539 0.533 0 O-C-N 120.311 -1.493 . . . . 2.6899999999999999 110.648 -175.757 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 57.5 p -48.58 -48.37 39.02 Favored 'General case' 0 C--N 1.331 -0.237 0 O-C-N 120.242 -1.536 . . . . 3.96 114.4 -166.436 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 18.9 m-80 -159.49 -53.77 0.06 Allowed 'General case' 0 C--N 1.329 -0.32 0 N-CA-C 105.9 -1.889 . . . . 7.2400000000000002 105.9 170.519 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER 57.33 -161.13 0.22 Allowed 'General case' 0 N--CA 1.452 -0.375 0 CA-C-N 115.462 -0.79 . . . . 2.9199999999999999 109.895 -170.584 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 8.9 mttm 46.51 -90.22 0.01 OUTLIER 'General case' 0 N--CA 1.47 0.548 0 C-N-CA 124.706 1.202 . . . . 5.8399999999999999 111.727 -175.855 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -75.19 78.45 2.32 Favored 'General case' 0 N--CA 1.45 -0.441 0 N-CA-C 107.274 -1.38 . . . . 6.71 107.274 173.076 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 1.7 m-85 -52.51 109.34 0.39 Allowed 'General case' 0 N--CA 1.456 -0.17 0 C-N-CA 123.657 0.783 . . . . 5.2400000000000002 108.995 178.623 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . 0.284 1.5 mp 54.27 67.95 0.14 Allowed 'Isoleucine or valine' 0 CA--C 1.551 1.007 0 CA-C-O 122.886 1.326 . . . . 3.5600000000000001 110.833 174.151 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 4.5 t0 -137.69 -64.19 0.56 Allowed 'General case' 0 N--CA 1.473 0.714 0 O-C-N 120.637 -1.289 . . . . 2.7400000000000002 109.048 174.166 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 5.8 mm -53.75 -56.07 10.71 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.331 0 N-CA-C 108.108 -1.071 . . . . 0.48999999999999999 108.108 -174.801 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 48' ' ' PHE . . . . . 0.538 ' CD2' ' HG2' ' A' ' 63' ' ' GLU . 29.2 t80 -57.73 -34.36 69.42 Favored 'General case' 0 N--CA 1.452 -0.364 0 N-CA-C 113.068 0.766 . . . . 0.40999999999999998 113.068 174.21 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . 0.534 ' HA ' ' HE2' ' A' ' 49' ' ' LYS . 9.3 mmpt? -62.88 -48.33 79.46 Favored 'General case' 0 N--CA 1.454 -0.234 0 O-C-N 120.531 -1.355 . . . . 1.1699999999999999 111.575 -172.465 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -88.32 -62.95 1.37 Allowed 'General case' 0 C--N 1.329 -0.316 0 N-CA-C 107.226 -1.398 . . . . 4.04 107.226 -177.806 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 13.9 mm-40 -66.21 -34.56 78.3 Favored 'General case' 0 C--O 1.235 0.31 0 CA-C-O 121.369 0.604 . . . . 2.48 109.869 -167.954 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -69.37 34.47 0.33 Allowed Glycine 0 CA--C 1.531 1.071 0 C-N-CA 125.447 1.498 . . . . 0.48999999999999999 113.328 169.463 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 60.8 p -146.57 27.93 1.09 Allowed 'General case' 0 N--CA 1.451 -0.383 0 O-C-N 120.195 -1.768 . . . . 1.6399999999999999 110.585 157.152 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 52.5 t-20 -134.48 -47.06 0.75 Allowed 'General case' 0 N--CA 1.453 -0.284 0 CA-C-O 120.725 0.298 . . . . 1.6299999999999999 111.149 -165.83 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 14.5 mt -63.42 -35.06 79.18 Favored 'General case' 0 C--N 1.333 -0.142 0 O-C-N 121.865 -0.522 . . . . 0.46000000000000002 111.125 -176.666 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 1.5 t 175.19 167.88 0.31 Allowed 'General case' 0 CA--C 1.531 0.237 0 C-N-CA 125.488 1.515 . . . . 0.55000000000000004 108.148 -178.272 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 9.7 m -59.53 -33.63 71.63 Favored 'General case' 0 N--CA 1.453 -0.281 0 C-N-CA 123.44 0.696 . . . . 0.92000000000000004 110.827 168.835 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -66.83 -14.23 62.46 Favored 'General case' 0 CA--C 1.535 0.377 0 C-N-CA 122.775 0.43 . . . . 2.46 111.672 175.842 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -90.26 -11.59 62.63 Favored Glycine 0 N--CA 1.445 -0.733 0 C-N-CA 124.415 1.007 . . . . 0.60999999999999999 111.105 175.239 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -104.41 -13.93 15.91 Favored 'General case' 0 CA--C 1.521 -0.166 0 CA-C-N 118.711 1.255 . . . . 2.9500000000000002 112.314 179.177 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 1.3 p -59.83 -173.1 0.02 OUTLIER 'General case' 0 CA--C 1.541 0.607 0 C-N-CA 123.205 0.602 . . . . 1.1599999999999999 110.006 161.834 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 98.1 m-20 -49.59 153.05 1.24 Allowed 'General case' 0 N--CA 1.467 0.409 0 O-C-N 121.347 -0.846 . . . . 1.5800000000000001 111.793 -172.8 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . 0.538 ' HG2' ' CD2' ' A' ' 48' ' ' PHE . 42.0 mt-10 -54.32 -34.24 60.59 Favored 'General case' 0 CA--C 1.533 0.321 0 O-C-N 122.299 -0.251 . . . . 3.1299999999999999 111.34 -179.684 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -56.12 -39.36 72.11 Favored 'General case' 0 C--N 1.334 -0.078 0 O-C-N 121.552 -0.718 . . . . 0.62 112.558 176.058 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 1.8 mm-40 -80.19 -34.92 37.08 Favored 'General case' 0 CA--C 1.508 -0.65 0 CA-C-O 118.664 -0.684 . . . . 2.98 110.592 -178.203 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 62.7 t80 -55.15 -48.9 73.07 Favored 'General case' 0 N--CA 1.449 -0.51 0 C-N-CA 123.928 0.891 . . . . 0.51000000000000001 111.13 170.929 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 82.5 t80 -63.13 -44.7 94.84 Favored 'General case' 0 CA--C 1.535 0.371 0 O-C-N 121.028 -1.045 . . . . 0.68000000000000005 110.398 175.648 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -60.94 -52.53 64.65 Favored 'General case' 0 CA--C 1.539 0.543 0 O-C-N 121.077 -1.015 . . . . 0.37 112.58 -175.213 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 1.9 pp20? -63.41 -33.29 75.22 Favored 'General case' 0 C--N 1.331 -0.196 0 C-N-CA 124.426 1.09 . . . . 3.73 111.213 174.915 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -53.09 -58.74 5.99 Favored 'General case' 0 C--O 1.222 -0.37 0 CA-C-O 118.075 -0.964 . . . . 0.51000000000000001 108.741 170.331 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 44.5 t80 -48.5 -48.01 38.33 Favored 'General case' 0 N--CA 1.468 0.445 0 CA-C-N 119.654 1.115 . . . . 2.2999999999999998 112.01 179.454 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 72' ' ' ARG . . . . . 0.479 ' CG ' HG13 ' A' ' 15' ' ' ILE . 2.4 tmm_? -48.34 -51.46 26.11 Favored 'General case' 0 CA--C 1.539 0.522 0 C-N-CA 122.544 0.338 . . . . 3.2400000000000002 110.238 176.331 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . 0.642 HD12 HG23 ' A' ' 85' ' ' VAL . 0.1 OUTLIER -75.7 -27.35 58.2 Favored 'General case' 0 C--O 1.225 -0.186 0 C-N-CA 124.5 1.12 . . . . 0.48999999999999999 111.924 -176.711 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 34.0 mmt -58.52 -40.82 83.98 Favored 'General case' 0 CA--C 1.516 -0.349 0 CA-C-N 118.931 0.787 . . . . 5.7999999999999998 109.627 -179.941 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 22.9 p80 -90.2 -39.6 12.71 Favored 'General case' 0 N--CA 1.449 -0.483 0 CA-C-O 115.815 -2.04 . . . . 1.0700000000000001 110.758 -176.975 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 3.6 m -3.18 112.46 0.01 OUTLIER 'General case' 0 C--N 1.349 0.569 0 C-N-CA 128.156 2.582 . . . . 1.0 114.445 -172.636 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 2.6 p -46.64 -43.91 17.96 Favored 'General case' 0 N--CA 1.451 -0.396 0 C-N-CA 125.366 1.466 . . . . 0.93999999999999995 110.836 178.713 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 61.9 t0 -72.35 108.1 5.29 Favored 'General case' 0 N--CA 1.453 -0.313 0 C-N-CA 119.055 -1.058 . . . . 1.9099999999999999 108.629 167.708 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 92.8 m-70 -50.39 -34.08 22.99 Favored 'General case' 0 N--CA 1.453 -0.292 0 C-N-CA 123.478 0.711 . . . . 5.25 110.93 175.14 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -53.57 -48.94 68.71 Favored 'General case' 0 N--CA 1.45 -0.435 0 CA-C-O 119.205 -0.426 . . . . 0.64000000000000001 111.039 176.659 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -56.17 -38.52 71.03 Favored 'General case' 0 CA--C 1.52 -0.188 0 CA-C-N 118.363 0.529 . . . . 3.7400000000000002 110.641 -178.847 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -64.86 -50.32 67.08 Favored 'General case' 0 N--CA 1.452 -0.335 0 N-CA-C 109.068 -0.716 . . . . 3.1499999999999999 109.068 179.111 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 1.2 mm? -65.11 -21.75 66.85 Favored 'General case' 0 N--CA 1.451 -0.378 0 CA-C-O 118.166 -0.921 . . . . 0.42999999999999999 112.548 178.241 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 30.6 mttt -66.98 -46.62 74.05 Favored 'General case' 0 C--O 1.222 -0.387 0 N-CA-C 107.083 -1.451 . . . . 1.6899999999999999 107.083 171.889 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 85' ' ' VAL . . . . . 0.642 HG23 HD12 ' A' ' 73' ' ' LEU . 86.8 t -59.87 -43.32 91.76 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.688 0 C-N-CA 119.541 -0.864 . . . . 0.48999999999999999 112.183 173.965 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 86' ' ' GLN . . . . . 0.445 ' HG2' ' CG ' ' A' ' 93' ' ' PHE . 1.4 mm-40 -67.76 -53.13 29.75 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 120.554 1.525 . . . . 2.6200000000000001 110.735 -174.994 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 18.6 tttm -52.82 -50.47 63.62 Favored 'General case' 0 N--CA 1.453 -0.279 0 C-N-CA 125.148 1.379 . . . . 2.0699999999999998 110.431 177.606 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 5.8 m-20 -67.27 -36.03 80.74 Favored 'General case' 0 N--CA 1.452 -0.327 0 CA-C-O 118.894 -0.574 . . . . 1.1000000000000001 110.501 -179.034 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -141.06 80.8 16.65 Favored Pre-proline 0 C--O 1.238 0.491 0 C-N-CA 126.266 1.826 . . . . 0.34999999999999998 110.968 -168.686 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 92.6 Cg_endo -80.26 37.97 0.71 Allowed 'Trans proline' 0 CA--C 1.541 0.837 0 C-N-CA 123.525 2.817 . . . . 1.53 111.974 -176.498 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 2.0 ptmt -155.51 -47.88 0.08 Allowed 'General case' 0 CA--C 1.531 0.225 0 C-N-CA 125.431 1.492 . . . . 2.7599999999999998 110.079 -175.34 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 3.6 m -53.94 -45.21 71.19 Favored 'General case' 0 N--CA 1.463 0.187 0 O-C-N 121.041 -1.037 . . . . 0.39000000000000001 110.323 171.957 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 93' ' ' PHE . . . . . 0.445 ' CG ' ' HG2' ' A' ' 86' ' ' GLN . 7.8 t80 -56.82 -47.92 79.16 Favored 'General case' 0 CA--C 1.505 -0.755 0 C-N-CA 120.281 -0.568 . . . . 2.3300000000000001 111.396 178.582 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 56.3 tt0 -51.27 -35.67 38.47 Favored 'General case' 0 N--CA 1.447 -0.624 0 CA-C-N 115.533 -0.758 . . . . 2.2200000000000002 110.655 179.934 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 9.0 t80 -55.68 -59.6 4.63 Favored 'General case' 0 CA--C 1.532 0.252 0 CA-C-N 118.534 0.606 . . . . 1.6399999999999999 110.83 -176.907 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 3.8 mp -69.43 -32.86 54.77 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.202 0 O-C-N 121.624 -0.673 . . . . 1.22 109.297 -178.846 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 47.2 t30 -60.37 -31.78 70.66 Favored 'General case' 0 N--CA 1.453 -0.284 0 O-C-N 121.807 -0.558 . . . . 2.1499999999999999 110.606 -179.243 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -68.22 -59.81 2.94 Favored 'General case' 0 N--CA 1.456 -0.126 0 C-N-CA 124.688 1.195 . . . . 2.1800000000000002 108.67 171.15 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 38.6 mm-40 -85.8 77.28 9.78 Favored 'General case' 0 N--CA 1.45 -0.456 0 CA-C-O 121.426 0.631 . . . . 3.4199999999999999 110.574 -176.307 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 6.7 tp -42.45 -50.98 0.97 Allowed 'Isoleucine or valine' 0 CA--C 1.534 0.361 0 C-N-CA 126.178 1.791 . . . . 4.3099999999999996 112.321 -178.181 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 34.5 pttt -172.98 162.77 4.71 Favored 'General case' 0 N--CA 1.46 0.055 0 C-N-CA 125.25 1.42 . . . . 8.7899999999999991 107.909 175.271 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 102' ' ' PHE . . . . . . . . . . . . . 4.1 t80 -144.05 -49.19 0.29 Allowed 'General case' 0 C--O 1.225 -0.233 0 N-CA-C 109.949 -0.389 . . . . 11.529999999999999 109.949 -179.451 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -52.79 -35.99 22.49 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.466 0 C-N-CA 123.937 0.895 . . . . 4.5700000000000003 111.427 175.051 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 104' ' ' ILE . . . . . . . . . . . . . 43.0 mm -74.05 81.46 0.47 Allowed 'Isoleucine or valine' 0 CA--C 1.532 0.25 0 N-CA-C 108.165 -1.05 . . . . 6.2999999999999998 108.165 176.255 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 4.9 t30 -87.0 143.92 27.13 Favored 'General case' 0 N--CA 1.449 -0.478 0 N-CA-C 107.288 -1.375 . . . . 10.01 107.288 168.671 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 27.2 m . . . . . 0 C--O 1.251 1.17 0 CA-C-O 116.592 -1.671 . . . . 12.449999999999999 108.316 175.656 . . . . . . . . 0 0 . 1 . 021 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.468 0.796 0 N-CA-C 108.439 -1.864 . . . . 10.66 108.439 . . . . . . . . . 0 0 . 1 . 021 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 24.7 m -151.24 108.11 3.54 Favored 'General case' 0 N--CA 1.454 -0.25 0 CA-C-N 118.043 0.921 . . . . 12.17 108.97 171.539 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 2.3 ptpp? -159.28 126.13 4.63 Favored 'General case' 0 C--O 1.224 -0.283 0 CA-C-N 119.248 0.931 . . . . 14.32 110.182 167.866 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 68.45 -154.32 53.17 Favored Glycine 0 C--N 1.334 0.458 0 N-CA-C 111.695 -0.562 . . . . 11.74 111.695 176.03 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 33.7 m -81.38 -169.14 0.1 Allowed 'Isoleucine or valine' 0 N--CA 1.446 -0.641 0 N-CA-C 108.786 -0.82 . . . . 12.359999999999999 108.786 169.955 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 14.5 pt-20 -79.1 120.37 23.55 Favored 'General case' 0 N--CA 1.445 -0.68 0 O-C-N 121.028 -1.045 . . . . 9.1099999999999994 111.923 176.757 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -108.18 32.17 4.99 Favored 'General case' 0 N--CA 1.453 -0.275 0 N-CA-C 109.208 -0.664 . . . . 7.9900000000000002 109.208 178.546 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER 73.9 -58.32 0.59 Allowed 'General case' 0 N--CA 1.465 0.288 0 C-N-CA 125.123 1.369 . . . . 9.8100000000000005 110.938 -166.558 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 3.9 m120 -59.65 -33.48 71.59 Favored 'General case' 0 CA--C 1.514 -0.439 0 C-N-CA 124.195 0.998 . . . . 2.7000000000000002 111.96 -177.74 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 5.1 t70 -72.18 -39.57 68.56 Favored 'General case' 0 N--CA 1.449 -0.51 0 C-N-CA 119.528 -0.869 . . . . 3.0699999999999998 110.36 -176.576 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 60.6 m -68.14 -55.31 12.85 Favored 'General case' 0 C--O 1.231 0.128 0 C-N-CA 123.448 0.699 . . . . 1.53 111.216 177.097 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . 0.457 ' HA ' HD11 ' A' ' 15' ' ' ILE . 0.0 OUTLIER -67.34 -30.8 70.71 Favored 'General case' 0 CA--C 1.539 0.557 0 CA-C-O 121.741 0.782 . . . . 4.46 109.262 -176.033 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -70.61 -40.47 66.55 Favored Glycine 0 CA--C 1.528 0.852 0 O-C-N 121.606 -0.684 . . . . 0.70999999999999996 111.53 173.54 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 28.2 t80 -58.21 -56.2 25.14 Favored 'General case' 0 C--O 1.226 -0.172 0 CA-C-N 118.725 1.263 . . . . 3.3599999999999999 108.813 -178.942 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . 0.457 HD11 ' HA ' ' A' ' 12' ' ' GLU . 0.5 OUTLIER -64.19 -32.51 57.72 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.229 0 CA-C-O 118.832 -0.604 . . . . 0.41999999999999998 112.456 178.705 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 1.6 t-160 -55.47 -57.91 9.95 Favored 'General case' 0 C--N 1.342 0.261 0 N-CA-C 106.78 -1.563 . . . . 0.46000000000000002 106.78 176.23 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 6.5 mt-10 -58.84 -36.35 74.41 Favored 'General case' 0 C--O 1.223 -0.307 0 C-N-CA 124.078 0.951 . . . . 3.0600000000000001 110.624 -178.619 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 1.8 t80 -56.81 -51.33 69.38 Favored 'General case' 0 CA--C 1.521 -0.158 0 C-N-CA 124.075 0.95 . . . . 1.98 110.386 176.907 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -51.79 -45.15 55.49 Favored Glycine 0 CA--C 1.526 0.746 0 N-CA-C 110.309 -1.116 . . . . 0.56000000000000005 110.309 175.681 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 20' ' ' HIS . . . . . 0.425 ' CE1' ' HB1' ' A' ' 64' ' ' ALA . 2.7 t60 -62.35 -42.91 99.78 Favored 'General case' 0 N--CA 1.451 -0.384 0 O-C-N 122.075 -0.662 . . . . 1.79 111.401 179.445 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -65.42 -30.0 70.75 Favored 'General case' 0 N--CA 1.452 -0.339 0 O-C-N 121.242 -0.911 . . . . 0.79000000000000004 110.02 179.175 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 71.2 t -71.92 -34.73 51.99 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.175 0 O-C-N 121.067 -1.021 . . . . 1.21 110.278 177.121 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 18.0 t70 -58.26 -26.26 62.73 Favored 'General case' 0 C--O 1.233 0.203 0 CA-C-O 120.952 0.406 . . . . 1.8400000000000001 111.581 172.787 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 12.8 t70 -65.26 -54.11 34.18 Favored 'General case' 0 CA--C 1.518 -0.266 0 N-CA-C 108.818 -0.808 . . . . 2.0 108.818 -177.369 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -50.43 -49.89 53.6 Favored 'General case' 0 CA--C 1.521 -0.172 0 C-N-CA 125.082 1.353 . . . . 3.75 110.13 178.855 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -55.92 -43.13 77.07 Favored 'General case' 0 N--CA 1.447 -0.581 0 CA-C-O 119.123 -0.465 . . . . 1.0900000000000001 110.74 179.531 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -62.57 -51.21 57.74 Favored Glycine 0 C--N 1.333 0.396 0 CA-C-N 118.745 0.702 . . . . 1.28 111.656 179.45 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -52.75 -39.91 62.62 Favored 'General case' 0 N--CA 1.453 -0.299 0 C-N-CA 124.917 1.287 . . . . 2.4700000000000002 110.563 -175.331 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 3.0 mm? -88.8 -24.57 22.57 Favored 'General case' 0 N--CA 1.446 -0.669 0 C-N-CA 124.683 1.193 . . . . 1.4199999999999999 113.511 179.255 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 16.3 mt -131.14 81.59 2.0 Allowed 'General case' 0 N--CA 1.451 -0.38 0 N-CA-C 108.441 -0.948 . . . . 1.8100000000000001 108.441 -169.041 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -43.54 -44.85 6.31 Favored 'General case' 0 N--CA 1.467 0.408 0 C-N-CA 126.017 1.727 . . . . 6.7599999999999998 113.081 -166.884 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 12.5 mmtm 28.09 54.99 0.08 Allowed 'General case' 0 N--CA 1.468 0.463 0 C-N-CA 129.02 2.928 . . . . 8.5500000000000007 113.615 177.187 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 6.1 t-20 38.53 52.59 1.79 Allowed 'General case' 0 CA--C 1.528 0.107 0 C-N-CA 126.218 1.807 . . . . 7.9800000000000004 111.819 178.936 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 21.4 tp60 -139.65 -46.66 0.45 Allowed 'General case' 0 N--CA 1.446 -0.66 0 CA-C-N 114.124 -1.398 . . . . 10.69 108.006 -179.423 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 3.0 t 77.34 -41.4 0.37 Allowed 'General case' 0 N--CA 1.462 0.143 0 C-N-CA 126.052 1.741 . . . . 7.5 112.348 179.283 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 33.0 t70 -128.61 118.8 23.57 Favored 'General case' 0 N--CA 1.449 -0.518 0 N-CA-C 105.977 -1.86 . . . . 6.5300000000000002 105.977 -177.059 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER 63.72 167.42 0.15 Allowed 'General case' 0 CA--C 1.539 0.528 0 C-N-CA 125.53 1.532 . . . . 2.8999999999999999 111.831 -168.922 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 4.5 p -104.21 -44.25 8.85 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.47 0 O-C-N 121.163 -0.961 . . . . 2.7400000000000002 110.296 176.927 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER 55.31 -175.2 0.04 OUTLIER 'General case' 0 CA--C 1.541 0.633 0 C-N-CA 125.379 1.472 . . . . 3.6099999999999999 110.887 -175.076 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 9.6 t30 -73.62 95.79 2.37 Favored 'General case' 0 N--CA 1.453 -0.319 0 O-C-N 119.601 -1.937 . . . . 6.6900000000000004 109.32 169.031 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 68.3 m -131.76 42.71 3.14 Favored 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 108.311 -0.996 . . . . 4.8099999999999996 108.311 170.479 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 24.3 mmtp -73.49 -44.49 57.74 Favored 'General case' 0 N--CA 1.467 0.401 0 O-C-N 121.69 -0.632 . . . . 6.1900000000000004 110.517 175.223 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 52.8 mttm -134.07 -72.0 0.49 Allowed 'General case' 0 CA--C 1.518 -0.252 0 N-CA-C 108.483 -0.932 . . . . 7.2800000000000002 108.483 -178.602 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -150.69 171.17 17.57 Favored 'General case' 0 N--CA 1.453 -0.299 0 N-CA-C 107.046 -1.465 . . . . 5.7400000000000002 107.046 171.338 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 7.0 pt -59.33 111.99 0.59 Allowed 'Isoleucine or valine' 0 CA--C 1.538 0.506 0 N-CA-C 108.946 -0.761 . . . . 2.4500000000000002 108.946 170.199 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 26.6 p-10 -145.63 -59.35 0.33 Allowed 'General case' 0 CA--C 1.533 0.322 0 O-C-N 121.587 -0.696 . . . . 3.9399999999999999 110.584 -169.824 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 4.6 mm -55.7 -49.97 70.68 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.416 0 C-N-CA 127.316 2.246 . . . . 0.55000000000000004 107.504 176.138 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 26.5 t80 -60.58 -36.63 79.0 Favored 'General case' 0 N--CA 1.449 -0.498 0 C-N-CA 123.874 0.87 . . . . 0.54000000000000004 112.866 174.155 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . 0.526 ' HA ' ' HE2' ' A' ' 49' ' ' LYS . 10.2 mmpt? -62.61 -46.8 86.62 Favored 'General case' 0 CA--C 1.519 -0.248 0 C-N-CA 118.576 -1.25 . . . . 1.03 110.542 -173.41 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 4.6 tp10 -85.05 -64.76 1.1 Allowed 'General case' 0 N--CA 1.449 -0.479 0 CA-C-O 121.916 0.865 . . . . 2.1800000000000002 108.669 -177.825 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 14.2 mm-40 -72.52 -29.58 63.72 Favored 'General case' 0 CA--C 1.533 0.324 0 O-C-N 121.609 -0.682 . . . . 2.54 110.331 -167.835 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -70.57 37.8 0.47 Allowed Glycine 0 CA--C 1.528 0.902 0 C-N-CA 125.844 1.688 . . . . 0.37 113.869 169.487 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 63.8 p -142.41 23.89 1.96 Allowed 'General case' 0 N--CA 1.447 -0.624 0 O-C-N 121.085 -1.244 . . . . 1.8500000000000001 110.152 157.497 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -134.26 -39.45 0.83 Allowed 'General case' 0 C--N 1.341 0.209 0 N-CA-C 112.842 0.682 . . . . 1.76 112.842 -164.541 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . 0.514 HD22 HG22 ' A' ' 85' ' ' VAL . 25.7 mt -65.91 -36.6 83.83 Favored 'General case' 0 N--CA 1.463 0.175 0 C-N-CA 120.118 -0.633 . . . . 0.41999999999999998 110.495 -177.988 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER 178.23 169.65 0.77 Allowed 'General case' 0 CA--C 1.533 0.32 0 C-N-CA 125.622 1.569 . . . . 0.48999999999999999 107.908 -178.762 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 16.4 m -59.19 -37.88 78.5 Favored 'General case' 0 CA--C 1.529 0.15 0 C-N-CA 124.026 0.93 . . . . 0.91000000000000003 110.994 171.628 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -60.13 -32.92 71.46 Favored 'General case' 0 C--O 1.223 -0.34 0 C-N-CA 123.784 0.834 . . . . 1.54 109.175 172.53 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -64.06 -6.16 18.05 Favored Glycine 0 CA--C 1.524 0.594 0 O-C-N 121.196 -0.94 . . . . 0.39000000000000001 112.442 176.46 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -121.57 0.88 10.0 Favored 'General case' 0 N--CA 1.454 -0.27 0 CA-C-N 119.01 1.405 . . . . 4.3600000000000003 112.491 -177.49 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 58.9 p -73.92 -127.58 0.01 OUTLIER 'General case' 0 CA--C 1.534 0.359 0 N-CA-C 108.881 -0.785 . . . . 0.93000000000000005 108.881 174.834 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 1.7 m120 -74.63 150.91 39.43 Favored 'General case' 0 CA--C 1.531 0.23 0 O-C-N 120.072 -1.642 . . . . 1.6799999999999999 108.822 176.484 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 31.0 tt0 -62.41 -24.23 67.28 Favored 'General case' 0 CA--C 1.539 0.523 0 O-C-N 121.596 -0.69 . . . . 3.3399999999999999 111.191 179.615 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 64' ' ' ALA . . . . . 0.425 ' HB1' ' CE1' ' A' ' 20' ' ' HIS . . . -67.33 -33.89 76.19 Favored 'General case' 0 N--CA 1.454 -0.241 0 C-N-CA 124.15 0.98 . . . . 0.77000000000000002 112.132 173.364 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 3.3 mt-10 -75.97 -49.61 17.22 Favored 'General case' 0 C--O 1.219 -0.525 0 N-CA-C 108.23 -1.026 . . . . 2.0699999999999998 108.23 177.778 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 59.8 t80 -40.06 -51.31 2.59 Favored 'General case' 0 CA--C 1.537 0.464 0 C-N-CA 123.885 0.874 . . . . 0.37 111.874 170.932 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 62.9 t80 -60.82 -43.89 97.61 Favored 'General case' 0 CA--C 1.539 0.54 0 O-C-N 121.705 -0.622 . . . . 0.46999999999999997 111.887 174.927 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -62.11 -52.07 65.34 Favored 'General case' 0 CA--C 1.535 0.368 0 C-N-CA 124.647 1.179 . . . . 0.33000000000000002 112.352 -177.951 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 4.5 mp0 -57.29 -43.69 83.38 Favored 'General case' 0 CA--C 1.515 -0.402 0 O-C-N 121.075 -1.015 . . . . 4.46 109.89 172.56 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -57.49 -34.57 69.19 Favored 'General case' 0 N--CA 1.451 -0.396 0 CA-C-N 118.286 0.494 . . . . 0.5 110.421 -179.544 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -60.51 -55.67 30.58 Favored 'General case' 0 CA--C 1.534 0.363 0 C-N-CA 124.057 0.943 . . . . 2.9900000000000002 111.385 169.917 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -48.92 -53.8 18.1 Favored 'General case' 0 CA--C 1.536 0.408 0 O-C-N 121.513 -0.742 . . . . 3.8900000000000001 110.407 178.61 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -68.69 -49.16 61.14 Favored 'General case' 0 N--CA 1.449 -0.521 0 C-N-CA 126.465 1.906 . . . . 0.52000000000000002 109.586 -171.509 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -63.16 -26.5 68.84 Favored 'General case' 0 CA--C 1.529 0.158 0 O-C-N 120.719 -1.238 . . . . 2.6699999999999999 111.895 -178.506 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 75' ' ' HIS . . . . . 0.411 ' CE1' HD12 ' A' ' 15' ' ' ILE . 0.3 OUTLIER -91.23 -13.97 31.8 Favored 'General case' 0 C--N 1.338 0.106 0 CA-C-O 117.627 -1.177 . . . . 1.01 111.736 175.974 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 73.5 p -46.61 123.72 5.27 Favored 'General case' 0 N--CA 1.447 -0.585 0 CA-C-O 122.819 1.295 . . . . 2.1699999999999999 108.611 -168.666 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -52.82 -39.75 62.7 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 113.604 -1.635 . . . . 1.3600000000000001 109.206 -179.254 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 78' ' ' ASP . . . . . 0.417 ' OD2' ' HB3' ' A' ' 80' ' ' ALA . 17.3 t0 -68.1 104.45 1.79 Allowed 'General case' 0 N--CA 1.444 -0.759 0 CA-C-O 122.411 1.1 . . . . 2.0299999999999998 110.466 167.816 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 9.0 p-80 -39.46 -40.9 0.9 Allowed 'General case' 0 N--CA 1.453 -0.299 0 CA-C-N 114.904 -1.044 . . . . 4.5199999999999996 113.362 168.609 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 80' ' ' ALA . . . . . 0.417 ' HB3' ' OD2' ' A' ' 78' ' ' ASP . . . -65.15 -48.23 74.26 Favored 'General case' 0 N--CA 1.45 -0.469 0 CA-C-N 119.159 0.891 . . . . 0.64000000000000001 110.273 -176.001 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 3.6 mt-10 -50.28 -38.14 39.65 Favored 'General case' 0 N--CA 1.454 -0.256 0 CA-C-N 118.884 0.766 . . . . 2.8799999999999999 110.949 175.631 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 2.6 mtp180 -63.97 -52.51 59.32 Favored 'General case' 0 CA--C 1.516 -0.33 0 C-N-CA 119.156 -1.018 . . . . 2.4399999999999999 109.733 177.8 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 1.3 mm? -60.19 -23.68 64.18 Favored 'General case' 0 N--CA 1.452 -0.356 0 CA-C-O 117.819 -1.086 . . . . 0.52000000000000002 112.267 178.778 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 2.7 mptm? -61.46 -43.9 98.05 Favored 'General case' 0 C--O 1.224 -0.283 0 CA-C-N 120.811 1.641 . . . . 1.3 108.791 172.061 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 85' ' ' VAL . . . . . 0.514 HG22 HD22 ' A' ' 55' ' ' LEU . 61.7 t -62.22 -61.83 1.44 Allowed 'Isoleucine or valine' 0 C--O 1.221 -0.431 0 CA-C-N 118.898 0.772 . . . . 0.55000000000000004 109.745 171.321 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -55.12 -30.55 59.98 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 119.046 0.839 . . . . 2.6699999999999999 113.073 -168.274 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 43.1 tttt -75.98 -60.17 2.44 Favored 'General case' 0 N--CA 1.451 -0.402 0 C-N-CA 125.526 1.531 . . . . 2.3199999999999998 109.932 173.117 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 10.0 m-20 -76.79 6.51 5.96 Favored 'General case' 0 CA--C 1.533 0.303 0 C-N-CA 123.776 0.83 . . . . 1.25 111.917 -172.798 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 89' ' ' ALA . . . . . 0.509 ' HB2' HD21 ' A' ' 55' ' ' LEU . . . -162.21 73.66 2.26 Favored Pre-proline 0 N--CA 1.445 -0.724 0 C-N-CA 125.657 1.583 . . . . 0.40999999999999998 108.625 -176.85 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 68.7 Cg_endo -81.82 49.85 3.3 Favored 'Trans proline' 0 CA--C 1.539 0.749 0 C-N-CA 124.041 3.161 . . . . 2.04 111.513 -172.726 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 1.2 ptmt -175.01 -49.99 0.01 OUTLIER 'General case' 0 C--O 1.225 -0.229 0 C-N-CA 126.972 2.109 . . . . 2.4199999999999999 109.407 -173.783 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 3.2 m -53.2 -41.97 65.83 Favored 'General case' 0 N--CA 1.462 0.163 0 O-C-N 121.293 -0.879 . . . . 0.40999999999999998 111.448 176.694 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 34.2 t80 -57.88 -52.46 65.4 Favored 'General case' 0 CA--C 1.503 -0.854 0 C-N-CA 120.127 -0.629 . . . . 2.3599999999999999 110.971 177.251 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 32.2 tt0 -53.22 -34.11 55.67 Favored 'General case' 0 N--CA 1.444 -0.764 0 CA-C-N 115.148 -0.933 . . . . 1.8899999999999999 110.043 178.152 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 6.0 t80 -61.7 -58.13 9.23 Favored 'General case' 0 N--CA 1.451 -0.408 0 C-N-CA 123.138 0.575 . . . . 1.05 110.393 -176.711 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 4.2 mp -63.21 -33.87 63.58 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.195 0 O-C-N 120.912 -1.117 . . . . 0.89000000000000001 109.695 176.912 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -60.89 -33.06 72.54 Favored 'General case' 0 CA--C 1.535 0.382 0 CA-C-N 118.814 0.734 . . . . 1.71 110.839 -178.592 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 28.0 t70 -59.59 -41.57 90.59 Favored 'General case' 0 N--CA 1.464 0.257 0 C-N-CA 124.542 1.137 . . . . 2.98 110.009 172.794 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 78.5 mm-40 -83.89 -42.44 16.35 Favored 'General case' 0 N--CA 1.447 -0.584 0 CA-C-N 115.857 -0.611 . . . . 2.9399999999999999 112.415 -167.644 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 17.8 tt -80.04 75.05 0.76 Allowed 'Isoleucine or valine' 0 CA--C 1.533 0.326 0 CA-C-O 122.057 0.932 . . . . 6.0700000000000003 110.445 -171.048 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -137.57 80.53 1.81 Allowed 'General case' 0 C--O 1.226 -0.166 0 O-C-N 121.235 -0.915 . . . . 8.9700000000000006 109.366 -172.212 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 102' ' ' PHE . . . . . . . . . . . . . 46.0 m-85 43.05 79.81 0.04 OUTLIER 'General case' 0 CA--C 1.53 0.207 0 C-N-CA 124.819 1.248 . . . . 7.79 111.93 -172.314 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 10.8 tp -121.44 72.25 0.41 Allowed 'Isoleucine or valine' 0 N--CA 1.454 -0.239 0 N-CA-C 107.982 -1.118 . . . . 6.7199999999999998 107.982 178.257 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 104' ' ' ILE . . . . . . . . . . . . . 11.4 pt -129.97 175.29 11.13 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.21 0 C-N-CA 124.256 1.022 . . . . 7.5899999999999999 108.493 179.487 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 7.8 p30 -147.86 175.9 10.57 Favored 'General case' 0 C--N 1.33 -0.279 0 C-N-CA 124.843 1.257 . . . . 8.2699999999999996 107.682 177.79 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 2.5 p . . . . . 0 C--O 1.249 1.067 0 CA-C-O 116.486 -1.721 . . . . 11.66 108.53 -173.975 . . . . . . . . 0 0 . 1 . 022 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.474 1.18 0 N-CA-C 109.154 -1.578 . . . . 11.93 109.154 . . . . . . . . . 0 0 . 1 . 022 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 26.5 t -155.38 177.0 11.85 Favored 'General case' 0 C--O 1.232 0.166 0 CA-C-N 118.339 1.069 . . . . 12.640000000000001 108.593 -175.416 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 37.9 ttpt -155.01 133.64 12.01 Favored 'General case' 0 N--CA 1.451 -0.388 0 N-CA-C 108.602 -0.888 . . . . 17.09 108.602 176.567 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 159.68 -166.41 34.9 Favored Glycine 0 N--CA 1.449 -0.443 0 N-CA-C 108.408 -1.877 . . . . 12.52 108.408 -179.469 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 31.6 m -90.25 -157.22 0.07 OUTLIER 'Isoleucine or valine' 0 N--CA 1.442 -0.845 0 N-CA-C 107.07 -1.455 . . . . 13.02 107.07 157.172 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 7.9 pt-20 -99.18 119.66 38.24 Favored 'General case' 0 N--CA 1.444 -0.757 0 CA-C-O 121.803 0.811 . . . . 9.5999999999999996 110.862 174.981 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . 0.4 HD22 ' N ' ' A' ' 7' ' ' LEU . 1.8 mm? -109.51 32.57 4.92 Favored 'General case' 0 N--CA 1.453 -0.296 0 C-N-CA 123.854 0.862 . . . . 8.4800000000000004 109.66 -178.818 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 21.5 mtp180 68.71 -67.37 0.21 Allowed 'General case' 0 N--CA 1.465 0.322 0 C-N-CA 125.704 1.602 . . . . 6.5899999999999999 110.861 -172.165 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 14.0 m-20 -51.94 -35.67 46.68 Favored 'General case' 0 CA--C 1.513 -0.455 0 C-N-CA 123.952 0.901 . . . . 2.6699999999999999 112.101 174.174 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 19.3 t70 -68.15 -43.44 78.27 Favored 'General case' 0 C--O 1.22 -0.482 0 C-N-CA 118.615 -1.234 . . . . 3.6200000000000001 110.479 178.957 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 74.6 m -58.28 -59.08 5.87 Favored 'General case' 0 CA--C 1.531 0.217 0 CA-C-N 119.08 0.854 . . . . 1.5 111.601 177.189 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . 0.511 ' HA ' HD11 ' A' ' 15' ' ' ILE . 27.8 mt-10 -68.33 -27.6 66.41 Favored 'General case' 0 CA--C 1.53 0.204 0 CA-C-O 121.369 0.604 . . . . 3.8500000000000001 110.575 -177.414 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -62.81 -41.08 99.92 Favored Glycine 0 CA--C 1.526 0.763 0 N-CA-C 111.047 -0.821 . . . . 0.57999999999999996 111.047 170.949 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 1.1 t80 -67.78 -52.2 40.04 Favored 'General case' 0 N--CA 1.455 -0.176 0 CA-C-N 118.476 1.138 . . . . 2.6099999999999999 109.139 -171.464 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . 0.511 HD11 ' HA ' ' A' ' 12' ' ' GLU . 1.1 pt -62.11 -36.37 73.9 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.301 0 CA-C-O 119.12 -0.467 . . . . 0.40000000000000002 112.057 175.625 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 3.5 t60 -58.25 -54.52 46.05 Favored 'General case' 0 CA--C 1.534 0.363 0 N-CA-C 107.286 -1.376 . . . . 0.46000000000000002 107.286 176.99 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 5.6 mt-10 -50.14 -49.05 53.28 Favored 'General case' 0 C--O 1.224 -0.255 0 C-N-CA 124.755 1.222 . . . . 3.0299999999999998 109.38 176.673 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -53.72 -47.98 70.05 Favored 'General case' 0 CA--C 1.518 -0.265 0 C-N-CA 124.829 1.252 . . . . 2.29 110.933 -178.931 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -49.06 -49.65 29.48 Favored Glycine 0 CA--C 1.524 0.617 0 N-CA-C 110.393 -1.083 . . . . 0.42999999999999999 110.393 173.614 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 20' ' ' HIS . . . . . 0.576 ' CE1' ' HB1' ' A' ' 64' ' ' ALA . 2.1 t-160 -61.33 -43.25 99.19 Favored 'General case' 0 N--CA 1.452 -0.331 0 O-C-N 121.901 -0.764 . . . . 1.95 111.413 178.041 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -61.94 -29.6 70.34 Favored 'General case' 0 N--CA 1.45 -0.464 0 O-C-N 120.909 -1.12 . . . . 0.62 110.396 -179.474 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 90.2 t -68.01 -41.11 84.25 Favored 'Isoleucine or valine' 0 CA--C 1.52 -0.201 0 O-C-N 121.332 -0.855 . . . . 0.81000000000000005 110.07 174.594 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 17.0 t0 -55.65 -31.54 62.43 Favored 'General case' 0 C--O 1.234 0.263 0 CA-C-O 121.779 0.8 . . . . 2.1000000000000001 111.087 173.9 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 14.3 t70 -77.42 -47.6 19.34 Favored 'General case' 0 N--CA 1.45 -0.472 0 C-N-CA 124.419 1.088 . . . . 2.0099999999999998 109.372 -173.54 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 29.0 t80 -62.05 -52.24 64.74 Favored 'General case' 0 N--CA 1.452 -0.351 0 N-CA-C 109.264 -0.643 . . . . 2.4399999999999999 109.264 179.338 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -54.43 -38.69 66.59 Favored 'General case' 0 N--CA 1.448 -0.541 0 CA-C-O 119.26 -0.4 . . . . 1.21 111.142 176.739 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -62.0 -53.54 42.06 Favored Glycine 0 CA--C 1.523 0.576 0 N-CA-C 110.669 -0.972 . . . . 1.3899999999999999 110.669 177.398 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -59.03 -43.27 91.59 Favored 'General case' 0 N--CA 1.455 -0.198 0 C-N-CA 124.003 0.921 . . . . 2.23 110.517 -173.451 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -79.79 -33.3 40.63 Favored 'General case' 0 N--CA 1.449 -0.498 0 C-N-CA 124.112 0.965 . . . . 2.1000000000000001 112.927 -177.155 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 14.4 mt -120.51 56.65 0.98 Allowed 'General case' 0 CA--C 1.521 -0.158 0 CA-C-N 119.037 0.835 . . . . 2.4300000000000002 109.276 -165.659 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 63.2 t0 -64.27 120.79 12.83 Favored 'General case' 0 CA--C 1.533 0.297 0 N-CA-C 109.093 -0.706 . . . . 6.54 109.093 177.575 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 19.6 ptmt -171.11 -39.58 0.02 OUTLIER 'General case' 0 N--CA 1.465 0.283 0 C-N-CA 124.586 1.154 . . . . 10.42 110.887 179.279 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 50.8 t-20 -63.61 142.7 58.3 Favored 'General case' 0 C--O 1.225 -0.185 0 N-CA-C 107.804 -1.184 . . . . 9.6500000000000004 107.804 174.474 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 6.2 tt0 -85.57 41.97 0.93 Allowed 'General case' 0 CA--C 1.535 0.395 0 CA-C-N 118.979 0.809 . . . . 10.699999999999999 109.569 176.631 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -150.36 159.66 44.29 Favored 'General case' 0 N--CA 1.45 -0.45 0 N-CA-C 107.284 -1.376 . . . . 6.7000000000000002 107.284 -179.283 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 17.5 t0 -75.69 149.22 38.16 Favored 'General case' 0 N--CA 1.453 -0.278 0 N-CA-C 109.256 -0.646 . . . . 5.0300000000000002 109.256 179.483 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 7.8 mp 61.56 164.05 0.08 Allowed 'General case' 0 CA--C 1.539 0.55 0 C-N-CA 126.531 1.933 . . . . 1.96 111.529 -173.402 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 9.7 p -65.12 -47.73 86.56 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.385 0 O-C-N 119.841 -1.787 . . . . 2.48 109.037 -178.88 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 71.4 p 51.49 -163.37 0.07 Allowed 'General case' 0 C--O 1.236 0.342 0 C-N-CA 128.414 2.685 . . . . 3.9700000000000002 112.758 177.756 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 35.0 t30 -73.13 79.58 1.25 Allowed 'General case' 0 N--CA 1.452 -0.354 0 O-C-N 121.321 -0.862 . . . . 7.0700000000000003 110.434 178.232 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 47.9 t -76.07 -62.49 1.58 Allowed 'General case' 0 CA--C 1.535 0.378 0 C-N-CA 124.348 1.059 . . . . 3.1899999999999999 111.229 179.734 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 12.2 mttt -54.19 125.98 21.18 Favored 'General case' 0 N--CA 1.467 0.383 0 O-C-N 121.219 -0.926 . . . . 6.75 109.25 -179.069 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 80.67 -44.74 0.24 Allowed 'General case' 0 CA--C 1.533 0.326 0 C-N-CA 124.971 1.308 . . . . 7.0899999999999999 110.136 177.973 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER 77.18 124.68 0.04 OUTLIER 'General case' 0 CA--C 1.529 0.137 0 C-N-CA 126.692 1.997 . . . . 5.6399999999999997 109.468 171.146 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER 38.55 65.79 0.1 Allowed 'Isoleucine or valine' 0 CA--C 1.539 0.527 0 C-N-CA 126.271 1.828 . . . . 2.6600000000000001 112.497 173.879 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 2.9 t70 -148.01 -66.08 0.25 Allowed 'General case' 0 C--O 1.225 -0.203 0 C-N-CA 123.934 0.894 . . . . 2.3100000000000001 109.319 -168.624 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 7.9 mm -44.78 -57.19 0.75 Allowed 'Isoleucine or valine' 0 CA--C 1.539 0.53 0 C-N-CA 125.53 1.532 . . . . 0.67000000000000004 109.075 169.799 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 18.0 t80 -60.2 -32.44 71.1 Favored 'General case' 0 C--O 1.222 -0.36 0 O-C-N 120.219 -1.551 . . . . 0.44 112.778 176.253 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . 0.537 ' HA ' ' HE2' ' A' ' 49' ' ' LYS . 7.0 mmpt? -66.17 -48.57 70.29 Favored 'General case' 0 C--N 1.327 -0.401 0 O-C-N 119.964 -1.71 . . . . 1.0600000000000001 111.227 -177.259 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 6.2 tp10 -86.96 -62.96 1.39 Allowed 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 108.117 -1.068 . . . . 2.4100000000000001 108.117 -175.162 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 29.8 mp0 -68.45 -30.3 69.13 Favored 'General case' 0 C--O 1.235 0.338 0 O-C-N 121.701 -0.624 . . . . 2.3799999999999999 111.041 -173.361 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -70.37 44.67 0.59 Allowed Glycine 0 CA--C 1.529 0.948 0 C-N-CA 125.154 1.359 . . . . 0.40000000000000002 113.927 169.123 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 52.3 p -150.72 31.77 0.63 Allowed 'General case' 0 N--CA 1.448 -0.563 0 O-C-N 120.879 -1.365 . . . . 1.8600000000000001 109.942 159.962 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 3.4 t-20 -143.85 -44.28 0.27 Allowed 'General case' 0 N--CA 1.454 -0.269 0 N-CA-C 112.4 0.519 . . . . 1.6799999999999999 112.4 -166.151 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . 0.59 HD21 ' HB2' ' A' ' 89' ' ' ALA . 15.4 mt -59.96 -35.62 75.36 Favored 'General case' 0 N--CA 1.464 0.235 0 O-C-N 122.324 -0.235 . . . . 0.5 111.124 -176.714 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER 178.15 171.61 0.7 Allowed 'General case' 0 CA--C 1.532 0.257 0 C-N-CA 126.148 1.779 . . . . 0.53000000000000003 106.886 179.961 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 13.2 m -61.24 -35.15 76.47 Favored 'General case' 0 N--CA 1.455 -0.214 0 O-C-N 121.599 -0.688 . . . . 0.93999999999999995 110.442 168.391 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -69.3 -4.06 16.51 Favored 'General case' 0 CA--C 1.535 0.383 0 N-CA-C 112.315 0.487 . . . . 1.4099999999999999 112.315 173.182 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -93.73 -6.97 61.86 Favored Glycine 0 N--CA 1.446 -0.681 0 CA-C-O 118.771 -1.016 . . . . 0.41999999999999998 111.084 173.131 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 54.1 ttt180 -111.15 -17.52 13.2 Favored 'General case' 0 C--O 1.23 0.076 0 CA-C-N 119.14 1.47 . . . . 3.3799999999999999 111.832 179.555 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 21.7 p -61.56 -163.95 0.01 OUTLIER 'General case' 0 CA--C 1.54 0.57 0 C-N-CA 123.532 0.733 . . . . 0.83999999999999997 109.73 167.976 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 2.8 m-20 -46.37 144.2 2.2 Favored 'General case' 0 CA--C 1.53 0.189 0 O-C-N 120.682 -1.262 . . . . 1.5600000000000001 111.455 -176.951 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -55.38 -32.1 62.33 Favored 'General case' 0 CA--C 1.532 0.267 0 CA-C-O 121.811 0.815 . . . . 2.8300000000000001 110.493 -179.604 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 64' ' ' ALA . . . . . 0.576 ' HB1' ' CE1' ' A' ' 20' ' ' HIS . . . -59.1 -39.68 82.95 Favored 'General case' 0 N--CA 1.448 -0.572 0 C-N-CA 123.74 0.816 . . . . 0.56000000000000005 112.382 176.538 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 9.3 mt-10 -71.81 -43.02 66.35 Favored 'General case' 0 C--O 1.223 -0.315 0 O-C-N 121.306 -0.871 . . . . 2.21 110.618 175.67 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 53.3 t80 -50.01 -50.36 47.57 Favored 'General case' 0 CA--C 1.531 0.215 0 C-N-CA 123.524 0.73 . . . . 0.46000000000000002 110.764 175.125 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 72.2 t80 -62.91 -45.05 94.33 Favored 'General case' 0 N--CA 1.451 -0.418 0 C-N-CA 123.738 0.815 . . . . 0.46000000000000002 110.928 177.298 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -61.31 -48.89 79.29 Favored 'General case' 0 CA--C 1.537 0.455 0 O-C-N 121.078 -1.013 . . . . 0.31 111.464 -176.051 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 6.4 mm-40 -56.02 -44.12 78.41 Favored 'General case' 0 CA--C 1.515 -0.381 0 C-N-CA 124.244 1.018 . . . . 4.0099999999999998 110.732 170.394 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -54.37 -43.71 71.59 Favored 'General case' 0 N--CA 1.451 -0.408 0 CA-C-O 118.662 -0.685 . . . . 0.37 109.423 -178.423 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 14.9 t80 -58.02 -52.28 66.19 Favored 'General case' 0 N--CA 1.463 0.188 0 C-N-CA 123.756 0.823 . . . . 2.1800000000000002 111.995 171.849 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 4.0 tmm_? -47.14 -52.57 15.11 Favored 'General case' 0 N--CA 1.465 0.321 0 C-N-CA 123.592 0.757 . . . . 2.52 110.191 179.917 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . 0.749 HD12 HG23 ' A' ' 85' ' ' VAL . 0.2 OUTLIER -66.44 -37.96 86.34 Favored 'General case' 0 C--N 1.329 -0.298 0 C-N-CA 126.55 1.94 . . . . 0.48999999999999999 111.003 178.297 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER -58.7 -37.57 76.38 Favored 'General case' 0 C--O 1.233 0.193 0 C-N-CA 123.385 0.674 . . . . 2.3900000000000001 111.506 -172.093 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 75' ' ' HIS . . . . . 0.405 ' CE1' HD12 ' A' ' 15' ' ' ILE . 10.0 p80 -95.43 -7.81 37.28 Favored 'General case' 0 CA--C 1.529 0.145 0 CA-C-O 116.395 -1.764 . . . . 0.93000000000000005 113.503 -179.979 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 7.6 m -38.53 125.01 1.36 Allowed 'General case' 0 C--N 1.342 0.277 0 CA-C-N 120.413 1.461 . . . . 0.98999999999999999 111.861 -167.006 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 2.7 p -51.94 -43.4 63.45 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 113.491 -1.686 . . . . 0.98999999999999999 109.045 176.7 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 10.6 t0 -66.84 106.15 1.8 Allowed 'General case' 0 N--CA 1.448 -0.531 0 N-CA-C 108.565 -0.902 . . . . 1.97 108.565 164.132 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 5.0 t-80 -62.36 -25.47 67.93 Favored 'General case' 0 N--CA 1.454 -0.264 0 O-C-N 121.373 -0.829 . . . . 6.0499999999999998 111.213 179.491 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -64.24 -43.76 93.94 Favored 'General case' 0 N--CA 1.452 -0.33 0 CA-C-N 118.988 0.813 . . . . 0.75 110.529 176.87 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 81' ' ' GLU . . . . . 0.542 ' HA ' ' HE3' ' A' ' 84' ' ' LYS . 7.5 mt-10 -49.77 -39.06 36.66 Favored 'General case' 0 CA--C 1.513 -0.451 0 C-N-CA 124.094 0.958 . . . . 2.6000000000000001 111.521 176.738 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 8.4 mtp180 -62.61 -47.68 82.71 Favored 'General case' 0 C--N 1.325 -0.482 0 N-CA-C 108.707 -0.849 . . . . 2.52 108.707 177.765 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . 0.416 HD13 ' HA ' ' A' ' 83' ' ' LEU . 1.6 mm? -64.81 -21.09 66.71 Favored 'General case' 0 N--CA 1.453 -0.316 0 CA-C-O 117.163 -1.398 . . . . 0.5 113.671 173.887 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 84' ' ' LYS . . . . . 0.542 ' HE3' ' HA ' ' A' ' 81' ' ' GLU . 0.0 OUTLIER -64.61 -43.52 93.48 Favored 'General case' 0 N--CA 1.463 0.202 0 CA-C-N 122.234 2.288 . . . . 2.2200000000000002 107.594 170.053 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' A' A ' 85' ' ' VAL . . . . . 0.749 HG23 HD12 ' A' ' 73' ' ' LEU . 68.3 t -63.18 -59.23 4.69 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.603 0 CA-C-O 117.267 -1.349 . . . . 0.40999999999999998 110.792 173.786 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 15.5 mt-30 -53.84 -44.15 70.05 Favored 'General case' 0 N--CA 1.465 0.286 0 CA-C-N 122.14 2.246 . . . . 1.78 112.29 -176.415 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 34.2 tttm -57.33 -48.24 79.48 Favored 'General case' 0 N--CA 1.449 -0.493 0 O-C-N 121.306 -0.871 . . . . 2.1299999999999999 110.903 178.139 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 6.3 m-20 -90.12 -0.37 57.57 Favored 'General case' 0 C--N 1.328 -0.327 0 C-N-CA 122.584 0.353 . . . . 0.92000000000000004 111.037 -174.635 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 89' ' ' ALA . . . . . 0.59 ' HB2' HD21 ' A' ' 55' ' ' LEU . . . -168.48 57.62 0.35 Allowed Pre-proline 0 CA--C 1.536 0.418 0 C-N-CA 124.876 1.27 . . . . 0.46000000000000002 109.764 -163.789 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 34.3 Cg_endo -61.12 -36.33 81.87 Favored 'Trans proline' 0 N--CA 1.455 -0.744 0 C-N-CA 121.87 1.713 . . . . 2.3199999999999998 109.501 -174.302 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 2.6 ptpt -75.82 -44.85 39.07 Favored 'General case' 0 N--CA 1.449 -0.489 0 C-N-CA 124.498 1.119 . . . . 2.3999999999999999 112.342 177.706 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 3.6 m -58.64 -45.13 89.95 Favored 'General case' 0 N--CA 1.463 0.178 0 CA-C-N 120.355 1.434 . . . . 0.38 110.675 -176.424 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 17.2 t80 -59.46 -49.53 77.44 Favored 'General case' 0 CA--C 1.508 -0.657 0 CA-C-O 120.99 0.424 . . . . 2.2000000000000002 110.083 178.267 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 26.1 tt0 -57.79 -28.72 64.26 Favored 'General case' 0 N--CA 1.445 -0.713 0 CA-C-N 115.283 -0.871 . . . . 1.3999999999999999 110.449 -178.64 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 8.7 t80 -64.37 -57.79 8.33 Favored 'General case' 0 N--CA 1.452 -0.348 0 C-N-CA 123.683 0.793 . . . . 1.3600000000000001 110.445 -176.579 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 96' ' ' ILE . . . . . 0.419 HD12 ' H ' ' A' ' 96' ' ' ILE . 3.7 mp -58.05 -39.45 72.5 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.187 0 N-CA-C 108.894 -0.78 . . . . 0.87 108.894 174.79 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 14.4 t30 -62.6 -30.83 71.63 Favored 'General case' 0 CA--C 1.536 0.412 0 O-C-N 121.55 -0.719 . . . . 1.48 111.601 -178.869 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 2.1 t0 -67.25 -55.21 14.93 Favored 'General case' 0 C--O 1.23 0.079 0 C-N-CA 125.306 1.442 . . . . 2.23 108.544 174.899 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 29.1 mm-40 -84.58 84.28 7.72 Favored 'General case' 0 N--CA 1.448 -0.547 0 CA-C-O 121.694 0.759 . . . . 3.2000000000000002 109.932 -178.108 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 8.5 pt -47.38 135.68 3.64 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.388 0 CA-C-N 115.225 -0.898 . . . . 5.9299999999999997 110.799 175.363 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 22.2 pttt -47.97 -31.56 5.44 Favored 'General case' 0 N--CA 1.464 0.248 0 N-CA-C 114.873 1.434 . . . . 9.8000000000000007 114.873 -172.587 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 102' ' ' PHE . . . . . . . . . . . . . 71.7 t80 28.92 74.11 0.04 OUTLIER 'General case' 0 CA--C 1.536 0.42 0 C-N-CA 127.048 2.139 . . . . 9.3499999999999996 113.294 171.707 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 14.5 tt -130.98 44.24 0.59 Allowed 'Isoleucine or valine' 0 CA--C 1.533 0.292 0 CA-C-O 121.494 0.664 . . . . 4.5700000000000003 109.359 -174.276 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 104' ' ' ILE . . . . . . . . . . . . . 48.9 mm 68.45 154.76 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.536 0.412 0 C-N-CA 125.965 1.706 . . . . 7.6799999999999997 110.577 -171.325 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 3.4 t-20 72.07 158.34 0.2 Allowed 'General case' 0 CA--C 1.537 0.458 0 C-N-CA 125.992 1.717 . . . . 8.3200000000000003 110.465 -174.513 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 13.1 p . . . . . 0 C--O 1.252 1.208 0 CA-C-O 114.831 -2.509 . . . . 12.74 107.739 -174.478 . . . . . . . . 0 0 . 1 . 023 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.471 1.014 0 N-CA-C 108.823 -1.711 . . . . 16.469999999999999 108.823 . . . . . . . . . 0 0 . 1 . 023 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 7.1 m -107.19 -62.81 1.36 Allowed 'General case' 0 C--O 1.226 -0.176 0 CA-C-N 118.106 0.953 . . . . 17.550000000000001 111.267 -169.269 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -151.21 148.25 28.0 Favored 'General case' 0 N--CA 1.454 -0.235 0 N-CA-C 105.579 -2.008 . . . . 20.489999999999998 105.579 172.456 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 43.18 75.95 0.13 Allowed Glycine 0 C--N 1.336 0.564 0 C-N-CA 124.806 1.193 . . . . 14.890000000000001 114.008 176.142 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 21.5 m -76.01 -173.48 0.15 Allowed 'Isoleucine or valine' 0 N--CA 1.443 -0.776 0 C-N-CA 119.715 -0.794 . . . . 14.59 110.629 171.578 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 31.8 mt-10 -107.33 106.57 17.07 Favored 'General case' 0 N--CA 1.448 -0.561 0 O-C-N 121.843 -0.536 . . . . 11.84 110.925 -167.773 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -84.1 33.36 0.49 Allowed 'General case' 0 CA--C 1.536 0.433 0 C-N-CA 123.198 0.599 . . . . 11.390000000000001 110.582 -173.235 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 6.3 mmm180 -143.56 -72.79 0.28 Allowed 'General case' 0 N--CA 1.45 -0.459 0 C-N-CA 127.803 2.441 . . . . 6.29 106.835 -179.693 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 23.5 m-20 -54.93 -34.67 63.41 Favored 'General case' 0 CA--C 1.516 -0.333 0 C-N-CA 123.302 0.641 . . . . 3.7999999999999998 112.442 178.337 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 20.4 t70 -66.87 -36.11 81.55 Favored 'General case' 0 C--O 1.222 -0.394 0 CA-C-N 119.176 0.898 . . . . 3.54 110.897 178.829 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 9.0 m -70.89 -51.5 25.84 Favored 'General case' 0 CA--C 1.534 0.335 0 O-C-N 121.18 -0.95 . . . . 2.7799999999999998 111.713 178.162 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 2.4 mt-10 -68.57 -28.13 66.68 Favored 'General case' 0 N--CA 1.464 0.26 0 O-C-N 121.13 -0.981 . . . . 5.79 110.853 -179.62 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -69.25 -45.71 60.24 Favored Glycine 0 CA--C 1.525 0.704 0 N-CA-C 110.585 -1.006 . . . . 1.0600000000000001 110.585 171.854 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 36.1 t80 -50.75 -51.62 48.48 Favored 'General case' 0 CA--C 1.515 -0.4 0 C-N-CA 125.191 1.396 . . . . 4.1399999999999997 109.689 -173.521 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER -62.6 -36.22 74.07 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.32 0 O-C-N 122.064 -0.398 . . . . 0.55000000000000004 111.815 -178.084 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 9.6 t60 -59.94 -55.49 33.43 Favored 'General case' 0 C--N 1.343 0.305 0 N-CA-C 107.168 -1.419 . . . . 0.47999999999999998 107.168 176.715 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 43.6 mt-10 -58.7 -32.45 69.18 Favored 'General case' 0 N--CA 1.456 -0.173 0 C-N-CA 123.463 0.705 . . . . 1.96 112.251 -179.626 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 24.8 t80 -59.94 -40.75 90.03 Favored 'General case' 0 CA--C 1.517 -0.292 0 CA-C-N 118.797 0.726 . . . . 3.8199999999999998 109.2 177.213 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -52.04 -46.98 55.5 Favored Glycine 0 CA--C 1.53 0.981 0 C-N-CA 120.622 -0.799 . . . . 0.57999999999999996 111.452 170.583 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 42.3 m-70 -58.18 -47.11 84.44 Favored 'General case' 0 N--CA 1.464 0.262 0 CA-C-N 119.119 1.46 . . . . 3.6499999999999999 111.384 176.121 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -59.43 -30.54 68.55 Favored 'General case' 0 N--CA 1.454 -0.267 0 O-C-N 122.105 -0.372 . . . . 0.83999999999999997 110.943 -178.619 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 77.1 t -72.21 -42.33 66.51 Favored 'Isoleucine or valine' 0 C--O 1.232 0.146 0 O-C-N 121.205 -0.934 . . . . 1.0700000000000001 110.5 177.581 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 23' ' ' ASP . . . . . 0.459 ' HB3' HD23 ' A' ' 37' ' ' LEU . 0.4 OUTLIER -53.57 -30.99 44.88 Favored 'General case' 0 C--N 1.329 -0.298 0 C-N-CA 123.195 0.598 . . . . 2.21 110.893 172.011 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 8.5 t70 -65.17 -51.22 62.46 Favored 'General case' 0 N--CA 1.455 -0.189 0 N-CA-C 108.522 -0.918 . . . . 2.4900000000000002 108.522 -174.003 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -52.28 -47.33 65.93 Favored 'General case' 0 CA--C 1.523 -0.092 0 C-N-CA 123.52 0.728 . . . . 2.6600000000000001 110.404 176.38 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -57.84 -39.38 77.58 Favored 'General case' 0 N--CA 1.45 -0.452 0 CA-C-O 119.312 -0.375 . . . . 1.28 111.223 179.134 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -85.53 -10.3 77.12 Favored Glycine 0 CA--C 1.526 0.764 0 CA-C-N 118.969 0.804 . . . . 1.6599999999999999 112.952 -178.725 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -80.59 -45.61 17.06 Favored 'General case' 0 N--CA 1.452 -0.354 0 CA-C-N 118.216 1.008 . . . . 3.2599999999999998 108.346 175.595 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -82.92 -35.21 26.28 Favored 'General case' 0 N--CA 1.449 -0.504 0 C-N-CA 124.925 1.29 . . . . 1.5800000000000001 112.35 -178.17 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 4.0 mt -119.79 176.57 5.33 Favored 'General case' 0 CA--C 1.535 0.395 0 N-CA-C 107.662 -1.236 . . . . 2.6099999999999999 107.662 -172.311 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 70.4 m-20 52.45 -132.97 1.88 Allowed 'General case' 0 CA--C 1.534 0.346 0 C-N-CA 124.094 0.957 . . . . 5.2000000000000002 112.076 177.68 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . 0.474 ' CA ' ' HE3' ' A' ' 32' ' ' LYS . 0.0 OUTLIER -113.54 117.31 31.3 Favored 'General case' 0 C--N 1.341 0.235 0 CA-C-N 120.595 1.543 . . . . 7.5800000000000001 108.127 178.775 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 39.8 t30 -74.52 78.0 1.95 Allowed 'General case' 0 N--CA 1.454 -0.251 0 O-C-N 121.834 -0.542 . . . . 12.68 110.938 177.509 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 20.7 tt0 -162.38 56.25 0.23 Allowed 'General case' 0 CA--C 1.533 0.315 0 N-CA-C 109.63 -0.507 . . . . 10.42 109.63 168.714 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 1.5 t 66.04 63.67 0.56 Allowed 'General case' 0 CA--C 1.533 0.315 0 CA-C-O 121.95 0.881 . . . . 9.4600000000000009 110.798 -179.662 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 50.6 t0 -121.94 -52.5 1.99 Allowed 'General case' 0 C--O 1.234 0.254 0 C-N-CA 125.181 1.392 . . . . 6.0899999999999999 108.77 -174.507 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . 0.459 HD23 ' HB3' ' A' ' 23' ' ' ASP . 4.8 mp 68.3 166.37 0.25 Allowed 'General case' 0 CA--C 1.536 0.406 0 C-N-CA 126.453 1.901 . . . . 2.0 108.674 179.394 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 10.9 p -84.7 39.89 0.05 OUTLIER 'Isoleucine or valine' 0 N--CA 1.471 0.598 0 O-C-N 120.342 -1.474 . . . . 2.1899999999999999 110.592 -174.195 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 33.0 p -90.64 -61.75 1.61 Allowed 'General case' 0 N--CA 1.448 -0.57 0 CA-C-O 123.224 1.487 . . . . 3.75 109.215 -162.09 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 10.6 p30 -83.51 -10.26 58.44 Favored 'General case' 0 N--CA 1.449 -0.491 0 C-N-CA 124.863 1.265 . . . . 7.4299999999999997 111.88 -174.748 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 45.4 m -132.09 80.13 1.9 Allowed 'General case' 0 C--O 1.224 -0.285 0 C-N-CA 123.655 0.782 . . . . 5.8499999999999996 110.103 -174.641 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 11.3 tmtt? -144.84 -63.4 0.35 Allowed 'General case' 0 CA--C 1.519 -0.215 0 O-C-N 121.328 -0.857 . . . . 5.8200000000000003 109.692 173.585 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 29.3 tttt -141.0 67.92 1.35 Allowed 'General case' 0 C--O 1.222 -0.371 0 N-CA-C 108.179 -1.045 . . . . 6.1100000000000003 108.179 175.178 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER 37.5 46.0 0.63 Allowed 'General case' 0 CA--C 1.541 0.614 0 C-N-CA 125.346 1.458 . . . . 5.5099999999999998 113.202 176.605 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER 34.28 57.22 0.15 Allowed 'Isoleucine or valine' 0 CA--C 1.541 0.614 0 C-N-CA 126.29 1.836 . . . . 2.79 113.27 -172.501 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 9.1 t70 -76.36 -63.27 1.37 Allowed 'General case' 0 CA--C 1.529 0.147 0 C-N-CA 125.611 1.564 . . . . 2.52 110.057 177.547 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 3.6 mm -51.1 -59.65 1.19 Allowed 'Isoleucine or valine' 0 CA--C 1.535 0.396 0 C-N-CA 125.81 1.644 . . . . 0.56000000000000005 109.321 -174.067 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 24.8 t80 -54.94 -34.67 63.44 Favored 'General case' 0 C--N 1.329 -0.316 0 O-C-N 121.365 -0.835 . . . . 0.51000000000000001 112.558 177.878 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . 0.56 ' HA ' ' HE2' ' A' ' 49' ' ' LYS . 0.1 OUTLIER -65.59 -40.54 92.81 Favored 'General case' 0 N--CA 1.452 -0.356 0 O-C-N 120.365 -1.459 . . . . 1.05 111.581 -176.127 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 4.9 tp10 -89.68 -65.78 0.98 Allowed 'General case' 0 N--CA 1.452 -0.362 0 N-CA-C 108.834 -0.802 . . . . 2.1200000000000001 108.834 -178.719 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . 0.403 ' OE1' ' HE2' ' A' ' 91' ' ' LYS . 9.9 mp0 -68.49 -27.71 66.37 Favored 'General case' 0 C--O 1.234 0.285 0 O-C-N 121.478 -0.764 . . . . 3.0899999999999999 111.109 -171.795 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . 0.415 ' HA2' ' CD1' ' A' ' 66' ' ' PHE . . . -67.99 37.29 0.24 Allowed Glycine 0 CA--C 1.53 1.01 0 C-N-CA 125.254 1.407 . . . . 0.34000000000000002 114.018 169.81 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 59.6 p -146.62 20.77 1.32 Allowed 'General case' 0 N--CA 1.448 -0.559 0 O-C-N 120.695 -1.473 . . . . 2.0699999999999998 111.485 159.996 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 46.8 t30 -130.93 -38.34 1.26 Allowed 'General case' 0 C--N 1.342 0.245 0 N-CA-C 112.954 0.724 . . . . 1.8300000000000001 112.954 -165.227 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 22.9 mt -68.36 -36.23 78.91 Favored 'General case' 0 N--CA 1.463 0.198 0 O-C-N 121.434 -0.791 . . . . 0.56999999999999995 110.615 -178.36 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 1.4 t 176.93 169.95 0.52 Allowed 'General case' 0 CA--C 1.53 0.189 0 C-N-CA 125.313 1.445 . . . . 0.56999999999999995 108.043 -175.155 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 8.2 m -61.24 -31.3 71.09 Favored 'General case' 0 N--CA 1.453 -0.285 0 C-N-CA 123.466 0.707 . . . . 1.02 110.909 170.296 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -64.63 -23.13 67.16 Favored 'General case' 0 N--CA 1.464 0.237 0 CA-C-O 121.089 0.471 . . . . 1.01 111.253 173.269 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -74.51 -12.77 82.23 Favored Glycine 0 N--CA 1.443 -0.89 0 CA-C-O 118.722 -1.044 . . . . 0.46999999999999997 111.313 175.156 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 60.0 ttt-85 -110.02 -16.01 13.92 Favored 'General case' 0 C--O 1.23 0.075 0 CA-C-N 119.177 1.489 . . . . 2.3399999999999999 112.76 -177.623 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 1.5 p -60.71 -169.21 0.01 OUTLIER 'General case' 0 CA--C 1.536 0.436 0 C-N-CA 122.487 0.315 . . . . 0.91000000000000003 110.281 166.645 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 5.3 m120 -45.92 147.29 1.02 Allowed 'General case' 0 C--N 1.341 0.211 0 O-C-N 121.346 -0.846 . . . . 2.0899999999999999 111.065 179.606 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 14.1 tm-20 -61.44 -28.89 69.59 Favored 'General case' 0 CA--C 1.533 0.321 0 CA-C-O 120.649 0.261 . . . . 3.3799999999999999 111.017 -173.999 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -52.36 -37.15 55.49 Favored 'General case' 0 CA--C 1.52 -0.203 0 N-CA-C 113.414 0.894 . . . . 0.48999999999999999 113.414 171.854 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 2.3 mm-40 -84.89 -35.96 21.83 Favored 'General case' 0 C--N 1.322 -0.613 0 C-N-CA 124.468 1.107 . . . . 2.5899999999999999 110.039 -173.84 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 66' ' ' PHE . . . . . 0.415 ' CD1' ' HA2' ' A' ' 52' ' ' GLY . 67.9 t80 -53.02 -50.47 64.2 Favored 'General case' 0 N--CA 1.453 -0.284 0 C-N-CA 124.403 1.081 . . . . 0.32000000000000001 111.219 166.555 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 77.5 t80 -63.03 -48.14 80.03 Favored 'General case' 0 CA--C 1.535 0.375 0 O-C-N 121.237 -0.915 . . . . 0.38 110.432 178.424 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -61.66 -53.47 55.67 Favored 'General case' 0 CA--C 1.536 0.426 0 N-CA-C 114.106 1.151 . . . . 0.45000000000000001 114.106 -176.524 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -58.81 -40.23 83.48 Favored 'General case' 0 C--N 1.329 -0.29 0 O-C-N 121.019 -1.051 . . . . 3.6899999999999999 110.821 174.094 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -55.93 -42.04 75.51 Favored 'General case' 0 C--O 1.222 -0.35 0 CA-C-N 118.52 0.6 . . . . 0.60999999999999999 110.326 174.258 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -54.56 -51.44 65.23 Favored 'General case' 0 N--CA 1.464 0.229 0 C-N-CA 123.943 0.897 . . . . 3.1400000000000001 111.375 172.45 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 52.2 ttt-85 -51.96 -50.13 61.83 Favored 'General case' 0 N--CA 1.462 0.148 0 CA-C-N 117.918 0.326 . . . . 2.2000000000000002 110.206 179.363 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . 0.503 ' CB ' HG21 ' A' ' 85' ' ' VAL . 0.1 OUTLIER -68.7 -30.81 69.55 Favored 'General case' 0 C--N 1.328 -0.351 0 C-N-CA 124.389 1.075 . . . . 0.56000000000000005 110.938 -178.388 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 2.4 ttp -63.73 -34.54 78.1 Favored 'General case' 0 N--CA 1.454 -0.244 0 C-N-CA 123.267 0.627 . . . . 2.6299999999999999 111.059 -174.614 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 10.0 p80 -99.21 1.46 44.85 Favored 'General case' 0 CA--C 1.531 0.227 0 CA-C-O 116.663 -1.637 . . . . 1.22 113.724 178.679 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 6.7 m -42.31 120.37 1.62 Allowed 'General case' 0 C--N 1.343 0.304 0 CA-C-N 120.573 1.533 . . . . 1.26 110.473 -171.843 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 2.7 p -48.34 -43.88 33.79 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 113.744 -1.571 . . . . 1.3100000000000001 109.064 178.449 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 11.7 t0 -69.72 105.91 2.9 Favored 'General case' 0 N--CA 1.446 -0.652 0 CA-C-O 122.006 0.908 . . . . 1.99 109.291 163.942 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 49.4 p-80 -49.38 -38.4 28.46 Favored 'General case' 0 N--CA 1.453 -0.285 0 CA-C-N 115.476 -0.784 . . . . 4.3399999999999999 111.98 173.605 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -61.52 -42.41 98.77 Favored 'General case' 0 C--N 1.331 -0.209 0 O-C-N 121.689 -0.632 . . . . 1.0700000000000001 110.778 -177.741 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 81' ' ' GLU . . . . . 0.423 ' HA ' ' HD3' ' A' ' 84' ' ' LYS . 18.7 mm-40 -53.77 -36.87 62.86 Favored 'General case' 0 N--CA 1.451 -0.424 0 C-N-CA 123.183 0.593 . . . . 4.4100000000000001 111.964 175.429 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 14.6 mtp180 -65.06 -46.26 81.93 Favored 'General case' 0 C--N 1.325 -0.471 0 C-N-CA 119.022 -1.071 . . . . 2.3199999999999998 108.683 176.861 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 1.6 mm? -62.29 -23.17 66.58 Favored 'General case' 0 N--CA 1.455 -0.195 0 CA-C-O 117.724 -1.132 . . . . 0.46999999999999997 112.909 175.88 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 84' ' ' LYS . . . . . 0.423 ' HD3' ' HA ' ' A' ' 81' ' ' GLU . 2.4 mptm? -60.98 -46.15 91.93 Favored 'General case' 0 CA--C 1.516 -0.329 0 CA-C-N 120.922 1.692 . . . . 1.3799999999999999 108.18 169.891 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 85' ' ' VAL . . . . . 0.503 HG21 ' CB ' ' A' ' 73' ' ' LEU . 90.3 t -62.12 -61.08 1.79 Allowed 'Isoleucine or valine' 0 N--CA 1.45 -0.463 0 CA-C-O 118.141 -0.933 . . . . 0.42999999999999999 109.951 176.448 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 2.5 mt-30 -50.03 -49.67 50.16 Favored 'General case' 0 CA--C 1.53 0.183 0 CA-C-N 119.842 1.201 . . . . 1.8999999999999999 111.88 -173.058 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 13.2 ptpt -65.99 -40.37 91.12 Favored 'General case' 0 N--CA 1.456 -0.157 0 O-C-N 121.896 -0.503 . . . . 4.0999999999999996 111.055 -176.227 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 52.1 m-20 -79.43 -10.78 59.88 Favored 'General case' 0 N--CA 1.461 0.105 0 N-CA-C 112.051 0.389 . . . . 1.77 112.051 -179.694 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -155.7 71.48 5.38 Favored Pre-proline 0 N--CA 1.446 -0.64 0 C-N-CA 124.409 1.084 . . . . 0.42999999999999999 109.413 -170.568 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 76.5 Cg_endo -81.13 60.49 7.85 Favored 'Trans proline' 0 N--CA 1.459 -0.552 0 C-N-CA 124.506 3.471 . . . . 1.7 110.822 -173.769 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 91' ' ' LYS . . . . . 0.403 ' HE2' ' OE1' ' A' ' 51' ' ' GLU . 5.4 ptmt 175.03 -51.52 0.01 OUTLIER 'General case' 0 C--O 1.224 -0.287 0 C-N-CA 126.986 2.114 . . . . 2.1400000000000001 109.716 -170.202 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 2.9 m -57.34 -44.93 84.67 Favored 'General case' 0 CA--C 1.522 -0.116 0 CA-C-N 119.286 0.948 . . . . 0.39000000000000001 110.245 176.946 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 8.0 t80 -59.25 -47.46 85.27 Favored 'General case' 0 CA--C 1.506 -0.716 0 C-N-CA 120.309 -0.557 . . . . 1.95 110.391 177.709 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 54.4 tt0 -57.34 -33.83 68.16 Favored 'General case' 0 N--CA 1.44 -0.946 0 CA-C-N 115.173 -0.921 . . . . 1.75 110.594 178.085 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 6.2 t80 -62.63 -54.49 38.69 Favored 'General case' 0 C--N 1.333 -0.117 0 N-CA-C 108.645 -0.872 . . . . 1.1499999999999999 108.645 -175.016 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 3.0 mp -60.34 -42.05 89.39 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.37 0 N-CA-C 108.475 -0.935 . . . . 0.82999999999999996 108.475 176.677 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 3.2 t30 -62.32 -25.99 68.18 Favored 'General case' 0 CA--C 1.535 0.377 0 CA-C-N 118.413 0.551 . . . . 1.46 111.857 -177.305 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 7.8 t70 -74.79 -43.15 56.31 Favored 'General case' 0 C--O 1.228 -0.07 0 C-N-CA 124.627 1.171 . . . . 2.1699999999999999 109.202 176.609 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 45.0 mm-40 -68.71 -54.61 15.1 Favored 'General case' 0 N--CA 1.451 -0.421 0 CA-C-N 115.591 -0.731 . . . . 3.02 111.007 -175.95 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 9.0 tp -71.3 113.37 7.65 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.44 0 N-CA-C 108.581 -0.896 . . . . 6.0499999999999998 108.581 -174.316 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 23.5 tttt -146.6 -55.39 0.26 Allowed 'General case' 0 N--CA 1.453 -0.289 0 N-CA-C 108.626 -0.879 . . . . 9.4299999999999997 108.626 -179.721 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 102' ' ' PHE . . . . . . . . . . . . . 7.9 p90 -145.99 121.81 10.59 Favored 'General case' 0 N--CA 1.45 -0.45 0 N-CA-C 106.604 -1.628 . . . . 8.3300000000000001 106.604 174.699 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -152.84 129.15 1.83 Allowed 'Isoleucine or valine' 0 N--CA 1.448 -0.536 0 N-CA-C 105.356 -2.09 . . . . 3.7200000000000002 105.356 174.345 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 104' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER 29.63 78.19 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.539 0.528 0 C-N-CA 127.487 2.315 . . . . 5.4199999999999999 112.711 -178.646 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 3.2 m120 -53.68 128.32 29.02 Favored 'General case' 0 C--O 1.232 0.135 0 CA-C-N 116.065 -0.516 . . . . 9.5399999999999991 109.887 176.779 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 27.4 t . . . . . 0 C--O 1.252 1.212 0 C-N-CA 125.312 1.445 . . . . 9.5600000000000005 107.225 177.532 . . . . . . . . 0 0 . 1 . 024 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.472 1.063 0 N-CA-C 110.232 -1.147 . . . . 13.15 110.232 . . . . . . . . . 0 0 . 1 . 024 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 4.2 m -159.13 -30.88 0.07 Allowed 'General case' 0 N--CA 1.468 0.445 0 CA-C-N 118.274 1.037 . . . . 14.539999999999999 112.729 178.203 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -145.84 163.12 36.04 Favored 'General case' 0 N--CA 1.45 -0.429 0 N-CA-C 106.879 -1.526 . . . . 17.100000000000001 106.879 176.388 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 150.23 179.62 26.18 Favored Glycine 0 N--CA 1.45 -0.374 0 N-CA-C 108.605 -1.798 . . . . 14.609999999999999 108.605 -178.936 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . 0.415 HG23 ' CD1' ' A' ' 7' ' ' LEU . 0.0 OUTLIER -72.45 -176.68 0.21 Allowed 'Isoleucine or valine' 0 N--CA 1.449 -0.505 0 CA-C-O 121.584 0.707 . . . . 15.6 111.097 173.067 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 9.9 pt-20 -89.91 111.01 21.93 Favored 'General case' 0 N--CA 1.442 -0.83 0 CA-C-O 122.999 1.381 . . . . 11.82 110.878 179.389 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . 0.448 ' H ' HD22 ' A' ' 7' ' ' LEU . 0.0 OUTLIER -151.04 47.58 0.84 Allowed 'General case' 0 N--CA 1.447 -0.59 0 C-N-CA 126.414 1.886 . . . . 9.8100000000000005 107.306 178.205 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 9.6 mtp85 59.36 37.62 23.28 Favored 'General case' 0 CA--C 1.532 0.276 0 C-N-CA 123.59 0.756 . . . . 6.6799999999999997 111.814 -176.381 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -49.65 -37.17 27.25 Favored 'General case' 0 N--CA 1.468 0.475 0 C-N-CA 124.628 1.171 . . . . 4.1200000000000001 111.568 175.99 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 4.2 t70 -59.71 -53.04 62.64 Favored 'General case' 0 N--CA 1.446 -0.648 0 C-N-CA 123.466 0.706 . . . . 2.46 111.163 175.79 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 5.1 t -66.79 -52.15 47.4 Favored 'General case' 0 N--CA 1.452 -0.364 0 CA-C-O 121.365 0.602 . . . . 1.8899999999999999 109.911 -173.226 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 9.7 pt-20 -70.39 -30.98 68.02 Favored 'General case' 0 C--O 1.227 -0.09 0 O-C-N 121.817 -0.552 . . . . 4.4199999999999999 109.593 -178.835 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -60.73 -42.21 99.32 Favored Glycine 0 N--CA 1.448 -0.537 0 N-CA-C 110.385 -1.086 . . . . 1.1299999999999999 110.385 174.443 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -58.23 -57.47 12.74 Favored 'General case' 0 N--CA 1.455 -0.193 0 CA-C-O 122.071 0.939 . . . . 2.8100000000000001 109.17 -176.532 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER -71.4 -29.3 34.86 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.453 0 CA-C-N 115.867 -0.606 . . . . 0.85999999999999999 111.641 -176.249 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 3.9 t60 -59.96 -53.37 58.69 Favored 'General case' 0 N--CA 1.453 -0.303 0 N-CA-C 106.749 -1.575 . . . . 0.92000000000000004 106.749 176.759 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 13.0 mm-40 -63.37 -30.72 71.8 Favored 'General case' 0 N--CA 1.449 -0.501 0 CA-C-O 117.943 -1.027 . . . . 4.5999999999999996 111.672 -177.13 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 1.0 OUTLIER -53.37 -54.55 35.01 Favored 'General case' 0 N--CA 1.464 0.24 0 CA-C-N 119.975 1.261 . . . . 2.46 111.085 168.042 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -48.81 -47.19 31.3 Favored Glycine 0 CA--C 1.524 0.594 0 N-CA-C 109.808 -1.317 . . . . 0.95999999999999996 109.808 174.997 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 1.8 t-160 -63.28 -41.65 99.03 Favored 'General case' 0 N--CA 1.447 -0.577 0 N-CA-C 113.295 0.85 . . . . 1.75 113.295 -176.565 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -65.93 -30.98 71.65 Favored 'General case' 0 N--CA 1.449 -0.506 0 C-N-CA 123.734 0.814 . . . . 1.22 109.238 -178.759 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 93.5 t -68.52 -37.1 77.25 Favored 'Isoleucine or valine' 0 C--O 1.233 0.222 0 C-N-CA 118.57 -1.252 . . . . 1.3200000000000001 110.27 173.589 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 1.7 t70 -61.99 -24.92 67.32 Favored 'General case' 0 C--N 1.331 -0.217 0 N-CA-C 111.968 0.359 . . . . 2.0499999999999998 111.968 173.291 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 24.8 t70 -67.98 -51.79 43.26 Favored 'General case' 0 C--O 1.221 -0.413 0 N-CA-C 108.6 -0.889 . . . . 2.1899999999999999 108.6 -176.396 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 25' ' ' TYR . . . . . 0.403 ' CE1' HD21 ' A' ' 29' ' ' LEU . 35.6 t80 -50.43 -55.01 17.7 Favored 'General case' 0 CA--C 1.522 -0.129 0 C-N-CA 123.485 0.714 . . . . 4.2800000000000002 110.332 172.892 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -54.72 -40.84 69.64 Favored 'General case' 0 N--CA 1.451 -0.388 0 C-N-CA 119.963 -0.695 . . . . 1.79 111.353 -177.916 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -65.92 -54.11 26.73 Favored Glycine 0 C--N 1.336 0.547 0 CA-C-N 119.318 0.963 . . . . 1.6000000000000001 111.593 178.416 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 28' ' ' TYR . . . . . 0.437 ' HB3' HD22 ' A' ' 29' ' ' LEU . 0.2 OUTLIER -44.71 -42.35 7.55 Favored 'General case' 0 N--CA 1.456 -0.171 0 C-N-CA 126.223 1.809 . . . . 3.6400000000000001 111.13 -179.29 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . 0.437 HD22 ' HB3' ' A' ' 28' ' ' TYR . 3.3 mm? -90.94 -25.43 19.77 Favored 'General case' 0 N--CA 1.446 -0.631 0 CA-C-O 118.637 -0.697 . . . . 3.0699999999999998 112.482 -177.82 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 14.5 mt -130.49 72.2 1.49 Allowed 'General case' 0 CA--C 1.534 0.334 0 CA-C-N 118.953 0.797 . . . . 3.7999999999999998 110.187 -168.899 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 5.5 t0 -136.32 156.42 48.67 Favored 'General case' 0 N--CA 1.462 0.153 0 N-CA-C 108.129 -1.063 . . . . 6.3700000000000001 108.129 171.003 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -137.08 23.75 3.03 Favored 'General case' 0 CA--C 1.536 0.422 0 C-N-CA 124.545 1.138 . . . . 10.17 109.264 -178.769 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 8.9 t-20 -139.75 -178.9 5.63 Favored 'General case' 0 CA--C 1.536 0.423 0 C-N-CA 125.09 1.356 . . . . 7.5 108.62 -175.933 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -82.44 -6.88 59.57 Favored 'General case' 0 CA--C 1.535 0.402 0 CA-C-N 118.817 0.735 . . . . 10.16 111.098 173.095 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 3.5 t -66.92 -174.72 0.35 Allowed 'General case' 0 CA--C 1.535 0.385 0 CA-C-N 118.338 0.517 . . . . 6.1200000000000001 110.702 173.389 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 9.2 t0 -150.12 165.41 32.89 Favored 'General case' 0 CA--C 1.534 0.334 0 N-CA-C 107.932 -1.136 . . . . 6.8799999999999999 107.932 175.381 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 1.1 mt 70.24 141.19 0.05 OUTLIER 'General case' 0 N--CA 1.465 0.293 0 C-N-CA 127.755 2.422 . . . . 3.02 110.47 -172.076 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 7.5 p -71.27 7.65 0.42 Allowed 'Isoleucine or valine' 0 CA--C 1.544 0.72 0 O-C-N 120.698 -1.251 . . . . 3.3599999999999999 112.576 -176.404 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 14.2 t -53.72 -19.73 4.55 Favored 'General case' 0 CA--C 1.533 0.321 0 C-N-CA 125.44 1.496 . . . . 4.7699999999999996 113.038 176.662 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 49.8 p30 -91.97 17.81 8.78 Favored 'General case' 0 CA--C 1.533 0.32 0 C-N-CA 123.785 0.834 . . . . 9.0299999999999994 112.079 -179.268 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 4.8 t -158.6 -63.31 0.08 Allowed 'General case' 0 N--CA 1.456 -0.148 0 O-C-N 121.666 -0.646 . . . . 4.21 109.663 -175.496 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . 0.434 ' HA ' ' HE3' ' A' ' 42' ' ' LYS . 0.1 OUTLIER 42.72 43.98 3.57 Favored 'General case' 0 N--CA 1.454 -0.229 0 C-N-CA 126.205 1.802 . . . . 11.25 111.749 -172.257 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 73.31 -65.84 0.34 Allowed 'General case' 0 N--CA 1.468 0.461 0 C-N-CA 124.299 1.04 . . . . 11.51 109.566 178.133 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 16.5 m-85 -140.28 131.3 26.24 Favored 'General case' 0 N--CA 1.453 -0.304 0 CA-C-N 119.158 0.89 . . . . 8.1199999999999992 109.123 169.602 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 0.6 OUTLIER -81.78 69.39 0.56 Allowed 'Isoleucine or valine' 0 CA--C 1.542 0.65 0 CA-C-O 121.751 0.786 . . . . 2.79 108.912 176.548 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 5.0 t70 -127.67 -54.75 1.33 Allowed 'General case' 0 N--CA 1.47 0.553 0 C-N-CA 126.154 1.782 . . . . 2.54 108.557 -179.397 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 47' ' ' ILE . . . . . 0.507 HD13 ' HE2' ' A' ' 91' ' ' LYS . 5.1 mm -49.17 -56.15 3.03 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.478 0 C-N-CA 125.976 1.71 . . . . 0.71999999999999997 108.229 176.903 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 26.4 t80 -63.38 -30.35 71.5 Favored 'General case' 0 C--N 1.328 -0.351 0 O-C-N 120.51 -1.369 . . . . 0.94999999999999996 113.052 175.803 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . 0.498 ' HA ' ' HE2' ' A' ' 49' ' ' LYS . 0.4 OUTLIER -63.67 -50.72 68.13 Favored 'General case' 0 C--N 1.33 -0.252 0 O-C-N 120.138 -1.601 . . . . 1.72 110.76 -178.898 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 17.3 tt0 -90.63 -53.41 4.43 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.957 0.408 . . . . 3.7799999999999998 110.024 -171.823 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 10.0 mp0 -74.07 -29.66 61.99 Favored 'General case' 0 C--O 1.235 0.303 0 O-C-N 121.249 -0.907 . . . . 2.7799999999999998 110.6 -176.978 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . 0.445 ' HA2' ' CD1' ' A' ' 66' ' ' PHE . . . -71.16 33.69 0.53 Allowed Glycine 0 CA--C 1.528 0.878 0 C-N-CA 124.613 1.101 . . . . 0.62 114.306 173.462 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 44.7 t -149.15 43.19 0.95 Allowed 'General case' 0 N--CA 1.447 -0.595 0 N-CA-C 107.678 -1.231 . . . . 1.6899999999999999 107.678 158.592 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -145.4 -44.41 0.22 Allowed 'General case' 0 CA--C 1.518 -0.286 0 N-CA-C 113.226 0.824 . . . . 2.1400000000000001 113.226 -176.436 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 19.3 mt -55.72 -40.63 72.7 Favored 'General case' 0 N--CA 1.462 0.16 0 CA-C-O 121.118 0.485 . . . . 0.46000000000000002 111.445 -174.879 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 56' ' ' THR . . . . . 0.4 HG23 ' H ' ' A' ' 59' ' ' GLY . 0.0 OUTLIER -179.79 162.1 1.03 Allowed 'General case' 0 C--N 1.329 -0.309 0 N-CA-C 106.855 -1.535 . . . . 0.45000000000000001 106.855 -178.254 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 74.3 m -59.11 -33.47 70.88 Favored 'General case' 0 N--CA 1.456 -0.151 0 O-C-N 122.155 -0.341 . . . . 1.3100000000000001 110.235 171.779 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 58' ' ' TYR . . . . . 0.406 ' O ' HG22 ' A' ' 61' ' ' THR . 0.1 OUTLIER -61.71 -39.51 91.74 Favored 'General case' 0 C--O 1.226 -0.161 0 O-C-N 121.786 -0.571 . . . . 1.1699999999999999 110.255 177.149 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A ' 59' ' ' GLY . . . . . 0.4 ' H ' HG23 ' A' ' 56' ' ' THR . . . -74.44 -2.02 62.44 Favored Glycine 0 CA--C 1.526 0.737 0 C-N-CA 123.613 0.625 . . . . 0.88 112.313 -179.956 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 59.9 ttt180 -97.33 -7.13 32.71 Favored 'General case' 0 N--CA 1.452 -0.361 0 CA-C-N 117.965 0.883 . . . . 4.1399999999999997 111.561 174.46 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 61' ' ' THR . . . . . 0.457 HG23 ' N ' ' A' ' 62' ' ' ASN . 1.6 t -63.53 -167.24 0.02 OUTLIER 'General case' 0 CA--C 1.53 0.18 0 CA-C-O 121.574 0.702 . . . . 3.4300000000000002 110.233 166.908 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 62' ' ' ASN . . . . . 0.457 ' N ' HG23 ' A' ' 61' ' ' THR . 2.3 m120 -46.71 150.56 0.69 Allowed 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 121.279 0.561 . . . . 2.5899999999999999 111.166 170.344 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 12.6 tm-20 -53.87 -24.38 15.7 Favored 'General case' 0 CA--C 1.537 0.451 0 C-N-CA 124.098 0.959 . . . . 4.2800000000000002 111.667 -177.877 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -47.11 -57.46 5.06 Favored 'General case' 0 N--CA 1.45 -0.465 0 C-N-CA 125.215 1.406 . . . . 0.83999999999999997 113.738 169.763 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 3.3 mt-10 -85.55 -19.49 31.04 Favored 'General case' 0 CA--C 1.514 -0.434 0 C-N-CA 118.01 -1.476 . . . . 3.1699999999999999 110.798 -175.824 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 66' ' ' PHE . . . . . 0.445 ' CD1' ' HA2' ' A' ' 52' ' ' GLY . 68.3 t80 -55.35 -51.56 66.39 Favored 'General case' 0 N--CA 1.449 -0.497 0 CA-C-N 118.277 0.49 . . . . 0.51000000000000001 110.117 166.883 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 87.7 t80 -69.24 -47.17 65.49 Favored 'General case' 0 N--CA 1.445 -0.692 0 C-N-CA 123.58 0.752 . . . . 0.52000000000000002 110.188 -176.981 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -65.18 -45.93 82.85 Favored 'General case' 0 CA--C 1.538 0.493 0 O-C-N 121.757 -0.589 . . . . 0.53000000000000003 111.575 -175.747 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 9.4 mm-40 -61.37 -42.21 98.34 Favored 'General case' 0 N--CA 1.462 0.151 0 O-C-N 121.175 -0.953 . . . . 4.7599999999999998 110.541 171.442 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -57.36 -41.16 79.59 Favored 'General case' 0 C--O 1.224 -0.285 0 O-C-N 121.25 -0.906 . . . . 0.45000000000000001 110.23 -179.715 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 51.1 t80 -59.66 -50.13 75.06 Favored 'General case' 0 C--O 1.231 0.083 0 CA-C-N 118.777 0.717 . . . . 3.5499999999999998 111.0 174.769 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 34.4 ttt180 -47.63 -58.23 4.52 Favored 'General case' 0 N--CA 1.465 0.292 0 O-C-N 121.755 -0.59 . . . . 2.2599999999999998 109.902 176.281 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . 0.606 ' CB ' HG21 ' A' ' 85' ' ' VAL . 0.1 OUTLIER -64.23 -27.45 69.06 Favored 'General case' 0 C--N 1.329 -0.325 0 C-N-CA 125.376 1.471 . . . . 0.62 110.923 -177.101 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 1.7 ttp -58.99 -42.97 91.31 Favored 'General case' 0 N--CA 1.452 -0.365 0 C-N-CA 123.12 0.568 . . . . 2.5299999999999998 110.772 -178.358 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 17.0 p80 -93.55 -37.56 11.84 Favored 'General case' 0 C--O 1.225 -0.23 0 CA-C-O 115.576 -2.154 . . . . 1.6399999999999999 112.34 179.792 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 2.6 m 4.19 112.22 0.0 OUTLIER 'General case' 0 N--CA 1.471 0.579 0 C-N-CA 128.285 2.634 . . . . 1.1499999999999999 115.099 -176.238 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 2.0 p -43.65 -44.32 6.3 Favored 'General case' 0 N--CA 1.452 -0.354 0 C-N-CA 125.628 1.571 . . . . 1.4399999999999999 111.571 177.576 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 56.9 t0 -73.98 105.36 5.19 Favored 'General case' 0 N--CA 1.454 -0.264 0 C-N-CA 117.495 -1.682 . . . . 2.3300000000000001 108.827 166.639 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 4.1 p-80 -39.91 -39.12 0.78 Allowed 'General case' 0 CA--C 1.531 0.231 0 C-N-CA 124.355 1.062 . . . . 5.2800000000000002 112.665 170.616 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -60.86 -44.61 96.8 Favored 'General case' 0 N--CA 1.449 -0.497 0 CA-C-O 118.983 -0.532 . . . . 1.0800000000000001 110.752 -177.582 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -52.44 -38.83 60.12 Favored 'General case' 0 CA--C 1.518 -0.251 0 CA-C-O 121.222 0.534 . . . . 3.8900000000000001 110.522 177.83 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -64.82 -48.52 74.07 Favored 'General case' 0 N--CA 1.451 -0.381 0 N-CA-C 108.595 -0.891 . . . . 3.2999999999999998 108.595 179.799 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 1.6 mm? -62.69 -25.72 68.3 Favored 'General case' 0 N--CA 1.454 -0.233 0 CA-C-O 118.132 -0.937 . . . . 1.24 112.724 175.99 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 14.8 mttt -65.18 -44.09 89.58 Favored 'General case' 0 CA--C 1.518 -0.261 0 CA-C-N 120.528 1.513 . . . . 1.45 108.084 174.256 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 85' ' ' VAL . . . . . 0.606 HG21 ' CB ' ' A' ' 73' ' ' LEU . 96.6 t -63.19 -60.18 3.18 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.544 0 CA-C-O 117.295 -1.336 . . . . 0.51000000000000001 111.191 173.605 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 24.1 mt-30 -49.91 -51.11 43.32 Favored 'General case' 0 N--CA 1.463 0.189 0 CA-C-N 121.425 1.921 . . . . 2.3399999999999999 111.827 -177.277 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.92 -37.65 88.36 Favored 'General case' 0 CA--C 1.531 0.234 0 O-C-N 121.545 -0.722 . . . . 2.4199999999999999 110.933 -175.656 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 83.0 m-20 -85.45 -5.78 59.26 Favored 'General case' 0 CA--C 1.531 0.237 0 CA-C-N 118.091 0.405 . . . . 1.1299999999999999 111.134 179.869 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -159.93 74.34 3.07 Favored Pre-proline 0 N--CA 1.446 -0.629 0 C-N-CA 125.016 1.326 . . . . 0.34999999999999998 109.482 -173.903 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 85.3 Cg_endo -82.05 50.78 3.57 Favored 'Trans proline' 0 CA--C 1.536 0.582 0 C-N-CA 124.294 3.329 . . . . 1.6499999999999999 110.96 -175.479 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 91' ' ' LYS . . . . . 0.507 ' HE2' HD13 ' A' ' 47' ' ' ILE . 0.1 OUTLIER -169.1 -57.57 0.02 OUTLIER 'General case' 0 N--CA 1.451 -0.393 0 C-N-CA 126.777 2.031 . . . . 2.3100000000000001 108.28 -174.189 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 3.9 m -50.15 -45.5 53.27 Favored 'General case' 0 N--CA 1.464 0.226 0 C-N-CA 123.835 0.854 . . . . 0.47999999999999998 112.276 178.02 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 16.6 t80 -57.31 -50.75 71.94 Favored 'General case' 0 CA--C 1.512 -0.507 0 CA-C-O 121.843 0.83 . . . . 2.5699999999999998 110.712 179.03 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 23.2 tt0 -60.19 -28.33 67.88 Favored 'General case' 0 N--CA 1.441 -0.908 0 CA-C-N 114.221 -1.354 . . . . 2.8300000000000001 110.007 -179.083 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 4.5 t80 -65.73 -55.75 15.69 Favored 'General case' 0 N--CA 1.452 -0.354 0 C-N-CA 124.364 1.065 . . . . 1.1699999999999999 110.205 -177.754 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 2.8 mp -56.67 -45.1 82.54 Favored 'Isoleucine or valine' 0 C--O 1.228 -0.068 0 N-CA-C 107.961 -1.125 . . . . 0.82999999999999996 107.961 176.34 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 5.3 t30 -58.24 -33.08 68.97 Favored 'General case' 0 CA--C 1.538 0.516 0 N-CA-C 111.962 0.356 . . . . 1.6200000000000001 111.962 -178.891 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 28.8 t70 -71.31 -44.07 65.86 Favored 'General case' 0 CA--C 1.517 -0.306 0 C-N-CA 125.203 1.401 . . . . 1.97 110.777 178.459 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 11.7 mm100 -83.42 54.05 2.7 Favored 'General case' 0 CA--C 1.537 0.45 0 CA-C-O 121.486 0.66 . . . . 3.48 110.306 -172.806 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -70.85 116.78 12.95 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.43 0 O-C-N 121.389 -0.819 . . . . 4.0300000000000002 108.814 -176.193 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 20.8 tttp -150.92 140.23 21.34 Favored 'General case' 0 N--CA 1.454 -0.228 0 N-CA-C 106.562 -1.644 . . . . 10.93 106.562 174.229 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 102' ' ' PHE . . . . . . . . . . . . . 31.2 p90 -96.46 139.97 31.8 Favored 'General case' 0 N--CA 1.452 -0.359 0 N-CA-C 107.248 -1.39 . . . . 7.1299999999999999 107.248 164.309 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -132.27 119.33 39.4 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.362 0 N-CA-C 104.597 -2.372 . . . . 4.3700000000000001 104.597 176.677 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 104' ' ' ILE . . . . . . . . . . . . . 24.0 mm 39.7 90.39 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.537 0.448 0 C-N-CA 126.52 1.928 . . . . 6.9500000000000002 112.123 -173.366 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 7.5 m-20 -51.54 145.78 8.39 Favored 'General case' 0 CA--C 1.528 0.128 0 C-N-CA 123.361 0.664 . . . . 6.7800000000000002 110.68 178.966 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 24.9 t . . . . . 0 C--O 1.253 1.256 0 C-N-CA 125.394 1.477 . . . . 9.5700000000000003 107.261 179.728 . . . . . . . . 0 0 . 1 . 025 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.225 -0.451 0 N-CA-C 106.381 -2.687 . . . . 14.48 106.381 . . . . . . . . . 0 0 . 1 . 025 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 49.6 m -122.3 82.88 2.03 Favored 'General case' 0 N--CA 1.456 -0.172 0 CA-C-N 118.766 1.283 . . . . 16.649999999999999 108.121 172.164 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 5.2 mmpt? -144.99 145.0 31.33 Favored 'General case' 0 N--CA 1.452 -0.341 0 N-CA-C 106.81 -1.552 . . . . 20.859999999999999 106.81 179.239 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 145.18 175.14 18.06 Favored Glycine 0 CA--C 1.522 0.516 0 N-CA-C 108.281 -1.928 . . . . 15.85 108.281 -178.948 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 34.0 m -93.86 -162.07 0.1 OUTLIER 'Isoleucine or valine' 0 N--CA 1.444 -0.726 0 N-CA-C 106.965 -1.494 . . . . 16.760000000000002 106.965 156.473 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -81.1 113.45 19.29 Favored 'General case' 0 N--CA 1.447 -0.613 0 CA-C-O 122.156 0.979 . . . . 11.44 111.576 174.978 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . 0.464 ' H ' HD22 ' A' ' 7' ' ' LEU . 0.0 OUTLIER -145.12 52.0 1.21 Allowed 'General case' 0 N--CA 1.449 -0.492 0 C-N-CA 125.823 1.649 . . . . 10.279999999999999 108.354 174.897 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 29.4 mtp180 62.15 48.35 5.04 Favored 'General case' 0 N--CA 1.461 0.09 0 C-N-CA 124.227 1.011 . . . . 7.1900000000000004 111.827 -177.825 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 1.2 m120 -49.58 -33.98 16.53 Favored 'General case' 0 C--O 1.219 -0.552 0 N-CA-C 113.139 0.792 . . . . 3.52 113.139 178.401 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -56.23 -56.73 17.4 Favored 'General case' 0 N--CA 1.449 -0.518 0 C-N-CA 122.966 0.506 . . . . 2.7799999999999998 111.524 176.322 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 26.6 m -79.73 -46.11 17.67 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 121.55 0.691 . . . . 1.6399999999999999 110.196 -170.858 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 38.0 tt0 -68.86 -33.97 74.67 Favored 'General case' 0 CA--C 1.533 0.312 0 N-CA-C 108.381 -0.97 . . . . 3.71 108.381 -179.209 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -62.8 -55.71 25.3 Favored Glycine 0 C--O 1.222 -0.656 0 N-CA-C 108.8 -1.72 . . . . 0.84999999999999998 108.8 174.411 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 3.2 t80 -46.43 -54.95 8.17 Favored 'General case' 0 C--O 1.227 -0.12 0 CA-C-N 118.549 1.175 . . . . 3.0800000000000001 111.24 -175.11 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 0.5 OUTLIER -66.17 -34.37 69.74 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.501 0 O-C-N 121.567 -0.708 . . . . 0.62 112.159 -177.907 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 5.3 t60 -63.38 -53.0 59.33 Favored 'General case' 0 N--CA 1.453 -0.295 0 N-CA-C 107.832 -1.173 . . . . 0.96999999999999997 107.832 179.916 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 17.2 mt-10 -58.63 -38.66 78.54 Favored 'General case' 0 N--CA 1.449 -0.477 0 C-N-CA 127.398 2.279 . . . . 2.9199999999999999 110.004 179.683 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -51.56 -47.05 63.6 Favored 'General case' 0 CA--C 1.519 -0.225 0 C-N-CA 123.709 0.804 . . . . 2.3300000000000001 109.689 170.829 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -48.77 -49.26 28.57 Favored Glycine 0 CA--C 1.527 0.841 0 CA-C-O 119.728 -0.484 . . . . 0.57999999999999996 111.912 171.851 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 60.4 m-70 -60.62 -45.4 94.17 Favored 'General case' 0 C--O 1.223 -0.299 0 CA-C-N 119.338 1.569 . . . . 3.5499999999999998 111.422 176.115 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -62.19 -24.42 67.19 Favored 'General case' 0 CA--C 1.534 0.339 0 O-C-N 121.019 -1.051 . . . . 1.0800000000000001 111.159 -179.474 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 78.3 t -78.26 -35.7 20.02 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.183 0 O-C-N 121.197 -0.94 . . . . 1.4399999999999999 110.938 173.44 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 15.1 t0 -54.86 -33.13 61.46 Favored 'General case' 0 C--N 1.333 -0.109 0 C-N-CA 124.37 1.068 . . . . 2.7000000000000002 109.716 171.278 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 11.9 t70 -61.21 -54.5 43.52 Favored 'General case' 0 CA--C 1.519 -0.214 0 N-CA-C 108.935 -0.765 . . . . 3.2000000000000002 108.935 -177.384 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 31.4 t80 -56.39 -49.58 74.04 Favored 'General case' 0 N--CA 1.454 -0.228 0 C-N-CA 122.535 0.334 . . . . 5.0300000000000002 110.101 -179.105 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -56.83 -38.32 72.48 Favored 'General case' 0 N--CA 1.451 -0.416 0 C-N-CA 120.566 -0.453 . . . . 1.8500000000000001 110.99 -179.828 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -80.6 -22.25 62.49 Favored Glycine 0 CA--C 1.525 0.71 0 C-N-CA 124.163 0.887 . . . . 1.3100000000000001 113.032 -177.758 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 1.1 t80 -76.57 -46.0 28.06 Favored 'General case' 0 N--CA 1.448 -0.571 0 O-C-N 121.029 -1.277 . . . . 2.9199999999999999 108.348 179.586 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -72.97 -39.41 66.16 Favored 'General case' 0 N--CA 1.445 -0.678 0 C-N-CA 124.264 1.026 . . . . 3.2599999999999998 111.527 179.768 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 7.9 mt -117.64 123.32 45.84 Favored 'General case' 0 N--CA 1.453 -0.325 0 N-CA-C 107.254 -1.387 . . . . 3.21 107.254 -170.486 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER 58.91 56.58 3.98 Favored 'General case' 0 CA--C 1.54 0.578 0 C-N-CA 124.249 1.02 . . . . 5.2599999999999998 110.578 -175.689 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 2.6 tmtt? -48.89 102.24 0.03 OUTLIER 'General case' 0 N--CA 1.468 0.465 0 C-N-CA 124.426 1.09 . . . . 11.359999999999999 111.481 -169.477 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 33.1 t-20 -150.79 159.1 44.76 Favored 'General case' 0 N--CA 1.453 -0.292 0 N-CA-C 106.792 -1.559 . . . . 6.96 106.792 -179.493 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 34.0 tt0 -89.49 -35.1 16.16 Favored 'General case' 0 CA--C 1.531 0.241 0 CA-C-N 118.794 0.725 . . . . 12.98 109.889 171.086 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 15.2 t -107.22 22.13 16.45 Favored 'General case' 0 CA--C 1.53 0.202 0 C-N-CA 123.111 0.564 . . . . 7.4299999999999997 111.089 -170.529 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 5.0 t0 -151.69 132.78 14.35 Favored 'General case' 0 C--N 1.331 -0.232 0 N-CA-C 104.294 -2.484 . . . . 7.1799999999999997 104.294 173.074 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 1.2 mm? -116.62 -148.28 0.42 Allowed 'General case' 0 CA--C 1.531 0.226 0 CA-C-N 119.598 1.09 . . . . 2.6699999999999999 108.393 -177.509 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 4.5 p -70.74 -19.68 21.7 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.398 0 O-C-N 121.142 -0.974 . . . . 2.79 111.161 176.502 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 4.5 t -46.65 148.2 1.06 Allowed 'General case' 0 N--CA 1.455 -0.218 0 C-N-CA 123.696 0.799 . . . . 3.6099999999999999 109.796 167.301 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 40' ' ' ASN . . . . . 0.573 ' HA ' HG23 ' A' ' 45' ' ' ILE . 28.7 t30 52.59 46.28 27.01 Favored 'General case' 0 CA--C 1.529 0.172 0 O-C-N 121.708 -0.62 . . . . 6.8200000000000003 112.044 173.34 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 11.4 t -52.99 96.13 0.01 OUTLIER 'General case' 0 C--O 1.224 -0.241 0 CA-C-O 118.516 -0.754 . . . . 4.3499999999999996 111.303 -177.214 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 6.0 mmpt? 30.26 69.68 0.09 Allowed 'General case' 0 N--CA 1.466 0.327 0 C-N-CA 124.955 1.302 . . . . 15.9 112.362 -166.709 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 31.3 mmtt 57.43 33.95 23.99 Favored 'General case' 0 N--CA 1.465 0.312 0 C-N-CA 122.769 0.428 . . . . 16.23 112.088 177.536 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 3.6 m-30 -73.63 -75.23 0.15 Allowed 'General case' 0 C--O 1.222 -0.385 0 N-CA-C 108.405 -0.961 . . . . 6.8899999999999997 108.405 162.444 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 45' ' ' ILE . . . . . 0.573 HG23 ' HA ' ' A' ' 40' ' ' ASN . 0.2 OUTLIER 36.08 80.96 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.544 0.745 0 O-C-N 123.768 0.667 . . . . 2.8599999999999999 111.876 -164.107 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 21.5 t70 -123.26 -60.11 1.52 Allowed 'General case' 0 N--CA 1.47 0.56 0 O-C-N 120.688 -1.257 . . . . 2.25 110.823 -174.191 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 5.2 mm -46.92 -52.13 4.37 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.622 0 C-N-CA 125.244 1.418 . . . . 0.95999999999999996 108.839 174.175 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 33.9 t80 -63.97 -28.01 69.52 Favored 'General case' 0 N--CA 1.453 -0.287 0 O-C-N 120.785 -1.197 . . . . 0.44 113.288 179.322 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . 0.497 ' HA ' ' HE2' ' A' ' 49' ' ' LYS . 10.5 mmpt? -68.97 -48.76 62.35 Favored 'General case' 0 C--N 1.329 -0.323 0 O-C-N 119.908 -1.745 . . . . 0.97999999999999998 110.834 -177.838 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 4.2 tp10 -84.88 -58.48 2.69 Favored 'General case' 0 N--CA 1.453 -0.322 0 N-CA-C 108.743 -0.836 . . . . 2.21 108.743 -174.232 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 20.7 mp0 -74.56 -31.74 62.19 Favored 'General case' 0 C--O 1.235 0.3 0 O-C-N 121.052 -1.03 . . . . 2.6800000000000002 110.982 -174.844 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . 0.403 ' HA2' ' CD1' ' A' ' 66' ' ' PHE . . . -72.39 42.98 0.85 Allowed Glycine 0 CA--C 1.531 1.091 0 C-N-CA 125.097 1.332 . . . . 0.40000000000000002 114.336 174.354 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 27.9 t -155.03 35.15 0.39 Allowed 'General case' 0 N--CA 1.451 -0.409 0 O-C-N 121.048 -1.266 . . . . 1.8799999999999999 108.614 153.332 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 42.9 t30 -140.52 -40.56 0.42 Allowed 'General case' 0 C--N 1.341 0.197 0 N-CA-C 112.728 0.64 . . . . 1.9399999999999999 112.728 -164.997 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 30.9 mt -64.31 -38.68 91.91 Favored 'General case' 0 C--N 1.332 -0.177 0 O-C-N 121.85 -0.531 . . . . 0.64000000000000001 110.754 178.209 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 1.4 t 177.57 171.6 0.6 Allowed 'General case' 0 CA--C 1.531 0.241 0 C-N-CA 125.513 1.525 . . . . 0.67000000000000004 107.612 -175.372 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 8.5 m -59.82 -31.32 69.62 Favored 'General case' 0 N--CA 1.455 -0.216 0 O-C-N 121.717 -0.614 . . . . 1.04 110.634 168.421 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -66.28 -19.05 65.71 Favored 'General case' 0 N--CA 1.463 0.183 0 N-CA-C 112.045 0.387 . . . . 1.3100000000000001 112.045 174.735 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -83.04 -8.44 85.69 Favored Glycine 0 N--CA 1.439 -1.102 0 CA-C-O 118.579 -1.123 . . . . 0.42999999999999999 110.546 175.792 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -110.77 -18.99 13.0 Favored 'General case' 0 C--O 1.232 0.166 0 CA-C-N 119.357 1.579 . . . . 2.71 112.527 -176.347 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 3.4 p -62.77 -163.57 0.01 OUTLIER 'General case' 0 CA--C 1.538 0.483 0 C-N-CA 124.177 0.991 . . . . 0.94999999999999996 109.447 168.282 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 78.1 m-20 -53.29 148.33 8.84 Favored 'General case' 0 CA--C 1.53 0.175 0 O-C-N 120.449 -1.407 . . . . 2.7799999999999998 110.445 -174.14 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 30.7 tt0 -59.77 -26.94 66.11 Favored 'General case' 0 CA--C 1.537 0.477 0 C-N-CA 123.226 0.61 . . . . 2.8700000000000001 111.168 -176.07 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -62.38 -39.27 92.64 Favored 'General case' 0 N--CA 1.458 -0.063 0 O-C-N 121.367 -0.833 . . . . 0.58999999999999997 112.509 171.63 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 13.9 mt-10 -69.2 -44.35 72.31 Favored 'General case' 0 CA--C 1.514 -0.439 0 O-C-N 121.041 -1.037 . . . . 2.21 110.435 177.45 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 66' ' ' PHE . . . . . 0.403 ' CD1' ' HA2' ' A' ' 52' ' ' GLY . 51.7 t80 -53.04 -46.03 68.3 Favored 'General case' 0 CA--C 1.534 0.328 0 C-N-CA 125.308 1.443 . . . . 0.34000000000000002 111.296 173.485 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 62.3 t80 -64.01 -48.48 76.21 Favored 'General case' 0 CA--C 1.534 0.33 0 CA-C-O 122.217 1.008 . . . . 0.68999999999999995 109.973 177.379 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -64.44 -41.96 96.26 Favored 'General case' 0 N--CA 1.446 -0.648 0 O-C-N 121.203 -0.936 . . . . 0.44 113.226 -174.564 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -68.67 -35.77 77.66 Favored 'General case' 0 C--N 1.332 -0.154 0 O-C-N 121.054 -1.029 . . . . 3.6299999999999999 109.848 175.006 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -54.24 -41.27 68.56 Favored 'General case' 0 C--O 1.223 -0.315 0 CA-C-N 118.949 0.795 . . . . 0.38 110.327 171.101 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 19.7 t80 -58.48 -49.97 75.44 Favored 'General case' 0 N--CA 1.464 0.241 0 CA-C-N 120.027 1.285 . . . . 3.3999999999999999 111.635 173.45 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -51.44 -54.38 27.46 Favored 'General case' 0 CA--C 1.531 0.239 0 O-C-N 121.709 -0.62 . . . . 4.1200000000000001 110.506 179.035 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . 0.608 ' HB3' HG21 ' A' ' 85' ' ' VAL . 0.1 OUTLIER -66.65 -32.77 74.31 Favored 'General case' 0 C--N 1.324 -0.543 0 C-N-CA 124.377 1.071 . . . . 0.41999999999999998 109.96 -174.468 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild full ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 1.8 tmt? -61.58 -39.32 90.75 Favored 'General case' 0 N--CA 1.447 -0.606 0 C-N-CA 123.676 0.79 . . . . 2.52 112.124 -177.774 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 13.0 p80 -94.59 -8.93 36.68 Favored 'General case' 0 C--O 1.232 0.133 0 CA-C-O 117.3 -1.333 . . . . 1.24 113.187 -179.655 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 9.7 m -40.03 127.37 2.16 Favored 'General case' 0 N--CA 1.45 -0.434 0 CA-C-O 123.24 1.495 . . . . 1.05 110.81 -168.459 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 1.4 p -52.63 -42.77 64.93 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 112.692 -2.049 . . . . 1.3 108.892 -178.315 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 78' ' ' ASP . . . . . 0.439 ' OD2' ' HB3' ' A' ' 80' ' ' ALA . 14.4 t0 -70.62 114.19 8.48 Favored 'General case' 0 N--CA 1.444 -0.739 0 CA-C-O 121.98 0.895 . . . . 1.9199999999999999 108.916 169.548 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 52.5 m80 -57.72 -32.39 67.36 Favored 'General case' 0 N--CA 1.455 -0.194 0 O-C-N 121.639 -0.663 . . . . 5.3300000000000001 110.615 174.597 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 80' ' ' ALA . . . . . 0.439 ' HB3' ' OD2' ' A' ' 78' ' ' ASP . . . -61.85 -50.83 70.68 Favored 'General case' 0 N--CA 1.451 -0.381 0 CA-C-O 118.401 -0.809 . . . . 0.84999999999999998 110.313 179.722 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 4.2 mt-10 -43.17 -45.45 5.57 Favored 'General case' 0 C--N 1.339 0.138 0 C-N-CA 124.725 1.21 . . . . 2.7799999999999998 110.204 176.648 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 1.9 mtp180 -63.91 -52.75 58.42 Favored 'General case' 0 N--CA 1.453 -0.32 0 CA-C-N 115.828 -0.623 . . . . 2.9199999999999999 109.778 -178.497 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 1.3 mm? -63.67 -21.08 66.2 Favored 'General case' 0 N--CA 1.452 -0.33 0 CA-C-O 117.651 -1.166 . . . . 0.70999999999999996 112.701 178.042 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 2.5 mptm? -64.12 -44.55 91.89 Favored 'General case' 0 C--O 1.225 -0.221 0 CA-C-N 121.324 1.875 . . . . 1.48 107.639 171.2 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 85' ' ' VAL . . . . . 0.608 HG21 ' HB3' ' A' ' 73' ' ' LEU . 84.4 t -62.11 -60.82 2.11 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.489 0 CA-C-O 118.144 -0.931 . . . . 0.40000000000000002 110.368 175.324 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -51.13 -48.14 61.87 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 119.765 1.166 . . . . 2.0899999999999999 111.197 -174.493 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 37.4 tttm -56.85 -48.54 77.84 Favored 'General case' 0 N--CA 1.449 -0.519 0 C-N-CA 123.769 0.828 . . . . 3.2200000000000002 111.754 176.457 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 47.4 m-20 -79.29 -7.81 58.58 Favored 'General case' 0 CA--C 1.532 0.261 0 C-N-CA 123.231 0.612 . . . . 1.1399999999999999 111.556 -177.244 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -165.8 73.19 1.3 Allowed Pre-proline 0 N--CA 1.448 -0.558 0 C-N-CA 125.488 1.515 . . . . 0.73999999999999999 110.345 -167.72 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 74.4 Cg_endo -73.31 8.14 1.91 Allowed 'Trans proline' 0 N--CA 1.457 -0.62 0 C-N-CA 123.099 2.532 . . . . 1.95 112.875 -175.093 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -122.43 -47.93 2.09 Favored 'General case' 0 N--CA 1.45 -0.431 0 C-N-CA 125.221 1.408 . . . . 2.29 109.638 -177.625 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 2.7 m -53.92 -46.87 71.61 Favored 'General case' 0 C--N 1.334 -0.081 0 C-N-CA 123.706 0.803 . . . . 0.81000000000000005 111.132 177.568 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 10.3 t80 -60.27 -47.45 85.94 Favored 'General case' 0 CA--C 1.508 -0.635 0 CA-C-O 121.355 0.598 . . . . 2.4900000000000002 110.567 178.499 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 24.2 tt0 -56.58 -33.76 66.5 Favored 'General case' 0 N--CA 1.441 -0.912 0 CA-C-N 114.693 -1.139 . . . . 2.0499999999999998 109.882 -179.914 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 3.2 t80 -63.33 -57.94 8.73 Favored 'General case' 0 N--CA 1.455 -0.221 0 C-N-CA 124.443 1.097 . . . . 1.1599999999999999 109.633 -175.891 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 47.0 mm -51.9 -46.72 41.18 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.14 0 C-N-CA 123.345 0.658 . . . . 1.8799999999999999 109.67 175.575 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 40.3 t30 -63.75 -32.99 74.67 Favored 'General case' 0 CA--C 1.53 0.205 0 N-CA-C 111.714 0.264 . . . . 2.0299999999999998 111.714 -176.559 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -63.31 -44.54 94.69 Favored 'General case' 0 CA--C 1.523 -0.075 0 C-N-CA 124.304 1.042 . . . . 2.1699999999999999 108.639 176.778 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 30.5 mm100 -81.88 58.89 4.05 Favored 'General case' 0 N--CA 1.452 -0.339 0 C-N-CA 123.223 0.609 . . . . 2.77 110.628 178.439 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 6.9 tp -75.11 72.09 0.35 Allowed 'Isoleucine or valine' 0 CA--C 1.54 0.588 0 C-N-CA 124.578 1.151 . . . . 4.0800000000000001 110.106 179.967 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 2.3 ttmt -169.13 -176.21 2.52 Favored 'General case' 0 CA--C 1.527 0.07 0 O-C-N 120.66 -1.275 . . . . 8.0600000000000005 108.973 176.22 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 102' ' ' PHE . . . . . . . . . . . . . 6.2 p90 -149.16 157.59 43.5 Favored 'General case' 0 C--N 1.33 -0.282 0 N-CA-C 108.286 -1.005 . . . . 8.0 108.286 178.044 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -68.79 -48.25 71.96 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.377 0 N-CA-C 108.663 -0.866 . . . . 5.6500000000000004 108.663 173.941 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 104' ' ' ILE . . . . . . . . . . . . . 4.8 tt -154.54 175.8 0.48 Allowed 'Isoleucine or valine' 0 N--CA 1.454 -0.262 0 N-CA-C 107.561 -1.274 . . . . 7.6699999999999999 107.561 177.941 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 30.7 p-10 -142.16 174.26 10.77 Favored 'General case' 0 N--CA 1.453 -0.314 0 C-N-CA 124.687 1.195 . . . . 6.5099999999999998 108.702 -178.773 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 15.6 t . . . . . 0 C--O 1.253 1.238 0 CA-C-O 115.383 -2.246 . . . . 10.59 108.506 172.457 . . . . . . . . 0 0 . 1 . 026 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.469 0.841 0 N-CA-C 108.956 -1.658 . . . . 20.18 108.956 . . . . . . . . . 0 0 . 1 . 026 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 5.5 m 21.21 101.12 0.0 OUTLIER 'General case' 0 CA--C 1.531 0.235 0 C-N-CA 129.036 2.934 . . . . 20.579999999999998 116.425 160.426 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 4.2 ptpt -146.57 130.32 17.06 Favored 'General case' 0 C--O 1.226 -0.163 0 N-CA-C 108.246 -1.02 . . . . 21.530000000000001 108.246 172.705 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 63.64 -150.63 49.63 Favored Glycine 0 CA--C 1.522 0.514 0 CA-C-N 118.209 0.458 . . . . 18.77 112.148 177.585 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 33.7 m -80.43 -154.16 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.446 -0.627 0 C-N-CA 123.609 0.764 . . . . 17.359999999999999 109.032 172.957 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 20.8 mt-10 -102.14 109.93 21.76 Favored 'General case' 0 N--CA 1.449 -0.485 0 O-C-N 121.147 -0.971 . . . . 11.640000000000001 110.103 175.909 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . 0.441 HD22 ' N ' ' A' ' 7' ' ' LEU . 1.9 mm? -99.21 33.11 2.5 Favored 'General case' 0 N--CA 1.455 -0.181 0 C-N-CA 123.746 0.819 . . . . 10.5 109.696 -178.403 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 4.6 mmm-85 -146.88 110.2 4.82 Favored 'General case' 0 N--CA 1.445 -0.679 0 N-CA-C 107.593 -1.262 . . . . 11.09 107.593 -175.161 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 3.7 m-20 -52.59 -29.95 28.51 Favored 'General case' 0 C--O 1.221 -0.423 0 C-N-CA 123.595 0.758 . . . . 2.8900000000000001 111.832 170.683 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 3.8 t0 -56.13 -56.68 17.94 Favored 'General case' 0 C--N 1.323 -0.586 0 C-N-CA 125.76 1.624 . . . . 2.75 110.651 173.268 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 11.9 m -67.24 -51.05 57.83 Favored 'General case' 0 CA--C 1.533 0.31 0 O-C-N 121.219 -0.926 . . . . 2.0800000000000001 111.019 178.467 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 3.7 tt0 -67.99 -22.01 65.03 Favored 'General case' 0 CA--C 1.542 0.647 0 C-N-CA 125.703 1.601 . . . . 3.3100000000000001 110.09 -171.851 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -88.22 -38.15 7.38 Favored Glycine 0 CA--C 1.524 0.627 0 C-N-CA 125.785 1.66 . . . . 0.78000000000000003 110.781 174.974 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -51.0 -50.44 58.5 Favored 'General case' 0 CA--C 1.522 -0.097 0 CA-C-N 118.52 1.16 . . . . 4.1299999999999999 109.853 179.823 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER -62.36 -33.65 60.24 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.313 0 N-CA-C 112.617 0.599 . . . . 0.54000000000000004 112.617 178.838 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 10.1 t60 -61.62 -52.33 64.8 Favored 'General case' 0 CA--C 1.531 0.213 0 N-CA-C 106.684 -1.599 . . . . 0.67000000000000004 106.684 178.349 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 36.7 mt-10 -57.21 -36.84 71.37 Favored 'General case' 0 CA--C 1.53 0.207 0 O-C-N 121.473 -0.767 . . . . 2.6299999999999999 111.337 176.946 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 1.1 t80 -56.9 -41.73 78.63 Favored 'General case' 0 C--N 1.33 -0.25 0 O-C-N 121.511 -0.743 . . . . 2.1400000000000001 110.881 175.398 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -52.88 -45.11 61.59 Favored Glycine 0 CA--C 1.53 0.97 0 N-CA-C 111.249 -0.74 . . . . 0.72999999999999998 111.249 172.631 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 20' ' ' HIS . . . . . . . . . . . . . 71.6 m-70 -59.7 -49.02 79.35 Favored 'General case' 0 C--O 1.227 -0.105 0 CA-C-N 118.216 1.008 . . . . 3.6200000000000001 111.279 175.403 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -58.69 -29.29 66.52 Favored 'General case' 0 CA--C 1.533 0.291 0 O-C-N 122.018 -0.426 . . . . 0.59999999999999998 110.982 -179.185 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 49.3 t -66.57 -42.21 89.59 Favored 'Isoleucine or valine' 0 C--O 1.233 0.223 0 O-C-N 121.08 -1.012 . . . . 1.0 111.053 176.27 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 65.0 m-20 -62.02 -21.25 64.73 Favored 'General case' 0 C--O 1.232 0.146 0 CA-C-N 117.904 0.32 . . . . 2.1699999999999999 111.648 175.777 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 45.5 t0 -71.21 -51.17 26.22 Favored 'General case' 0 N--CA 1.457 -0.121 0 CA-C-O 121.981 0.896 . . . . 2.2000000000000002 109.06 -176.052 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -53.86 -52.31 60.85 Favored 'General case' 0 C--O 1.233 0.195 0 N-CA-C 109.011 -0.737 . . . . 2.7799999999999998 109.011 175.075 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -59.99 -28.79 67.99 Favored 'General case' 0 N--CA 1.451 -0.388 0 N-CA-C 112.093 0.405 . . . . 0.89000000000000001 112.093 178.713 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -66.45 -36.28 91.3 Favored Glycine 0 CA--C 1.52 0.37 0 N-CA-C 111.1 -0.8 . . . . 1.1499999999999999 111.1 177.99 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 0.8 OUTLIER -78.98 -42.83 25.75 Favored 'General case' 0 N--CA 1.454 -0.249 0 CA-C-N 117.866 0.833 . . . . 2.8799999999999999 110.909 -177.974 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 2.9 mm? -80.64 -32.37 36.2 Favored 'General case' 0 N--CA 1.449 -0.487 0 C-N-CA 123.844 0.858 . . . . 1.6699999999999999 113.178 -173.116 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 14.2 mt -111.97 -134.84 0.35 Allowed 'General case' 0 N--CA 1.45 -0.442 0 N-CA-C 106.793 -1.558 . . . . 2.6000000000000001 106.793 -172.975 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 18.19 93.02 0.01 OUTLIER 'General case' 0 N--CA 1.468 0.432 0 C-N-CA 127.971 2.508 . . . . 5.7199999999999998 115.993 168.705 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 6.9 ptmm? -60.32 167.03 2.66 Favored 'General case' 0 CA--C 1.533 0.3 0 CA-C-O 121.508 0.67 . . . . 8.0600000000000005 112.55 -178.352 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 56.0 t30 -48.39 146.06 3.06 Favored 'General case' 0 CA--C 1.532 0.286 0 C-N-CA 124.731 1.212 . . . . 7.9400000000000004 112.157 -178.594 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 45.6 mt-30 66.69 24.14 10.07 Favored 'General case' 0 CA--C 1.531 0.22 0 C-N-CA 126.844 2.058 . . . . 8.6699999999999999 112.159 -164.1 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 3.9 t -135.31 153.98 51.69 Favored 'General case' 0 N--CA 1.448 -0.527 0 N-CA-C 104.895 -2.261 . . . . 6.2400000000000002 104.895 153.765 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 49.7 t0 -150.12 129.48 12.91 Favored 'General case' 0 C--N 1.329 -0.286 0 N-CA-C 107.099 -1.445 . . . . 5.3799999999999999 107.099 179.788 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 6.2 mp 60.79 147.53 0.02 OUTLIER 'General case' 0 CA--C 1.536 0.433 0 C-N-CA 125.47 1.508 . . . . 2.0600000000000001 110.464 -156.574 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 7.7 p -71.58 128.93 35.2 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.192 0 O-C-N 120.294 -1.504 . . . . 3.1499999999999999 107.723 174.18 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 59.0 p -134.56 109.31 8.6 Favored 'General case' 0 CA--C 1.529 0.155 0 CA-C-N 119.042 0.837 . . . . 3.73 108.984 173.72 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 7.6 m-80 37.43 49.86 1.01 Allowed 'General case' 0 CA--C 1.532 0.273 0 C-N-CA 127.235 2.214 . . . . 7.0199999999999996 115.332 179.429 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 34.3 t -55.71 -50.24 70.86 Favored 'General case' 0 CA--C 1.533 0.326 0 O-C-N 121.059 -1.026 . . . . 3.3399999999999999 112.343 -179.357 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 6.4 mtpm? -66.5 -20.51 66.05 Favored 'General case' 0 N--CA 1.465 0.323 0 O-C-N 121.41 -0.806 . . . . 6.2000000000000002 112.714 -176.817 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 24.7 mttt -143.26 71.91 1.35 Allowed 'General case' 0 N--CA 1.451 -0.406 0 N-CA-C 106.392 -1.706 . . . . 7.5599999999999996 106.392 -174.572 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 9.3 m-85 -38.71 101.4 0.02 OUTLIER 'General case' 0 N--CA 1.456 -0.169 0 C-N-CA 125.639 1.576 . . . . 5.5099999999999998 111.164 -172.117 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 2.4 tt 36.94 57.48 0.18 Allowed 'Isoleucine or valine' 0 CA--C 1.542 0.655 0 C-N-CA 125.73 1.612 . . . . 2.3700000000000001 111.856 -179.518 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 1.6 t70 -118.62 -57.85 2.02 Favored 'General case' 0 N--CA 1.468 0.432 0 C-N-CA 125.661 1.584 . . . . 2.1899999999999999 109.612 -176.677 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 4.4 mm -50.3 -53.25 12.52 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.26 0 C-N-CA 123.988 0.915 . . . . 0.46999999999999997 109.383 178.262 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 20.2 t80 -60.11 -32.22 70.78 Favored 'General case' 0 N--CA 1.452 -0.338 0 C-N-CA 123.504 0.722 . . . . 0.40000000000000002 112.243 178.465 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . 0.501 ' HA ' ' HE2' ' A' ' 49' ' ' LYS . 0.6 OUTLIER -63.38 -51.14 67.09 Favored 'General case' 0 CA--C 1.519 -0.22 0 O-C-N 120.336 -1.478 . . . . 0.91000000000000003 110.502 -179.331 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 3.1 tp10 -79.44 -65.98 0.93 Allowed 'General case' 0 N--CA 1.452 -0.338 0 CA-C-O 122.27 1.033 . . . . 2.1299999999999999 108.559 -175.368 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 3.8 mm-40 -72.14 -30.23 64.82 Favored 'General case' 0 N--CA 1.453 -0.316 0 C-N-CA 124.006 0.923 . . . . 2.2999999999999998 109.956 -167.336 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . 0.413 ' HA2' ' CD1' ' A' ' 66' ' ' PHE . . . -68.99 41.68 0.34 Allowed Glycine 0 CA--C 1.527 0.815 0 C-N-CA 125.706 1.622 . . . . 0.33000000000000002 113.838 169.036 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 65.3 p -145.77 22.42 1.44 Allowed 'General case' 0 N--CA 1.448 -0.55 0 O-C-N 120.871 -1.37 . . . . 1.98 111.49 159.681 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 47.9 t-20 -135.44 -44.32 0.69 Allowed 'General case' 0 C--O 1.226 -0.16 0 N-CA-C 111.906 0.336 . . . . 1.5800000000000001 111.906 -165.529 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 28.7 mt -58.55 -38.55 78.07 Favored 'General case' 0 N--CA 1.462 0.163 0 CA-C-O 120.985 0.421 . . . . 0.40000000000000002 111.142 -174.987 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER 178.16 172.03 0.68 Allowed 'General case' 0 CA--C 1.531 0.22 0 C-N-CA 125.468 1.507 . . . . 0.53000000000000003 107.591 -178.244 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 14.4 m -56.89 -35.55 69.08 Favored 'General case' 0 N--CA 1.453 -0.283 0 O-C-N 121.572 -0.705 . . . . 1.0 110.319 166.7 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -64.67 -21.43 66.73 Favored 'General case' 0 CA--C 1.534 0.343 0 CA-C-O 121.085 0.469 . . . . 1.3100000000000001 111.858 175.969 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -80.73 -12.49 82.76 Favored Glycine 0 N--CA 1.444 -0.791 0 N-CA-C 111.125 -0.79 . . . . 0.45000000000000001 111.125 176.372 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 36.4 ttt-85 -110.98 -11.59 14.31 Favored 'General case' 0 CA--C 1.529 0.171 0 CA-C-N 118.758 1.279 . . . . 2.3199999999999998 112.151 -179.15 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 2.2 p -63.9 -161.63 0.01 OUTLIER 'General case' 0 CA--C 1.54 0.568 0 C-N-CA 123.616 0.766 . . . . 0.98999999999999999 109.9 167.059 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 16.3 t-20 -52.34 151.83 3.78 Favored 'General case' 0 CA--C 1.532 0.287 0 O-C-N 120.907 -1.121 . . . . 2.1400000000000001 110.709 -177.574 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 35.7 tt0 -59.91 -36.37 76.85 Favored 'General case' 0 CA--C 1.53 0.182 0 CA-C-N 118.915 0.78 . . . . 2.4700000000000002 110.349 -176.527 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -55.37 -30.14 59.78 Favored 'General case' 0 C--N 1.331 -0.198 0 O-C-N 121.522 -0.736 . . . . 0.41999999999999998 112.813 176.924 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 1.6 mm-40 -82.16 -38.67 24.34 Favored 'General case' 0 N--CA 1.447 -0.589 0 CA-C-O 118.612 -0.709 . . . . 2.6499999999999999 110.362 -179.177 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 66' ' ' PHE . . . . . 0.413 ' CD1' ' HA2' ' A' ' 52' ' ' GLY . 59.0 t80 -55.16 -47.29 75.36 Favored 'General case' 0 N--CA 1.452 -0.361 0 C-N-CA 124.267 1.027 . . . . 0.35999999999999999 111.43 170.73 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 56.9 t80 -65.03 -48.11 75.02 Favored 'General case' 0 CA--C 1.538 0.501 0 O-C-N 121.061 -1.024 . . . . 0.48999999999999999 109.819 176.141 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -58.82 -55.69 31.92 Favored 'General case' 0 CA--C 1.536 0.44 0 N-CA-C 113.252 0.834 . . . . 0.27000000000000002 113.252 -174.7 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -55.4 -39.56 70.34 Favored 'General case' 0 C--N 1.331 -0.218 0 O-C-N 121.027 -1.045 . . . . 3.8700000000000001 111.355 171.264 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -60.17 -32.95 71.54 Favored 'General case' 0 CA--C 1.533 0.311 0 CA-C-N 119.737 1.153 . . . . 0.41999999999999998 110.872 175.516 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -59.17 -49.71 76.83 Favored 'General case' 0 N--CA 1.464 0.229 0 CA-C-N 119.127 0.876 . . . . 3.3700000000000001 111.901 168.681 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 72' ' ' ARG . . . . . 0.494 ' HE ' ' CD2' ' A' ' 73' ' ' LEU . 10.7 ttp180 -51.92 -61.61 2.15 Favored 'General case' 0 CA--C 1.534 0.352 0 O-C-N 121.392 -0.818 . . . . 2.0899999999999999 110.82 174.905 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . 0.494 ' CD2' ' HE ' ' A' ' 72' ' ' ARG . 0.1 OUTLIER -62.25 -45.89 91.3 Favored 'General case' 0 C--O 1.221 -0.436 0 C-N-CA 125.56 1.544 . . . . 0.48999999999999999 110.649 -170.94 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild full ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -63.61 -25.96 68.46 Favored 'General case' 0 C--N 1.331 -0.216 0 O-C-N 120.276 -1.515 . . . . 4.5700000000000003 111.808 -179.867 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -91.96 -12.11 34.28 Favored 'General case' 0 C--O 1.232 0.169 0 CA-C-O 117.063 -1.446 . . . . 1.03 112.327 175.214 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 80.3 p -48.9 122.66 5.99 Favored 'General case' 0 N--CA 1.446 -0.642 0 CA-C-N 119.8 1.182 . . . . 2.25 108.31 -167.436 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 2.2 p -51.21 -39.36 56.36 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 114.646 -1.161 . . . . 1.1100000000000001 109.641 177.102 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 13.5 t0 -63.98 104.35 0.7 Allowed 'General case' 0 N--CA 1.448 -0.528 0 CA-C-O 121.641 0.734 . . . . 2.0600000000000001 109.846 166.685 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 39.3 p-80 -50.17 -35.23 25.28 Favored 'General case' 0 C--N 1.332 -0.171 0 C-N-CA 122.991 0.517 . . . . 4.54 111.994 174.268 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -61.12 -51.24 69.93 Favored 'General case' 0 N--CA 1.449 -0.512 0 CA-C-O 118.516 -0.754 . . . . 0.63 110.736 -178.072 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 1.2 mt-10 -50.42 -39.52 47.53 Favored 'General case' 0 C--O 1.233 0.198 0 CA-C-N 119.132 0.878 . . . . 3.25 110.478 177.759 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -62.97 -52.96 60.98 Favored 'General case' 0 N--CA 1.453 -0.312 0 C-N-CA 119.218 -0.993 . . . . 3.0299999999999998 108.891 -178.588 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 1.2 mm? -65.64 -18.1 65.08 Favored 'General case' 0 N--CA 1.451 -0.423 0 CA-C-O 117.866 -1.064 . . . . 0.55000000000000004 112.114 178.851 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 6.0 mttt -65.83 -44.65 84.91 Favored 'General case' 0 CA--C 1.516 -0.335 0 CA-C-N 120.824 1.647 . . . . 1.23 108.299 169.371 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 95.8 t -58.2 -60.28 2.44 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.497 0 CA-C-N 118.757 0.708 . . . . 0.5 110.051 171.254 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -57.37 -45.54 84.34 Favored 'General case' 0 CA--C 1.53 0.202 0 CA-C-N 119.512 1.051 . . . . 2.3500000000000001 111.812 -169.721 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 56.6 tttt -58.09 -53.44 58.25 Favored 'General case' 0 N--CA 1.451 -0.404 0 C-N-CA 123.723 0.809 . . . . 2.1600000000000001 109.712 177.03 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 4.3 m-20 -77.23 -6.5 53.27 Favored 'General case' 0 N--CA 1.453 -0.283 0 CA-C-O 118.825 -0.607 . . . . 0.92000000000000004 111.229 -173.927 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -164.46 72.9 1.61 Allowed Pre-proline 0 N--CA 1.447 -0.609 0 C-N-CA 124.952 1.301 . . . . 0.39000000000000001 110.587 -171.75 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 72.9 Cg_endo -74.27 16.89 0.55 Allowed 'Trans proline' 0 CA--C 1.536 0.584 0 C-N-CA 123.461 2.774 . . . . 1.47 113.283 -173.861 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -133.75 -41.82 0.84 Allowed 'General case' 0 N--CA 1.454 -0.252 0 C-N-CA 125.385 1.474 . . . . 2.6899999999999999 109.29 -177.635 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 5.7 m -54.55 -48.1 72.4 Favored 'General case' 0 CA--C 1.521 -0.154 0 O-C-N 121.159 -0.963 . . . . 0.38 110.615 171.517 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 2.7 t80 -59.12 -46.67 87.72 Favored 'General case' 0 CA--C 1.506 -0.733 0 C-N-CA 119.849 -0.741 . . . . 2.4500000000000002 110.492 179.342 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 50.2 tt0 -54.09 -37.13 63.93 Favored 'General case' 0 N--CA 1.442 -0.85 0 O-C-N 123.964 0.79 . . . . 2.4100000000000001 110.319 177.708 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 4.4 t80 -60.66 -57.63 11.9 Favored 'General case' 0 N--CA 1.457 -0.078 0 CA-C-N 118.549 0.613 . . . . 0.93999999999999995 109.568 -174.557 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 3.2 mp -60.9 -39.01 80.58 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.284 0 N-CA-C 109.588 -0.523 . . . . 0.75 109.588 177.598 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 9.3 t-20 -62.0 -35.41 78.43 Favored 'General case' 0 N--CA 1.455 -0.198 0 O-C-N 121.597 -0.689 . . . . 2.4500000000000002 111.443 -174.789 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -57.16 -52.45 65.28 Favored 'General case' 0 C--O 1.231 0.11 0 C-N-CA 125.679 1.592 . . . . 2.1000000000000001 108.303 174.904 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 7.6 mm100 -78.6 85.91 4.62 Favored 'General case' 0 N--CA 1.449 -0.486 0 CA-C-N 115.832 -0.622 . . . . 2.98 109.796 177.577 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 2.9 pt -39.71 118.64 0.13 Allowed 'Isoleucine or valine' 0 CA--C 1.533 0.302 0 C-N-CA 124.271 1.029 . . . . 5.1799999999999997 111.038 177.176 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -80.51 60.42 3.88 Favored 'General case' 0 CA--C 1.532 0.286 0 O-C-N 121.789 -0.57 . . . . 12.07 111.221 -175.307 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 102' ' ' PHE . . . . . . . . . . . . . 81.2 m-85 -142.04 44.33 1.68 Allowed 'General case' 0 N--CA 1.452 -0.359 0 C-N-CA 125.708 1.603 . . . . 8.8900000000000006 107.38 -179.574 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 11.2 tp -66.23 149.88 11.26 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.247 0 N-CA-C 108.275 -1.009 . . . . 4.54 108.275 172.433 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 104' ' ' ILE . . . . . . . . . . . . . 97.7 mt -126.84 159.18 36.97 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.186 0 N-CA-C 106.301 -1.74 . . . . 7.6900000000000004 106.301 -176.316 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 6.8 p30 -124.6 162.99 22.9 Favored 'General case' 0 C--N 1.332 -0.195 0 C-N-CA 124.146 0.978 . . . . 7.6200000000000001 108.424 -177.481 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 14.1 t . . . . . 0 C--O 1.252 1.219 0 CA-C-O 116.469 -1.729 . . . . 12.390000000000001 109.068 -160.122 . . . . . . . . 0 0 . 1 . 027 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.466 0.674 0 N-CA-C 107.988 -2.045 . . . . 14.24 107.988 . . . . . . . . . 0 0 . 1 . 027 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 1.7 m -65.82 164.14 15.38 Favored 'General case' 0 CA--C 1.537 0.445 0 C-N-CA 124.352 1.061 . . . . 13.380000000000001 110.728 179.582 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 5.8 ttmt -159.78 147.41 16.88 Favored 'General case' 0 C--N 1.339 0.135 0 N-CA-C 108.784 -0.821 . . . . 18.239999999999998 108.784 177.448 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 156.19 -172.5 34.07 Favored Glycine 0 C--N 1.333 0.371 0 N-CA-C 108.734 -1.746 . . . . 13.130000000000001 108.734 -174.925 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 28.0 m -98.01 -158.76 0.09 OUTLIER 'Isoleucine or valine' 0 N--CA 1.444 -0.759 0 N-CA-C 106.966 -1.494 . . . . 13.4 106.966 159.837 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 5.3 pt-20 -99.66 119.98 38.97 Favored 'General case' 0 N--CA 1.447 -0.591 0 CA-C-O 121.879 0.847 . . . . 9.2699999999999996 110.83 176.58 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 1.6 mm? -112.4 30.35 7.16 Favored 'General case' 0 N--CA 1.453 -0.297 0 C-N-CA 124.164 0.986 . . . . 9.1799999999999997 109.936 -179.004 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER 68.31 -68.56 0.17 Allowed 'General case' 0 N--CA 1.465 0.303 0 C-N-CA 125.316 1.447 . . . . 7.0199999999999996 110.606 -172.141 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 3.5 m120 -50.12 -34.06 20.86 Favored 'General case' 0 CA--C 1.513 -0.475 0 C-N-CA 124.64 1.176 . . . . 2.4900000000000002 112.793 172.21 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 16.3 t70 -68.18 -40.67 82.17 Favored 'General case' 0 C--O 1.223 -0.332 0 C-N-CA 119.932 -0.707 . . . . 3.6200000000000001 110.913 177.99 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 50.6 m -62.66 -57.88 9.46 Favored 'General case' 0 N--CA 1.455 -0.212 0 CA-C-N 119.154 0.888 . . . . 1.9199999999999999 110.99 176.518 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 9.1 pt-20 -70.12 -21.13 63.14 Favored 'General case' 0 CA--C 1.536 0.412 0 O-C-N 121.625 -0.672 . . . . 3.3700000000000001 110.404 -176.375 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -76.61 -38.79 31.41 Favored Glycine 0 CA--C 1.528 0.89 0 C-N-CA 124.366 0.984 . . . . 0.57999999999999996 111.873 175.668 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 34.0 t80 -58.21 -51.98 67.49 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 118.72 1.26 . . . . 3.3900000000000001 109.344 -174.876 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 0.7 OUTLIER -63.1 -33.97 63.94 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.469 0 O-C-N 121.625 -0.672 . . . . 0.5 111.956 179.694 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 2.2 t-160 -60.29 -53.69 54.63 Favored 'General case' 0 CA--C 1.533 0.32 0 N-CA-C 106.7 -1.592 . . . . 0.56999999999999995 106.7 176.554 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 86.4 mt-10 -51.54 -44.7 62.75 Favored 'General case' 0 C--O 1.223 -0.32 0 C-N-CA 124.455 1.102 . . . . 2.4700000000000002 110.05 177.669 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -53.37 -56.98 12.3 Favored 'General case' 0 CA--C 1.519 -0.25 0 C-N-CA 124.476 1.11 . . . . 2.4100000000000001 110.892 177.987 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -48.03 -46.66 26.6 Favored Glycine 0 CA--C 1.523 0.537 0 N-CA-C 110.466 -1.054 . . . . 0.5 110.466 175.652 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 20' ' ' HIS . . . . . 0.64 ' CE1' ' HB1' ' A' ' 64' ' ' ALA . 2.6 t-160 -60.68 -46.35 90.67 Favored 'General case' 0 N--CA 1.45 -0.428 0 O-C-N 122.052 -0.675 . . . . 1.79 112.028 -179.525 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -60.38 -31.46 70.37 Favored 'General case' 0 N--CA 1.447 -0.575 0 N-CA-C 109.428 -0.582 . . . . 0.67000000000000004 109.428 -179.214 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 26.3 t -66.47 -41.54 88.77 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.182 0 C-N-CA 118.567 -1.253 . . . . 0.85999999999999999 111.682 175.44 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 33.3 t0 -57.87 -29.54 65.1 Favored 'General case' 0 N--CA 1.464 0.243 0 CA-C-O 122.098 0.952 . . . . 2.0600000000000001 111.114 174.925 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 6.8 t70 -74.17 -51.99 13.85 Favored 'General case' 0 N--CA 1.446 -0.626 0 N-CA-C 108.407 -0.96 . . . . 2.2799999999999998 108.407 -174.482 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 1.2 t80 -59.75 -47.8 84.22 Favored 'General case' 0 N--CA 1.454 -0.249 0 C-N-CA 124.232 1.013 . . . . 3.6400000000000001 109.304 -179.161 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -61.32 -30.06 70.26 Favored 'General case' 0 N--CA 1.446 -0.638 0 CA-C-O 118.284 -0.865 . . . . 0.90000000000000002 111.469 178.289 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -88.71 -4.32 76.1 Favored Glycine 0 CA--C 1.525 0.68 0 CA-C-N 119.839 1.199 . . . . 1.3999999999999999 112.56 179.188 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -90.15 -49.55 6.5 Favored 'General case' 0 N--CA 1.451 -0.416 0 N-CA-C 108.715 -0.846 . . . . 2.6699999999999999 108.715 173.012 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 3.0 mm? -79.58 -38.62 33.62 Favored 'General case' 0 N--CA 1.449 -0.509 0 C-N-CA 125.151 1.38 . . . . 1.6100000000000001 111.976 -177.037 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 2.7 mt -116.51 173.65 6.49 Favored 'General case' 0 N--CA 1.445 -0.678 0 N-CA-C 106.32 -1.733 . . . . 2.23 106.32 -177.994 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER 57.48 99.18 0.02 OUTLIER 'General case' 0 CA--C 1.537 0.468 0 CA-C-O 122.941 1.353 . . . . 5.6600000000000001 112.063 -177.07 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 24.5 mttm -68.62 168.51 12.89 Favored 'General case' 0 C--O 1.226 -0.141 0 O-C-N 120.216 -1.553 . . . . 7.7199999999999998 110.255 -176.583 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -58.67 88.53 0.01 OUTLIER 'General case' 0 CA--C 1.533 0.31 0 C-N-CA 124.616 1.166 . . . . 7.0899999999999999 112.284 -165.234 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 1.1 mt-30 -149.47 -48.02 0.14 Allowed 'General case' 0 C--N 1.332 -0.165 0 C-N-CA 124.312 1.045 . . . . 11.039999999999999 109.968 -174.322 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 34.4 t -127.78 157.47 40.31 Favored 'General case' 0 N--CA 1.452 -0.37 0 N-CA-C 106.564 -1.643 . . . . 5.8399999999999999 106.564 167.05 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 16.3 t70 -91.87 143.09 26.86 Favored 'General case' 0 N--CA 1.449 -0.476 0 N-CA-C 107.091 -1.448 . . . . 5.2199999999999998 107.091 174.393 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 4.0 mp 63.87 152.13 0.04 OUTLIER 'General case' 0 CA--C 1.541 0.617 0 C-N-CA 125.917 1.687 . . . . 1.9199999999999999 111.044 -168.266 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 11.2 p -66.09 -45.22 91.06 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.498 0 O-C-N 120.337 -1.477 . . . . 2.79 109.866 -174.413 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 24.1 p 46.32 -146.7 0.17 Allowed 'General case' 0 CA--C 1.538 0.49 0 C-N-CA 125.07 1.348 . . . . 3.6400000000000001 112.255 179.847 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 40.3 t-20 -100.59 76.4 1.82 Allowed 'General case' 0 C--O 1.232 0.153 0 O-C-N 121.034 -1.041 . . . . 7.3399999999999999 110.405 -177.349 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 25.3 p -69.04 -49.86 53.84 Favored 'General case' 0 N--CA 1.453 -0.322 0 CA-C-N 116.481 -0.327 . . . . 3.7599999999999998 111.191 -178.135 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 6.8 mtpm? -57.5 -34.75 69.4 Favored 'General case' 0 N--CA 1.465 0.318 0 N-CA-C 113.5 0.926 . . . . 7.2699999999999996 113.5 -175.958 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 34.1 mmtt -134.44 97.21 3.76 Favored 'General case' 0 N--CA 1.452 -0.34 0 N-CA-C 106.575 -1.639 . . . . 6.6200000000000001 106.575 -177.282 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 27.3 t80 -48.85 95.23 0.01 OUTLIER 'General case' 0 N--CA 1.456 -0.154 0 C-N-CA 125.396 1.478 . . . . 7.0 110.88 -167.672 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 44.9 pt 39.1 79.67 0.02 OUTLIER 'Isoleucine or valine' 0 CA--C 1.538 0.497 0 C-N-CA 126.4 1.88 . . . . 3.1099999999999999 112.911 -172.05 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 42.2 t0 -116.48 -58.32 2.1 Favored 'General case' 0 N--CA 1.467 0.41 0 C-N-CA 123.693 0.797 . . . . 2.2799999999999998 110.335 -174.145 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 5.4 mm -51.94 -54.74 12.18 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.397 0 C-N-CA 124.74 1.216 . . . . 0.53000000000000003 109.523 172.673 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 48' ' ' PHE . . . . . 0.474 ' CD2' ' HE3' ' A' ' 49' ' ' LYS . 22.1 t80 -57.77 -28.62 64.14 Favored 'General case' 0 N--CA 1.452 -0.325 0 O-C-N 120.414 -1.429 . . . . 0.46999999999999997 112.148 176.538 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . 0.474 ' HE3' ' CD2' ' A' ' 48' ' ' PHE . 0.2 OUTLIER -69.17 -46.21 68.08 Favored 'General case' 0 N--CA 1.45 -0.431 0 O-C-N 120.353 -1.467 . . . . 1.1100000000000001 111.251 -178.317 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 52.3 tp10 -83.68 -66.01 0.94 Allowed 'General case' 0 C--N 1.33 -0.264 0 N-CA-C 109.009 -0.738 . . . . 2.8199999999999998 109.009 -179.688 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 29.9 mp0 -69.19 -32.6 72.0 Favored 'General case' 0 C--O 1.236 0.384 0 O-C-N 121.384 -0.823 . . . . 2.6899999999999999 111.35 -172.082 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -72.14 42.27 0.78 Allowed Glycine 0 CA--C 1.529 0.913 0 C-N-CA 124.652 1.12 . . . . 0.39000000000000001 113.949 172.5 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 22.9 t -146.38 24.43 1.26 Allowed 'General case' 0 N--CA 1.447 -0.584 0 O-C-N 121.246 -1.149 . . . . 1.5800000000000001 109.511 159.257 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -138.06 -27.99 0.88 Allowed 'General case' 0 C--N 1.342 0.273 0 N-CA-C 113.778 1.029 . . . . 2.2799999999999998 113.778 -169.979 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . 0.624 HD22 HG22 ' A' ' 85' ' ' VAL . 32.0 mt -68.28 -40.02 81.96 Favored 'General case' 0 C--N 1.333 -0.151 0 CA-C-N 119.06 0.845 . . . . 0.45000000000000001 110.793 -179.441 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER 177.71 165.42 0.65 Allowed 'General case' 0 C--N 1.33 -0.253 0 C-N-CA 125.511 1.524 . . . . 0.44 106.961 -173.477 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 7.2 m -59.8 -35.18 74.14 Favored 'General case' 0 N--CA 1.453 -0.278 0 C-N-CA 123.027 0.531 . . . . 1.05 110.637 170.262 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -71.18 -6.09 36.84 Favored 'General case' 0 CA--C 1.533 0.306 0 C-N-CA 122.88 0.472 . . . . 1.01 112.032 176.127 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -101.85 4.23 52.97 Favored Glycine 0 CA--C 1.524 0.606 0 C-N-CA 124.524 1.059 . . . . 0.54000000000000004 111.196 172.853 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -114.1 -17.89 11.81 Favored 'General case' 0 CA--C 1.527 0.064 0 C-N-CA 124.356 1.062 . . . . 3.5899999999999999 111.514 177.274 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 13.9 p -61.74 -160.13 0.01 OUTLIER 'General case' 0 CA--C 1.541 0.607 0 C-N-CA 125.443 1.497 . . . . 0.84999999999999998 109.691 168.069 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 3.7 m120 -50.49 146.62 5.26 Favored 'General case' 0 CA--C 1.535 0.373 0 O-C-N 119.983 -1.698 . . . . 2.1600000000000001 111.469 -177.081 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 38.8 tt0 -56.52 -30.62 63.24 Favored 'General case' 0 N--CA 1.467 0.398 0 CA-C-O 121.443 0.64 . . . . 2.6499999999999999 110.493 179.095 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 64' ' ' ALA . . . . . 0.64 ' HB1' ' CE1' ' A' ' 20' ' ' HIS . . . -53.69 -45.05 70.24 Favored 'General case' 0 N--CA 1.452 -0.367 0 C-N-CA 123.841 0.857 . . . . 0.57999999999999996 112.183 172.643 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 8.7 mt-10 -72.75 -39.26 66.99 Favored 'General case' 0 C--O 1.221 -0.397 0 O-C-N 121.562 -0.712 . . . . 2.29 110.756 178.484 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 55.4 t80 -51.45 -52.93 42.2 Favored 'General case' 0 C--N 1.332 -0.159 0 C-N-CA 123.337 0.655 . . . . 0.31 111.18 173.99 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 73.4 t80 -66.61 -45.54 78.83 Favored 'General case' 0 N--CA 1.449 -0.492 0 C-N-CA 123.711 0.804 . . . . 0.40999999999999998 110.579 -178.567 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -60.12 -47.6 85.22 Favored 'General case' 0 CA--C 1.539 0.537 0 O-C-N 121.198 -0.939 . . . . 0.25 111.963 -178.666 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 48.1 mm-40 -55.41 -44.79 76.55 Favored 'General case' 0 CA--C 1.517 -0.292 0 C-N-CA 125.011 1.324 . . . . 4.2300000000000004 109.975 169.36 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -55.7 -45.94 77.77 Favored 'General case' 0 N--CA 1.446 -0.632 0 CA-C-O 118.06 -0.971 . . . . 0.39000000000000001 109.508 -175.869 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 73.9 t80 -56.82 -50.8 71.3 Favored 'General case' 0 N--CA 1.464 0.271 0 CA-C-N 119.343 0.974 . . . . 2.6600000000000001 111.913 172.799 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 18.3 ttp180 -46.15 -58.02 4.0 Favored 'General case' 0 CA--C 1.531 0.25 0 CA-C-N 118.283 0.492 . . . . 2.6099999999999999 110.826 178.103 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . 0.611 HD12 HG23 ' A' ' 85' ' ' VAL . 0.1 OUTLIER -65.14 -32.51 74.23 Favored 'General case' 0 C--N 1.324 -0.528 0 C-N-CA 125.332 1.453 . . . . 0.40999999999999998 110.92 -178.428 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild full ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -59.48 -39.57 84.14 Favored 'General case' 0 CA--C 1.517 -0.315 0 C-N-CA 123.701 0.8 . . . . 2.52 110.012 -178.047 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 22.9 p80 -90.52 -36.45 14.48 Favored 'General case' 0 N--CA 1.45 -0.443 0 CA-C-O 115.723 -2.084 . . . . 0.95999999999999996 110.867 -176.948 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 15.9 m -8.14 111.32 0.01 OUTLIER 'General case' 0 C--N 1.348 0.53 0 C-N-CA 127.883 2.473 . . . . 1.03 113.342 -171.765 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 4.1 p -46.56 -42.62 16.19 Favored 'General case' 0 N--CA 1.45 -0.465 0 C-N-CA 125.186 1.394 . . . . 0.97999999999999998 110.567 -177.013 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 78' ' ' ASP . . . . . 0.419 ' OD2' ' HB3' ' A' ' 80' ' ' ALA . 14.6 t0 -70.13 105.63 2.99 Favored 'General case' 0 N--CA 1.447 -0.586 0 C-N-CA 118.073 -1.451 . . . . 2.2599999999999998 110.162 164.333 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 5.9 p-80 -39.38 -43.36 1.19 Allowed 'General case' 0 N--CA 1.45 -0.464 0 CA-C-N 114.457 -1.247 . . . . 4.3399999999999999 113.039 169.657 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 80' ' ' ALA . . . . . 0.419 ' HB3' ' OD2' ' A' ' 78' ' ' ASP . . . -66.98 -40.1 87.35 Favored 'General case' 0 N--CA 1.453 -0.291 0 O-C-N 121.872 -0.517 . . . . 0.91000000000000003 110.195 -172.549 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 81' ' ' GLU . . . . . 0.472 ' OE1' HD13 ' A' ' 73' ' ' LEU . 1.1 tm-20 -50.94 -41.79 59.24 Favored 'General case' 0 C--N 1.328 -0.327 0 C-N-CA 124.604 1.161 . . . . 3.3300000000000001 110.097 172.625 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -63.53 -47.18 82.68 Favored 'General case' 0 CA--C 1.519 -0.234 0 C-N-CA 119.327 -0.949 . . . . 3.2599999999999998 108.795 176.926 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . 0.403 HD13 ' HA ' ' A' ' 83' ' ' LEU . 2.1 mm? -56.57 -25.11 51.52 Favored 'General case' 0 N--CA 1.456 -0.129 0 CA-C-O 118.042 -0.98 . . . . 0.62 113.308 174.061 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 14.9 mptt -64.64 -48.33 75.23 Favored 'General case' 0 CA--C 1.52 -0.21 0 CA-C-N 121.082 1.764 . . . . 3.04 108.956 172.337 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 85' ' ' VAL . . . . . 0.624 HG22 HD22 ' A' ' 55' ' ' LEU . 2.4 t -57.87 -60.51 2.1 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.5 0 CA-C-N 118.608 0.64 . . . . 0.68999999999999995 109.921 173.488 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 86' ' ' GLN . . . . . 0.436 ' HG2' ' CG ' ' A' ' 93' ' ' PHE . 36.0 mt-30 -52.48 -50.44 62.73 Favored 'General case' 0 N--CA 1.453 -0.32 0 CA-C-N 118.909 0.777 . . . . 4.5899999999999999 111.091 -171.064 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 8.5 pttp -65.02 -41.09 95.61 Favored 'General case' 0 N--CA 1.455 -0.214 0 O-C-N 121.623 -0.673 . . . . 3.3999999999999999 110.842 -179.249 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 89.9 m-20 -79.75 -8.5 59.29 Favored 'General case' 0 CA--C 1.529 0.16 0 O-C-N 122.077 -0.389 . . . . 1.0700000000000001 110.891 -177.27 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 89' ' ' ALA . . . . . 0.542 ' HB2' HD21 ' A' ' 55' ' ' LEU . . . -160.9 62.52 1.63 Allowed Pre-proline 0 N--CA 1.446 -0.648 0 C-N-CA 123.606 0.763 . . . . 0.51000000000000001 110.769 -169.416 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 28.5 Cg_endo -59.99 -35.9 91.61 Favored 'Trans proline' 0 N--CA 1.452 -0.929 0 C-N-CA 122.018 1.812 . . . . 2.1600000000000001 110.56 -174.153 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 3.4 tttt -77.56 -44.23 29.23 Favored 'General case' 0 N--CA 1.453 -0.285 0 C-N-CA 123.496 0.718 . . . . 4.6600000000000001 111.219 -177.038 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 12.0 m -58.21 -42.47 86.26 Favored 'General case' 0 CA--C 1.518 -0.288 0 O-C-N 121.22 -0.925 . . . . 0.53000000000000003 110.394 177.734 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 93' ' ' PHE . . . . . 0.436 ' CG ' ' HG2' ' A' ' 86' ' ' GLN . 56.3 t80 -54.9 -51.38 66.2 Favored 'General case' 0 CA--C 1.502 -0.893 0 C-N-CA 120.07 -0.652 . . . . 2.7400000000000002 111.161 178.144 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 36.6 tt0 -50.94 -35.61 34.24 Favored 'General case' 0 N--CA 1.445 -0.701 0 O-C-N 124.374 1.046 . . . . 2.0299999999999998 111.016 178.74 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 4.1 t80 -58.75 -58.95 6.32 Favored 'General case' 0 CA--C 1.532 0.288 0 C-N-CA 123.268 0.627 . . . . 0.97999999999999998 110.102 -177.55 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 3.9 mp -62.89 -35.29 70.55 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.128 0 O-C-N 121.419 -0.801 . . . . 0.88 109.59 178.781 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -63.23 -29.81 71.08 Favored 'General case' 0 N--CA 1.452 -0.328 0 C-N-CA 122.693 0.397 . . . . 2.0 110.206 -179.012 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 10.7 t70 -70.91 -45.72 63.79 Favored 'General case' 0 C--N 1.333 -0.116 0 CA-C-O 121.546 0.689 . . . . 2.5600000000000001 109.734 174.57 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 5.5 mm-40 -62.08 -52.57 63.36 Favored 'General case' 0 CA--C 1.532 0.286 0 C-N-CA 123.493 0.717 . . . . 3.3700000000000001 111.893 -175.015 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -75.5 103.71 3.32 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.291 0 N-CA-C 107.575 -1.268 . . . . 4.7199999999999998 107.575 -174.167 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 4.2 tmtt? -154.64 -42.82 0.09 Allowed 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.016 -0.538 . . . . 10.550000000000001 110.423 -165.386 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 102' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -135.75 -46.26 0.67 Allowed 'General case' 0 N--CA 1.456 -0.141 0 C-N-CA 124.186 0.994 . . . . 8.5399999999999991 109.963 177.566 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 7.2 tp -61.39 136.72 24.6 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.327 0 N-CA-C 109.555 -0.535 . . . . 5.8200000000000003 109.555 178.428 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 104' ' ' ILE . . . . . . . . . . . . . 7.9 tp -155.0 -53.89 0.02 OUTLIER 'Isoleucine or valine' 0 CA--C 1.528 0.113 0 N-CA-C 109.519 -0.548 . . . . 9.2899999999999991 109.519 176.793 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 2.9 t-20 -158.02 175.9 13.23 Favored 'General case' 0 C--O 1.233 0.212 0 N-CA-C 107.787 -1.19 . . . . 6.9800000000000004 107.787 176.932 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 89.5 p . . . . . 0 C--O 1.248 0.979 0 CA-C-O 116.354 -1.784 . . . . 9.5600000000000005 108.15 170.188 . . . . . . . . 0 0 . 1 . 028 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.472 1.087 0 N-CA-C 108.932 -1.667 . . . . 15.25 108.932 . . . . . . . . . 0 0 . 1 . 028 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 13.1 m -153.19 84.5 1.2 Allowed 'General case' 0 CA--C 1.519 -0.228 0 CA-C-N 118.652 1.226 . . . . 17.280000000000001 109.935 -177.759 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 2.6 ttmt -167.1 41.37 0.05 OUTLIER 'General case' 0 C--O 1.224 -0.246 0 C-N-CA 121.047 -0.261 . . . . 20.850000000000001 111.534 178.315 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 58.77 39.54 93.83 Favored Glycine 0 C--N 1.336 0.559 0 N-CA-C 111.586 -0.606 . . . . 15.23 111.586 -175.103 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 30.2 m -84.81 -169.93 0.13 Allowed 'Isoleucine or valine' 0 N--CA 1.439 -0.99 0 N-CA-C 109.627 -0.509 . . . . 12.35 109.627 179.466 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 12.2 pt-20 -82.02 111.04 17.81 Favored 'General case' 0 N--CA 1.448 -0.559 0 CA-C-O 122.31 1.052 . . . . 8.5500000000000007 111.114 179.779 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -95.55 40.37 1.11 Allowed 'General case' 0 N--CA 1.451 -0.379 0 N-CA-C 108.498 -0.927 . . . . 10.380000000000001 108.498 -178.942 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 69.7 mtt180 -137.52 -84.47 0.32 Allowed 'General case' 0 N--CA 1.448 -0.575 0 C-N-CA 125.714 1.605 . . . . 7.1900000000000004 107.504 -173.022 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 2.3 m120 -62.68 -61.42 2.43 Favored 'General case' 0 C--O 1.224 -0.27 0 CA-C-N 119.291 0.951 . . . . 2.96 111.953 179.276 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 32.7 t70 -52.87 -43.22 65.95 Favored 'General case' 0 N--CA 1.465 0.28 0 CA-C-N 119.425 1.011 . . . . 2.3999999999999999 111.309 179.642 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 62.0 m -58.61 -60.43 3.82 Favored 'General case' 0 C--O 1.225 -0.201 0 O-C-N 121.575 -0.703 . . . . 1.5800000000000001 112.655 177.242 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . 0.504 ' HA ' HD11 ' A' ' 15' ' ' ILE . 30.0 mt-10 -69.36 -37.27 77.53 Favored 'General case' 0 C--N 1.329 -0.321 0 C-N-CA 125.076 1.35 . . . . 3.3300000000000001 109.998 -168.825 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -54.36 -63.77 4.9 Favored Glycine 0 CA--C 1.526 0.723 0 N-CA-C 109.993 -1.243 . . . . 0.71999999999999997 109.993 167.079 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 79.4 t80 -49.84 -55.9 12.46 Favored 'General case' 0 C--O 1.224 -0.256 0 C-N-CA 124.031 0.932 . . . . 3.1200000000000001 111.28 -175.635 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . 0.504 HD11 ' HA ' ' A' ' 12' ' ' GLU . 0.9 OUTLIER -66.69 -31.0 51.54 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.192 0 O-C-N 121.457 -0.777 . . . . 0.5 112.632 -179.199 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild full ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 5.7 t60 -59.65 -57.2 13.97 Favored 'General case' 0 C--N 1.341 0.228 0 N-CA-C 106.406 -1.702 . . . . 0.62 106.406 176.359 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 44.0 mt-10 -54.11 -39.51 66.47 Favored 'General case' 0 N--CA 1.452 -0.343 0 C-N-CA 124.607 1.163 . . . . 2.1000000000000001 110.713 178.384 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 4.0 t80 -58.78 -48.08 82.5 Favored 'General case' 0 CA--C 1.521 -0.16 0 C-N-CA 124.054 0.942 . . . . 2.02 110.488 178.625 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -51.15 -45.44 51.74 Favored Glycine 0 CA--C 1.525 0.67 0 N-CA-C 110.322 -1.111 . . . . 0.41999999999999998 110.322 172.983 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 20' ' ' HIS . . . . . 0.544 ' CE1' ' HB1' ' A' ' 64' ' ' ALA . 2.3 t-160 -60.81 -48.68 80.72 Favored 'General case' 0 N--CA 1.45 -0.426 0 O-C-N 122.109 -0.642 . . . . 1.8799999999999999 111.32 179.434 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -60.3 -30.89 69.77 Favored 'General case' 0 N--CA 1.453 -0.319 0 O-C-N 121.696 -0.628 . . . . 0.67000000000000004 110.169 179.846 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 74.2 t -69.95 -39.47 77.52 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.163 0 O-C-N 121.338 -0.851 . . . . 0.83999999999999997 110.633 176.8 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 9.5 t0 -59.49 -30.66 68.71 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-O 121.364 0.602 . . . . 2.1400000000000001 110.698 172.242 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 8.5 t0 -67.88 -52.45 36.34 Favored 'General case' 0 N--CA 1.452 -0.367 0 N-CA-C 107.714 -1.217 . . . . 1.99 107.714 -174.881 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 40.8 t80 -56.08 -49.61 73.32 Favored 'General case' 0 N--CA 1.454 -0.231 0 CA-C-N 115.898 -0.592 . . . . 2.4199999999999999 110.239 177.869 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -57.6 -38.71 75.36 Favored 'General case' 0 N--CA 1.448 -0.537 0 C-N-CA 120.851 -0.34 . . . . 1.04 111.206 -179.332 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -71.46 -41.13 58.8 Favored Glycine 0 CA--C 1.525 0.668 0 N-CA-C 111.084 -0.806 . . . . 1.0900000000000001 111.084 -179.194 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 1.7 t80 -61.77 -47.2 86.23 Favored 'General case' 0 N--CA 1.454 -0.242 0 C-N-CA 123.487 0.715 . . . . 2.0499999999999998 109.411 -176.39 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -81.81 -32.65 31.19 Favored 'General case' 0 N--CA 1.451 -0.41 0 C-N-CA 123.275 0.63 . . . . 1.9299999999999999 112.432 -176.59 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 2.6 mt -124.53 75.61 1.42 Allowed 'General case' 0 N--CA 1.451 -0.386 0 N-CA-C 107.106 -1.442 . . . . 2.21 107.106 -169.487 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -46.92 -51.76 16.13 Favored 'General case' 0 N--CA 1.468 0.453 0 C-N-CA 124.635 1.174 . . . . 6.6399999999999997 111.301 -165.398 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . 0.426 ' HE3' ' HA ' ' A' ' 32' ' ' LYS . 0.1 OUTLIER 34.27 74.6 0.06 Allowed 'General case' 0 CA--C 1.54 0.563 0 C-N-CA 127.819 2.448 . . . . 9.6699999999999999 113.072 174.215 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 17.2 t-20 71.09 140.97 0.05 OUTLIER 'General case' 0 C--O 1.22 -0.455 0 C-N-CA 130.043 3.337 . . . . 8.4800000000000004 112.381 -175.099 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 11.3 pt20 -80.62 36.44 0.38 Allowed 'General case' 0 CA--C 1.534 0.36 0 C-N-CA 123.37 0.668 . . . . 8.6999999999999993 111.563 -176.655 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -147.77 147.04 29.45 Favored 'General case' 0 N--CA 1.451 -0.396 0 N-CA-C 107.793 -1.188 . . . . 7.2000000000000002 107.793 178.809 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 38.5 m-20 54.82 -163.78 0.12 Allowed 'General case' 0 CA--C 1.54 0.581 0 C-N-CA 124.888 1.275 . . . . 11.08 109.923 -173.266 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 2.7 mm? -116.91 -144.49 0.38 Allowed 'General case' 0 CA--C 1.539 0.552 0 N-CA-C 106.831 -1.544 . . . . 4.0199999999999996 106.831 176.277 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 3.0 p -74.61 -24.48 18.5 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.446 0 O-C-N 119.941 -1.725 . . . . 3.6099999999999999 110.392 -179.256 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 8.8 t -49.8 151.75 1.71 Allowed 'General case' 0 CA--C 1.538 0.498 0 C-N-CA 124.956 1.302 . . . . 5.0 111.792 169.143 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 13.5 m-80 38.83 46.2 1.03 Allowed 'General case' 0 CA--C 1.538 0.491 0 C-N-CA 126.214 1.806 . . . . 6.8700000000000001 113.839 -176.875 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 10.5 t -74.13 -65.69 0.81 Allowed 'General case' 0 CA--C 1.537 0.456 0 O-C-N 120.861 -1.149 . . . . 3.4500000000000002 112.377 -177.856 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 3.8 mptt -55.91 -62.16 1.88 Allowed 'General case' 0 N--CA 1.469 0.511 0 O-C-N 121.138 -0.977 . . . . 6.3700000000000001 111.124 -173.677 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -89.52 101.46 14.14 Favored 'General case' 0 N--CA 1.449 -0.497 0 N-CA-C 105.537 -2.023 . . . . 6.3499999999999996 105.537 167.328 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 57.7 m-85 -52.57 128.14 25.08 Favored 'General case' 0 N--CA 1.452 -0.366 0 O-C-N 124.137 0.898 . . . . 5.6600000000000001 108.968 173.44 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 45' ' ' ILE . . . . . 0.406 HD11 ' HE3' ' A' ' 49' ' ' LYS . 5.0 tt 34.36 78.41 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.543 0.7 0 C-N-CA 126.519 1.928 . . . . 2.2599999999999998 112.74 176.76 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 14.8 t70 -140.39 -58.24 0.53 Allowed 'General case' 0 N--CA 1.465 0.31 0 C-N-CA 124.684 1.194 . . . . 2.1200000000000001 110.396 -170.086 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 5.7 mm -53.31 -50.08 49.38 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.19 0 N-CA-C 108.339 -0.986 . . . . 0.46000000000000002 108.339 172.052 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 19.6 t80 -63.61 -25.76 68.38 Favored 'General case' 0 N--CA 1.454 -0.225 0 O-C-N 121.906 -0.496 . . . . 0.41999999999999998 112.008 177.667 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . 0.545 ' HA ' ' CE ' ' A' ' 49' ' ' LYS . 0.6 OUTLIER -71.22 -48.37 51.75 Favored 'General case' 0 N--CA 1.45 -0.43 0 O-C-N 119.774 -1.829 . . . . 1.49 110.888 -178.192 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 22.8 tp10 -85.63 -63.53 1.31 Allowed 'General case' 0 C--N 1.328 -0.331 0 N-CA-C 108.582 -0.896 . . . . 2.6000000000000001 108.582 -176.927 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 3.4 mm-40 -67.22 -32.86 74.2 Favored 'General case' 0 CA--C 1.536 0.407 0 C-N-CA 123.833 0.853 . . . . 2.73 109.789 -170.175 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . 0.446 ' HA2' ' CD1' ' A' ' 66' ' ' PHE . . . -68.05 43.9 0.3 Allowed Glycine 0 CA--C 1.53 1.028 0 C-N-CA 126.917 2.199 . . . . 0.34000000000000002 114.587 171.132 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 33.1 p -154.2 32.25 0.43 Allowed 'General case' 0 N--CA 1.448 -0.536 0 O-C-N 121.104 -1.233 . . . . 1.96 109.869 160.274 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -137.35 -43.94 0.55 Allowed 'General case' 0 CA--C 1.517 -0.296 0 N-CA-C 112.908 0.707 . . . . 1.8100000000000001 112.908 -168.719 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . 0.5 HD22 HG22 ' A' ' 85' ' ' VAL . 15.3 mt -63.11 -36.48 83.74 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 120.872 0.367 . . . . 0.38 110.749 -175.926 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 1.1 t 176.53 171.01 0.45 Allowed 'General case' 0 CA--C 1.531 0.234 0 C-N-CA 125.835 1.654 . . . . 0.45000000000000001 107.501 -177.919 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 20.8 m -57.38 -33.71 68.1 Favored 'General case' 0 N--CA 1.453 -0.306 0 O-C-N 121.713 -0.617 . . . . 0.91000000000000003 110.555 168.016 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -61.15 -30.89 70.66 Favored 'General case' 0 CA--C 1.53 0.199 0 CA-C-N 118.475 0.58 . . . . 1.0800000000000001 110.894 174.207 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -71.8 -11.56 73.69 Favored Glycine 0 C--O 1.221 -0.663 0 O-C-N 121.354 -0.841 . . . . 0.37 111.729 176.524 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 32.1 ttt180 -105.14 -12.54 16.07 Favored 'General case' 0 CA--C 1.533 0.294 0 CA-C-N 118.817 1.308 . . . . 2.7799999999999998 112.473 177.224 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 41.4 p -66.39 -134.9 0.0 OUTLIER 'General case' 0 N--CA 1.47 0.573 0 CA-C-N 118.833 0.742 . . . . 0.77000000000000002 111.211 178.204 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 6.7 t-20 -69.07 152.91 44.62 Favored 'General case' 0 N--CA 1.453 -0.307 0 O-C-N 119.465 -2.022 . . . . 2.8999999999999999 107.943 179.871 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 5.3 tm-20 -60.7 -33.1 72.36 Favored 'General case' 0 CA--C 1.531 0.246 0 CA-C-N 118.72 0.691 . . . . 3.3999999999999999 109.625 177.487 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 64' ' ' ALA . . . . . 0.544 ' HB1' ' CE1' ' A' ' 20' ' ' HIS . . . -61.0 -30.73 70.46 Favored 'General case' 0 N--CA 1.45 -0.435 0 N-CA-C 113.246 0.832 . . . . 0.52000000000000002 113.246 174.848 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 2.4 mt-10 -80.13 -42.31 23.76 Favored 'General case' 0 CA--C 1.51 -0.567 0 CA-C-O 118.392 -0.813 . . . . 2.3599999999999999 110.592 176.5 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 66' ' ' PHE . . . . . 0.446 ' CD1' ' HA2' ' A' ' 52' ' ' GLY . 54.7 t80 -48.99 -49.0 42.92 Favored 'General case' 0 N--CA 1.453 -0.309 0 C-N-CA 123.596 0.758 . . . . 0.33000000000000002 111.164 172.816 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 82.7 t80 -63.29 -44.42 95.11 Favored 'General case' 0 CA--C 1.539 0.53 0 O-C-N 121.319 -0.863 . . . . 0.38 110.772 177.074 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -62.21 -56.44 18.66 Favored 'General case' 0 CA--C 1.54 0.586 0 O-C-N 121.296 -0.878 . . . . 0.31 113.021 -175.594 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 1.1 pp20? -56.19 -38.45 70.98 Favored 'General case' 0 C--N 1.333 -0.123 0 O-C-N 120.962 -1.086 . . . . 3.73 111.204 171.376 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -57.91 -42.55 84.99 Favored 'General case' 0 N--CA 1.45 -0.438 0 CA-C-O 118.493 -0.765 . . . . 0.37 110.562 175.347 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 55.7 t80 -59.98 -50.08 75.16 Favored 'General case' 0 N--CA 1.464 0.268 0 CA-C-N 120.37 1.441 . . . . 2.7999999999999998 111.544 174.453 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 6.9 ttt180 -44.71 -62.22 1.29 Allowed 'General case' 0 N--CA 1.465 0.294 0 N-CA-C 109.097 -0.705 . . . . 2.2799999999999998 109.097 178.08 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . 0.528 HD12 HG23 ' A' ' 85' ' ' VAL . 0.1 OUTLIER -60.43 -37.93 82.47 Favored 'General case' 0 CA--C 1.515 -0.372 0 C-N-CA 125.651 1.58 . . . . 0.41999999999999998 111.107 -177.253 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild full ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 1.6 tmt? -65.81 -33.01 74.86 Favored 'General case' 0 N--CA 1.451 -0.393 0 O-C-N 122.189 -0.319 . . . . 2.8100000000000001 111.263 -174.593 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 75' ' ' HIS . . . . . 0.425 ' CE1' HD12 ' A' ' 15' ' ' ILE . 5.2 p80 -92.8 -20.43 20.74 Favored 'General case' 0 CA--C 1.527 0.096 0 CA-C-O 117.159 -1.4 . . . . 0.87 112.708 177.35 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 76' ' ' SER . . . . . 0.425 ' O ' ' HD2' ' A' ' 82' ' ' ARG . 32.0 m -33.77 114.43 0.19 Allowed 'General case' 0 C--O 1.22 -0.491 0 C-N-CA 125.981 1.712 . . . . 1.1899999999999999 112.446 -169.547 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 1.4 p -46.11 -39.96 10.24 Favored 'General case' 0 C--N 1.326 -0.441 0 C-N-CA 124.863 1.265 . . . . 1.4299999999999999 110.832 -178.968 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 11.5 t0 -65.03 103.42 0.74 Allowed 'General case' 0 N--CA 1.451 -0.407 0 CA-C-O 121.823 0.821 . . . . 1.8700000000000001 110.238 165.486 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 11.7 p80 -46.15 -37.7 7.32 Favored 'General case' 0 N--CA 1.455 -0.212 0 C-N-CA 123.574 0.75 . . . . 4.4699999999999998 112.13 173.316 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -61.1 -47.05 88.09 Favored 'General case' 0 N--CA 1.451 -0.394 0 CA-C-N 118.378 0.535 . . . . 0.75 110.292 -178.555 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 2.9 mt-10 -52.8 -40.22 63.04 Favored 'General case' 0 CA--C 1.512 -0.484 0 CA-C-O 121.116 0.484 . . . . 3.1299999999999999 111.365 177.348 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 82' ' ' ARG . . . . . 0.425 ' HD2' ' O ' ' A' ' 76' ' ' SER . 15.3 mtp180 -64.77 -56.49 13.25 Favored 'General case' 0 N--CA 1.45 -0.468 0 C-N-CA 119.173 -1.011 . . . . 2.46 108.343 178.762 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . 0.418 HD13 ' HA ' ' A' ' 83' ' ' LEU . 0.9 OUTLIER -56.34 -23.77 39.48 Favored 'General case' 0 C--O 1.223 -0.291 0 N-CA-C 113.28 0.844 . . . . 0.56999999999999995 113.28 178.883 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 32.1 mttt -67.66 -45.3 75.68 Favored 'General case' 0 CA--C 1.517 -0.31 0 CA-C-N 120.242 1.383 . . . . 1.6499999999999999 108.777 173.64 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 85' ' ' VAL . . . . . 0.528 HG23 HD12 ' A' ' 73' ' ' LEU . 39.8 t -60.11 -53.48 48.0 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.614 0 CA-C-O 118.661 -0.685 . . . . 0.41999999999999998 110.671 170.95 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 60.1 mt-30 -60.6 -44.59 96.11 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 120.394 1.452 . . . . 4.3099999999999996 110.965 -171.125 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 22.4 tttt -59.87 -51.32 70.24 Favored 'General case' 0 N--CA 1.452 -0.362 0 C-N-CA 123.948 0.899 . . . . 2.2200000000000002 110.6 175.751 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 38.9 m-20 -78.41 -8.24 58.26 Favored 'General case' 0 C--N 1.331 -0.212 0 C-N-CA 122.944 0.498 . . . . 1.1499999999999999 111.474 -174.144 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 89' ' ' ALA . . . . . 0.462 ' HB2' HD21 ' A' ' 55' ' ' LEU . . . -159.37 69.61 3.29 Favored Pre-proline 0 N--CA 1.447 -0.598 0 C-N-CA 125.013 1.325 . . . . 0.42999999999999999 109.305 -173.144 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 36.2 Cg_endo -61.36 -25.76 80.61 Favored 'Trans proline' 0 N--CA 1.453 -0.907 0 C-N-CA 122.454 2.103 . . . . 1.74 110.759 -176.462 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 7.1 mttp -81.62 -52.96 6.64 Favored 'General case' 0 N--CA 1.449 -0.493 0 C-N-CA 123.211 0.604 . . . . 4.79 110.557 177.902 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 2.3 m -55.51 -39.9 71.1 Favored 'General case' 0 N--CA 1.467 0.385 0 CA-C-N 119.28 0.946 . . . . 0.59999999999999998 111.296 -175.67 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 3.2 t80 -48.96 -65.67 0.53 Allowed 'General case' 0 CA--C 1.503 -0.836 0 CA-C-O 121.423 0.63 . . . . 4.6399999999999997 112.562 175.261 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 44.7 tt0 -54.2 -31.98 54.44 Favored 'General case' 0 N--CA 1.44 -0.965 0 CA-C-N 113.926 -1.488 . . . . 1.51 109.727 -178.162 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 4.7 t80 -68.9 -58.53 4.01 Favored 'General case' 0 N--CA 1.451 -0.398 0 C-N-CA 122.87 0.468 . . . . 2.0299999999999998 110.442 -173.102 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 35.5 mm -48.27 -46.41 13.75 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.139 0 C-N-CA 123.9 0.88 . . . . 1.55 109.961 172.279 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 12.4 t-20 -64.82 -32.7 74.52 Favored 'General case' 0 CA--C 1.535 0.373 0 CA-C-N 117.853 0.297 . . . . 1.73 111.631 -176.153 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 12.5 t70 -61.4 -45.38 94.6 Favored 'General case' 0 N--CA 1.464 0.236 0 CA-C-O 121.61 0.719 . . . . 2.0600000000000001 109.404 174.723 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -72.09 -46.93 54.87 Favored 'General case' 0 CA--C 1.536 0.425 0 CA-C-N 115.492 -0.776 . . . . 4.25 110.805 -172.137 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 20.7 mm -72.19 97.31 0.7 Allowed 'Isoleucine or valine' 0 N--CA 1.454 -0.237 0 N-CA-C 108.498 -0.927 . . . . 6.9000000000000004 108.498 -175.291 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -134.27 84.83 2.14 Favored 'General case' 0 C--O 1.222 -0.349 0 O-C-N 121.601 -0.687 . . . . 9.7200000000000006 109.498 177.376 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 102' ' ' PHE . . . . . . . . . . . . . 7.8 m-85 48.58 89.12 0.02 OUTLIER 'General case' 0 CA--C 1.535 0.402 0 C-N-CA 125.658 1.583 . . . . 7.8899999999999997 112.67 178.437 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 0.5 OUTLIER -112.69 4.6 8.19 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.489 0 O-C-N 121.897 -0.502 . . . . 4.5599999999999996 111.418 179.495 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 104' ' ' ILE . . . . . . . . . . . . . 6.9 pt -87.43 68.53 0.62 Allowed 'Isoleucine or valine' 0 CA--C 1.529 0.164 0 O-C-N 120.813 -1.18 . . . . 8.8200000000000003 110.46 -176.768 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 1.5 t-20 70.25 176.86 0.27 Allowed 'General case' 0 CA--C 1.534 0.33 0 C-N-CA 123.955 0.902 . . . . 7.9299999999999997 110.436 -178.389 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 20.3 t . . . . . 0 C--O 1.253 1.238 0 CA-C-O 116.574 -1.679 . . . . 13.279999999999999 110.661 -174.987 . . . . . . . . 0 0 . 1 . 029 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . 0.533 ' HA2' ' OE2' ' A' ' 17' ' ' GLU . . . . . . . . 0 N--CA 1.469 0.862 0 N-CA-C 109.638 -1.385 . . . . 12.25 109.638 . . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 11.5 p -125.85 -105.95 0.33 Allowed 'General case' 0 N--CA 1.449 -0.482 0 N-CA-C 106.038 -1.838 . . . . 12.44 106.038 170.628 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 71.85 166.21 0.3 Allowed 'General case' 0 N--CA 1.466 0.333 0 C-N-CA 125.965 1.706 . . . . 15.85 111.038 -176.378 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 95.89 -167.92 25.8 Favored Glycine 0 C--N 1.333 0.415 0 N-CA-C 110.499 -1.04 . . . . 11.77 110.499 177.132 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 33.5 m -95.52 -163.2 0.11 Allowed 'Isoleucine or valine' 0 N--CA 1.443 -0.801 0 N-CA-C 108.027 -1.101 . . . . 12.75 108.027 169.549 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 9.8 pt-20 -81.51 121.97 26.96 Favored 'General case' 0 N--CA 1.45 -0.43 0 CA-C-O 121.734 0.778 . . . . 10.15 110.877 174.52 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . 0.437 HD22 ' N ' ' A' ' 7' ' ' LEU . 0.0 OUTLIER -158.04 38.99 0.26 Allowed 'General case' 0 N--CA 1.451 -0.382 0 C-N-CA 124.653 1.181 . . . . 8.1999999999999993 110.372 178.572 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 76.96 -55.66 0.55 Allowed 'General case' 0 N--CA 1.468 0.463 0 C-N-CA 125.317 1.447 . . . . 9.6199999999999992 111.776 -176.999 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 1.9 m120 -55.94 -33.96 65.21 Favored 'General case' 0 CA--C 1.51 -0.583 0 C-N-CA 123.974 0.91 . . . . 2.5099999999999998 111.483 -178.131 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 13.6 t70 -60.95 -52.46 64.91 Favored 'General case' 0 N--CA 1.443 -0.821 0 CA-C-O 119.108 -0.472 . . . . 2.1600000000000001 110.672 173.753 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 19.3 m -58.65 -57.05 14.7 Favored 'General case' 0 CA--C 1.531 0.231 0 CA-C-N 119.444 1.02 . . . . 1.54 111.488 -179.124 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . 0.529 ' HA ' HD11 ' A' ' 15' ' ' ILE . 0.0 OUTLIER -71.23 -27.7 63.66 Favored 'General case' 0 CA--C 1.536 0.416 0 CA-C-O 121.472 0.654 . . . . 3.9500000000000002 110.197 -172.759 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -73.03 -37.78 55.99 Favored Glycine 0 CA--C 1.522 0.504 0 N-CA-C 110.68 -0.968 . . . . 0.62 110.68 176.485 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 15.3 t80 -64.15 -54.86 27.07 Favored 'General case' 0 CA--C 1.517 -0.29 0 CA-C-N 118.082 0.941 . . . . 2.5099999999999998 108.481 -176.359 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . 0.529 HD11 ' HA ' ' A' ' 12' ' ' GLU . 0.6 OUTLIER -61.43 -34.5 61.57 Favored 'Isoleucine or valine' 0 CA--C 1.528 0.113 0 CA-C-O 118.864 -0.589 . . . . 0.52000000000000002 112.579 175.547 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild full ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 4.6 t60 -56.44 -55.09 37.92 Favored 'General case' 0 C--N 1.341 0.211 0 N-CA-C 106.916 -1.513 . . . . 0.52000000000000002 106.916 177.309 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . 0.533 ' OE2' ' HA2' ' A' ' 1' ' ' GLY . 48.3 mt-10 -62.41 -32.11 72.9 Favored 'General case' 0 N--CA 1.452 -0.367 0 CA-C-O 118.709 -0.662 . . . . 2.6299999999999999 111.802 179.608 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 17.7 t80 -59.19 -50.21 74.9 Favored 'General case' 0 N--CA 1.452 -0.326 0 CA-C-N 118.999 0.818 . . . . 2.1699999999999999 109.618 177.34 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -51.87 -43.08 54.49 Favored Glycine 0 CA--C 1.529 0.909 0 N-CA-C 111.011 -0.836 . . . . 0.55000000000000004 111.011 173.889 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 20' ' ' HIS . . . . . 0.523 ' CE1' ' HB1' ' A' ' 64' ' ' ALA . 3.4 t60 -63.28 -53.04 59.04 Favored 'General case' 0 N--CA 1.453 -0.307 0 O-C-N 121.82 -0.812 . . . . 1.7 111.593 -177.738 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -63.65 -27.56 69.31 Favored 'General case' 0 N--CA 1.451 -0.388 0 C-N-CA 123.094 0.558 . . . . 1.02 110.172 -179.352 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 25.1 t -68.28 -42.39 84.44 Favored 'Isoleucine or valine' 0 C--O 1.235 0.307 0 O-C-N 121.342 -0.848 . . . . 1.25 109.646 177.049 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 2.8 t70 -65.24 -20.63 66.52 Favored 'General case' 0 N--CA 1.451 -0.381 0 C-N-CA 120.204 -0.599 . . . . 2.7999999999999998 111.837 176.209 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 28.1 t70 -63.93 -49.51 72.32 Favored 'General case' 0 N--CA 1.453 -0.282 0 N-CA-C 108.014 -1.106 . . . . 2.2200000000000002 108.014 -177.942 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -55.4 -43.48 75.26 Favored 'General case' 0 N--CA 1.453 -0.3 0 CA-C-N 115.354 -0.839 . . . . 4.3399999999999999 111.229 173.049 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -59.45 -39.68 84.39 Favored 'General case' 0 N--CA 1.449 -0.508 0 C-N-CA 119.77 -0.772 . . . . 0.88 110.717 179.619 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -72.87 -40.42 52.3 Favored Glycine 0 CA--C 1.523 0.545 0 CA-C-N 119.083 0.856 . . . . 1.2 111.142 -177.998 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -60.68 -44.57 96.33 Favored 'General case' 0 N--CA 1.452 -0.339 0 O-C-N 121.555 -0.967 . . . . 2.6800000000000002 109.794 -176.246 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 3.0 mm? -79.7 -35.28 39.28 Favored 'General case' 0 N--CA 1.445 -0.698 0 C-N-CA 123.627 0.771 . . . . 1.51 112.338 179.647 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 2.8 mt -125.97 117.89 24.23 Favored 'General case' 0 CA--C 1.535 0.387 0 N-CA-C 108.021 -1.103 . . . . 2.1099999999999999 108.021 -168.037 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 46.4 t0 68.54 68.81 0.3 Allowed 'General case' 0 N--CA 1.474 0.735 0 C-N-CA 126.014 1.726 . . . . 4.6500000000000004 110.802 -166.811 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -69.6 75.96 0.42 Allowed 'General case' 0 CA--C 1.534 0.334 0 C-N-CA 124.552 1.141 . . . . 7.2199999999999998 111.002 -179.447 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 3.0 t-20 -121.95 173.36 7.57 Favored 'General case' 0 C--N 1.328 -0.341 0 O-C-N 121.631 -0.668 . . . . 6.0499999999999998 109.25 -163.827 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 15.5 pt20 -66.64 -20.96 66.11 Favored 'General case' 0 CA--C 1.532 0.264 0 O-C-N 121.379 -0.825 . . . . 7.79 111.353 172.773 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -93.26 115.2 27.8 Favored 'General case' 0 N--CA 1.447 -0.578 0 N-CA-C 106.701 -1.592 . . . . 5.5800000000000001 106.701 173.483 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 26.1 m-20 -71.79 175.27 5.88 Favored 'General case' 0 CA--C 1.534 0.361 0 N-CA-C 109.65 -0.5 . . . . 5.7599999999999998 109.65 172.316 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 5.8 mp 70.17 153.37 0.11 Allowed 'General case' 0 N--CA 1.467 0.377 0 C-N-CA 127.478 2.311 . . . . 2.79 111.754 -173.61 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . 0.412 HG22 ' HB2' ' A' ' 41' ' ' SER . 6.7 p -93.0 33.47 0.13 Allowed 'Isoleucine or valine' 0 CA--C 1.535 0.401 0 O-C-N 121.037 -1.04 . . . . 2.2000000000000002 109.47 178.19 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 12.3 t -52.21 -40.42 61.55 Favored 'General case' 0 N--CA 1.454 -0.255 0 C-N-CA 123.993 0.917 . . . . 2.8399999999999999 110.182 179.103 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 20.4 t-20 -75.48 82.38 2.53 Favored 'General case' 0 N--CA 1.448 -0.528 0 N-CA-C 108.678 -0.86 . . . . 6.5499999999999998 108.678 172.761 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 41' ' ' SER . . . . . 0.412 ' HB2' HG22 ' A' ' 38' ' ' VAL . 13.5 t -156.53 -175.59 5.51 Favored 'General case' 0 N--CA 1.451 -0.411 0 N-CA-C 109.169 -0.678 . . . . 4.9500000000000002 109.169 176.445 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 1.9 tpmt? 56.91 -73.24 0.02 OUTLIER 'General case' 0 N--CA 1.463 0.212 0 C-N-CA 126.754 2.021 . . . . 7.2999999999999998 110.746 -165.522 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 13.4 mttt -141.86 46.56 1.66 Allowed 'General case' 0 C--O 1.222 -0.386 0 C-N-CA 123.639 0.776 . . . . 6.7000000000000002 110.168 176.74 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 29.4 p90 44.14 65.78 0.97 Allowed 'General case' 0 CA--C 1.534 0.348 0 C-N-CA 125.256 1.422 . . . . 6.6200000000000001 113.297 169.433 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 1.1 mp 69.84 100.34 0.05 OUTLIER 'Isoleucine or valine' 0 CA--C 1.541 0.598 0 C-N-CA 124.365 1.066 . . . . 3.6200000000000001 108.159 -171.867 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 50.8 t0 -160.83 -62.85 0.06 Allowed 'General case' 0 N--CA 1.465 0.322 0 O-C-N 120.615 -1.303 . . . . 2.1899999999999999 108.4 -179.474 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 2.0 mm -52.71 -51.6 34.34 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.29 0 C-N-CA 124.781 1.232 . . . . 0.56999999999999995 110.211 -179.203 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 37.5 t80 -57.71 -31.54 66.52 Favored 'General case' 0 N--CA 1.454 -0.254 0 N-CA-C 113.044 0.757 . . . . 0.40999999999999998 113.044 178.305 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . 0.447 ' HA ' ' HE2' ' A' ' 49' ' ' LYS . 1.0 OUTLIER -62.19 -44.8 95.79 Favored 'General case' 0 C--N 1.331 -0.216 0 O-C-N 120.967 -1.083 . . . . 1.0900000000000001 111.091 -178.255 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 17.8 tp10 -90.62 -61.61 1.64 Allowed 'General case' 0 CA--C 1.531 0.25 0 CA-C-O 122.442 1.115 . . . . 2.5800000000000001 109.625 -177.141 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . 0.479 ' OE2' ' HE3' ' A' ' 91' ' ' LYS . 28.3 mm-40 -71.41 -34.23 70.16 Favored 'General case' 0 C--N 1.329 -0.305 0 C-N-CA 123.773 0.829 . . . . 2.4300000000000002 109.889 -169.785 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . 0.427 ' HA2' ' CD1' ' A' ' 66' ' ' PHE . . . -69.84 38.8 0.4 Allowed Glycine 0 CA--C 1.528 0.889 0 C-N-CA 125.705 1.621 . . . . 0.40000000000000002 113.894 168.162 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 34.3 t -153.37 37.82 0.48 Allowed 'General case' 0 N--CA 1.446 -0.656 0 O-C-N 121.133 -1.216 . . . . 1.6799999999999999 108.191 159.371 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -141.18 -47.63 0.4 Allowed 'General case' 0 CA--C 1.518 -0.251 0 N-CA-C 112.384 0.513 . . . . 1.9099999999999999 112.384 -169.203 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . 0.44 HD22 HG22 ' A' ' 85' ' ' VAL . 37.7 mt -63.31 -36.76 84.77 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 120.808 0.337 . . . . 0.51000000000000001 110.911 -176.361 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER 177.09 166.5 0.55 Allowed 'General case' 0 CA--C 1.529 0.172 0 C-N-CA 124.673 1.189 . . . . 0.46000000000000002 108.289 -173.602 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 9.3 m -60.04 -35.07 74.31 Favored 'General case' 0 N--CA 1.454 -0.253 0 C-N-CA 123.212 0.605 . . . . 0.91000000000000003 110.608 168.73 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -67.59 -10.75 54.83 Favored 'General case' 0 CA--C 1.533 0.324 0 C-N-CA 123.126 0.57 . . . . 1.6799999999999999 111.716 175.359 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -93.05 -8.62 61.49 Favored Glycine 0 N--CA 1.445 -0.721 0 C-N-CA 124.887 1.232 . . . . 0.42999999999999999 110.982 174.895 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 37.0 ttt180 -108.88 -11.58 14.99 Favored 'General case' 0 CA--C 1.528 0.118 0 CA-C-N 118.598 1.199 . . . . 2.6800000000000002 111.88 177.725 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 31.9 p -65.33 -156.1 0.01 OUTLIER 'General case' 0 CA--C 1.541 0.611 0 N-CA-C 109.361 -0.607 . . . . 0.87 109.361 170.098 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 1.3 m-20 -52.82 145.84 11.7 Favored 'General case' 0 CA--C 1.53 0.188 0 O-C-N 120.119 -1.613 . . . . 1.72 110.312 -178.01 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 31.4 tt0 -60.97 -27.91 68.61 Favored 'General case' 0 CA--C 1.537 0.461 0 CA-C-O 122.118 0.961 . . . . 3.1699999999999999 111.083 -177.595 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 64' ' ' ALA . . . . . 0.523 ' HB1' ' CE1' ' A' ' 20' ' ' HIS . . . -58.62 -41.45 85.93 Favored 'General case' 0 N--CA 1.452 -0.351 0 C-N-CA 124.848 1.259 . . . . 0.51000000000000001 112.447 170.626 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 6.0 mt-10 -71.73 -42.03 67.8 Favored 'General case' 0 C--O 1.219 -0.534 0 CA-C-O 118.163 -0.922 . . . . 1.79 110.323 176.405 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 66' ' ' PHE . . . . . 0.427 ' CD1' ' HA2' ' A' ' 52' ' ' GLY . 52.7 t80 -50.33 -52.92 32.65 Favored 'General case' 0 N--CA 1.456 -0.143 0 C-N-CA 123.377 0.671 . . . . 0.38 111.077 175.488 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 52.2 t80 -59.64 -42.98 93.98 Favored 'General case' 0 CA--C 1.539 0.555 0 O-C-N 121.712 -0.617 . . . . 0.56999999999999995 110.53 177.003 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -64.1 -54.28 36.48 Favored 'General case' 0 CA--C 1.538 0.505 0 O-C-N 121.278 -0.889 . . . . 0.37 113.054 -175.124 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 1.4 pp20? -61.56 -37.48 83.98 Favored 'General case' 0 C--N 1.332 -0.195 0 O-C-N 120.97 -1.081 . . . . 3.8999999999999999 110.174 175.523 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -58.73 -36.27 74.03 Favored 'General case' 0 N--CA 1.451 -0.409 0 CA-C-N 118.377 0.535 . . . . 0.5 110.938 173.761 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 41.6 t80 -63.68 -51.04 66.84 Favored 'General case' 0 CA--C 1.531 0.221 0 CA-C-N 119.758 1.163 . . . . 3.23 111.359 171.627 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 6.2 ttp180 -45.15 -54.14 7.22 Favored 'General case' 0 N--CA 1.468 0.426 0 C-N-CA 123.244 0.618 . . . . 2.3100000000000001 109.463 177.311 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -67.25 -55.26 14.72 Favored 'General case' 0 C--N 1.329 -0.325 0 C-N-CA 126.615 1.966 . . . . 0.76000000000000001 110.793 -174.24 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -56.82 -31.73 65.03 Favored 'General case' 0 N--CA 1.464 0.268 0 CA-C-N 119.576 1.08 . . . . 2.7799999999999998 111.416 -177.622 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 75' ' ' HIS . . . . . 0.432 ' CE1' HD12 ' A' ' 15' ' ' ILE . 0.0 OUTLIER -90.72 -19.92 23.02 Favored 'General case' 0 N--CA 1.454 -0.233 0 CA-C-O 117.342 -1.313 . . . . 0.90000000000000002 111.748 179.284 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 3.1 m -47.01 115.94 1.22 Allowed 'General case' 0 CA--C 1.507 -0.705 0 CA-C-N 119.953 1.251 . . . . 1.5600000000000001 108.031 -174.815 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -46.12 -39.45 9.49 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 114.793 -1.094 . . . . 1.9099999999999999 110.306 -179.533 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 18.0 t0 -57.3 104.78 0.18 Allowed 'General case' 0 N--CA 1.452 -0.337 0 CA-C-O 122.7 1.238 . . . . 2.04 111.556 168.562 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 1.9 p80 -46.73 -38.25 9.66 Favored 'General case' 0 N--CA 1.45 -0.428 0 CA-C-N 114.664 -1.153 . . . . 5.2599999999999998 112.612 171.539 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -61.2 -58.76 6.98 Favored 'General case' 0 N--CA 1.45 -0.454 0 CA-C-N 119.276 0.944 . . . . 1.1200000000000001 109.245 -176.346 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -48.27 -39.9 23.06 Favored 'General case' 0 N--CA 1.453 -0.275 0 C-N-CA 123.595 0.758 . . . . 3.6800000000000002 112.101 179.125 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 12.8 mtt180 -64.23 -53.93 41.49 Favored 'General case' 0 C--N 1.328 -0.362 0 C-N-CA 120.441 -0.504 . . . . 3.2000000000000002 110.904 178.6 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . 0.413 HD13 ' HA ' ' A' ' 83' ' ' LEU . 1.1 mm? -62.06 -23.26 66.37 Favored 'General case' 0 N--CA 1.449 -0.486 0 CA-C-O 117.883 -1.056 . . . . 0.67000000000000004 111.57 177.654 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 1.7 mptm? -64.57 -42.46 95.62 Favored 'General case' 0 C--O 1.224 -0.281 0 CA-C-N 120.857 1.662 . . . . 1.6399999999999999 108.283 171.867 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 85' ' ' VAL . . . . . 0.44 HG22 HD22 ' A' ' 55' ' ' LEU . 69.6 t -61.99 -63.45 0.81 Allowed 'Isoleucine or valine' 0 C--O 1.218 -0.557 0 CA-C-O 118.13 -0.938 . . . . 0.40000000000000002 110.107 172.928 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -48.96 -47.47 43.89 Favored 'General case' 0 CA--C 1.536 0.412 0 CA-C-N 120.328 1.422 . . . . 1.95 111.704 -173.619 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 32.7 tttm -63.0 -50.53 70.39 Favored 'General case' 0 N--CA 1.452 -0.353 0 C-N-CA 124.449 1.1 . . . . 2.1299999999999999 111.784 179.102 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 25.3 m-20 -86.78 5.16 37.86 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 119.038 -0.506 . . . . 1.0700000000000001 110.997 -175.006 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 89' ' ' ALA . . . . . 0.422 ' HB2' HD21 ' A' ' 55' ' ' LEU . . . -162.28 69.36 2.16 Favored Pre-proline 0 N--CA 1.447 -0.575 0 C-N-CA 125.54 1.536 . . . . 0.37 109.277 -176.112 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 90.3 Cg_endo -79.45 59.86 7.57 Favored 'Trans proline' 0 N--CA 1.458 -0.566 0 C-N-CA 124.214 3.276 . . . . 1.96 110.801 -173.659 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 91' ' ' LYS . . . . . 0.479 ' HE3' ' OE2' ' A' ' 51' ' ' GLU . 0.0 OUTLIER 175.89 -48.4 0.01 OUTLIER 'General case' 0 CA--C 1.531 0.232 0 C-N-CA 127.046 2.139 . . . . 2.3500000000000001 109.713 -172.574 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild full ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 8.6 m -57.74 -43.55 85.46 Favored 'General case' 0 CA--C 1.516 -0.333 0 O-C-N 121.101 -0.999 . . . . 0.46000000000000002 111.445 179.991 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 3.7 t80 -54.28 -48.43 71.24 Favored 'General case' 0 CA--C 1.515 -0.402 0 C-N-CA 120.114 -0.635 . . . . 2.23 110.021 176.251 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 30.0 tt0 -60.82 -29.72 69.65 Favored 'General case' 0 N--CA 1.441 -0.888 0 CA-C-N 115.025 -0.989 . . . . 1.5600000000000001 111.118 -179.799 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -63.41 -61.97 1.99 Allowed 'General case' 0 N--CA 1.463 0.205 0 C-N-CA 124.427 1.091 . . . . 1.6200000000000001 108.919 -177.223 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 3.8 mp -53.35 -45.06 56.17 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.323 0 N-CA-C 108.48 -0.933 . . . . 0.98999999999999999 108.48 177.246 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -57.69 -35.35 70.48 Favored 'General case' 0 C--O 1.225 -0.197 0 N-CA-C 112.352 0.501 . . . . 1.8700000000000001 112.352 -179.655 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -64.67 -42.66 95.22 Favored 'General case' 0 C--N 1.334 -0.1 0 C-N-CA 124.845 1.258 . . . . 2.3500000000000001 109.203 178.636 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 26.5 mm100 -79.76 69.16 6.03 Favored 'General case' 0 CA--C 1.532 0.26 0 C-N-CA 123.532 0.733 . . . . 3.0800000000000001 110.479 179.892 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 68.7 mt -63.41 -70.1 0.18 Allowed 'Isoleucine or valine' 0 CA--C 1.531 0.215 0 C-N-CA 124.269 1.028 . . . . 5.5300000000000002 109.264 178.784 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 4.7 tttm 51.25 -161.15 0.08 Allowed 'General case' 0 CA--C 1.539 0.529 0 C-N-CA 124.019 0.927 . . . . 11.380000000000001 110.911 -172.178 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 102' ' ' PHE . . . . . . . . . . . . . 0.8 OUTLIER -157.36 121.17 4.18 Favored 'General case' 0 N--CA 1.453 -0.316 0 N-CA-C 104.438 -2.43 . . . . 5.9500000000000002 104.438 161.337 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 7.9 tp -151.97 128.3 1.91 Allowed 'Isoleucine or valine' 0 N--CA 1.448 -0.54 0 N-CA-C 108.69 -0.856 . . . . 3.8599999999999999 108.69 173.932 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 104' ' ' ILE . . . . . . . . . . . . . 6.9 mt 65.02 133.61 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.537 0.452 0 C-N-CA 125.761 1.624 . . . . 7.5300000000000002 109.087 -172.347 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 13.2 t-20 -125.64 161.77 26.51 Favored 'General case' 0 C--O 1.234 0.256 0 O-C-N 120.954 -1.091 . . . . 7.3499999999999996 108.197 -178.151 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 20.0 m . . . . . 0 C--O 1.247 0.965 0 CA-C-O 116.207 -1.854 . . . . 9.0800000000000001 109.57 166.99 . . . . . . . . 0 0 . 1 . 030 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.469 0.847 0 N-CA-C 110.159 -1.177 . . . . 10.970000000000001 110.159 . . . . . . . . . 0 0 . 1 . 030 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 73.6 m -85.73 -67.59 0.79 Allowed 'General case' 0 C--O 1.226 -0.162 0 CA-C-N 118.477 1.139 . . . . 12.6 111.602 -179.956 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 9.6 ptpt -158.14 140.06 13.98 Favored 'General case' 0 N--CA 1.455 -0.195 0 N-CA-C 107.889 -1.152 . . . . 16.09 107.889 -176.367 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 157.29 -178.18 33.77 Favored Glycine 0 N--CA 1.451 -0.308 0 N-CA-C 109.258 -1.537 . . . . 12.23 109.258 -179.729 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 35.6 m -91.75 -164.3 0.1 Allowed 'Isoleucine or valine' 0 N--CA 1.442 -0.846 0 N-CA-C 107.146 -1.427 . . . . 13.31 107.146 156.343 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 5.3 pt-20 -83.05 124.59 30.59 Favored 'General case' 0 N--CA 1.443 -0.792 0 CA-C-O 121.71 0.767 . . . . 9.6699999999999999 111.475 176.994 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 3.1 mt -125.79 25.67 6.83 Favored 'General case' 0 N--CA 1.454 -0.264 0 C-N-CA 123.725 0.81 . . . . 8.75 109.545 -175.331 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 22.4 mtp180 65.92 -69.33 0.11 Allowed 'General case' 0 C--O 1.227 -0.09 0 C-N-CA 124.981 1.312 . . . . 6.5700000000000003 110.269 -161.53 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 2.3 m120 -49.78 -38.87 36.05 Favored 'General case' 0 CA--C 1.512 -0.494 0 C-N-CA 123.78 0.832 . . . . 2.7200000000000002 112.53 177.218 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 7.7 t70 -70.39 -35.49 73.51 Favored 'General case' 0 N--CA 1.455 -0.217 0 C-N-CA 117.387 -1.725 . . . . 4.2199999999999998 111.397 -177.14 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 18.5 m -67.79 -56.4 9.36 Favored 'General case' 0 C--O 1.231 0.127 0 C-N-CA 125.031 1.333 . . . . 1.78 111.073 178.009 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 35.8 mt-10 -68.61 -26.0 65.14 Favored 'General case' 0 CA--C 1.532 0.274 0 CA-C-O 121.289 0.566 . . . . 3.8300000000000001 110.331 -178.799 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -61.62 -53.56 42.75 Favored Glycine 0 C--O 1.218 -0.862 0 N-CA-C 109.89 -1.284 . . . . 0.60999999999999999 109.89 163.308 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 11.2 t80 -50.98 -49.56 59.96 Favored 'General case' 0 CA--C 1.519 -0.236 0 O-C-N 120.814 -1.403 . . . . 2.6699999999999999 110.677 -169.996 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 0.6 OUTLIER -69.46 -32.85 54.63 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.328 0 CA-C-O 118.809 -0.615 . . . . 0.44 112.571 178.894 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 9.3 t60 -59.94 -58.51 8.23 Favored 'General case' 0 CA--C 1.53 0.21 0 N-CA-C 107.227 -1.397 . . . . 0.64000000000000001 107.227 175.775 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 1.5 mp0 -51.37 -44.55 62.16 Favored 'General case' 0 C--O 1.226 -0.135 0 C-N-CA 124.154 0.982 . . . . 4.04 110.634 176.697 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 18' ' ' PHE . . . . . 0.453 ' O ' HG23 ' A' ' 22' ' ' VAL . 0.2 OUTLIER -54.2 -52.17 62.09 Favored 'General case' 0 CA--C 1.517 -0.322 0 C-N-CA 123.582 0.753 . . . . 2.6099999999999999 109.505 179.884 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -45.97 -49.05 13.88 Favored Glycine 0 CA--C 1.524 0.646 0 N-CA-C 110.808 -0.917 . . . . 0.47999999999999998 110.808 174.435 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 20' ' ' HIS . . . . . 0.494 ' CE1' ' HB1' ' A' ' 64' ' ' ALA . 2.1 t-160 -59.16 -47.06 86.68 Favored 'General case' 0 N--CA 1.452 -0.346 0 O-C-N 122.015 -0.697 . . . . 1.8300000000000001 111.393 179.209 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -61.03 -32.66 72.27 Favored 'General case' 0 N--CA 1.453 -0.294 0 O-C-N 121.635 -0.666 . . . . 0.81999999999999995 110.47 178.438 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . 0.582 HG22 HG21 ' A' ' 103' ' ' ILE . 40.4 t -67.63 -35.28 72.39 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.267 0 O-C-N 121.235 -0.915 . . . . 0.93000000000000005 110.393 178.271 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 8.0 t0 -59.3 -29.59 67.72 Favored 'General case' 0 N--CA 1.451 -0.391 0 CA-C-O 121.506 0.669 . . . . 1.8999999999999999 110.983 176.611 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 26.8 t0 -73.87 -47.21 39.74 Favored 'General case' 0 N--CA 1.454 -0.254 0 N-CA-C 108.927 -0.768 . . . . 2.4900000000000002 108.927 -176.411 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 33.6 t80 -49.97 -48.76 51.97 Favored 'General case' 0 CA--C 1.521 -0.141 0 CA-C-N 115.855 -0.612 . . . . 3.0499999999999998 109.429 170.788 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 26' ' ' ALA . . . . . 0.48 ' HB1' ' HB ' ' A' ' 38' ' ' VAL . . . -58.98 -37.22 76.31 Favored 'General case' 0 N--CA 1.443 -0.789 0 CA-C-O 118.492 -0.766 . . . . 1.04 112.31 -179.264 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -77.11 -18.84 78.06 Favored Glycine 0 CA--C 1.526 0.766 0 CA-C-N 118.944 0.793 . . . . 1.1100000000000001 112.209 -178.189 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 1.1 t80 -81.95 -49.93 9.73 Favored 'General case' 0 N--CA 1.452 -0.354 0 O-C-N 121.783 -0.834 . . . . 3.0099999999999998 109.474 175.246 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -72.27 -43.9 63.62 Favored 'General case' 0 CA--C 1.514 -0.436 0 C-N-CA 124.503 1.121 . . . . 2.23 112.145 -175.83 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 5.7 mt -109.76 143.94 38.88 Favored 'General case' 0 N--CA 1.441 -0.886 0 N-CA-C 104.319 -2.474 . . . . 2.27 104.319 -176.965 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 30.1 m-20 71.96 -64.49 0.39 Allowed 'General case' 0 CA--C 1.535 0.39 0 C-N-CA 124.283 1.033 . . . . 5.5599999999999996 110.845 -179.015 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 2.6 tmmm? 73.87 62.64 0.08 Allowed 'General case' 0 CA--C 1.518 -0.288 0 C-N-CA 126.702 2.001 . . . . 9.3100000000000005 108.962 175.127 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 57.2 t30 -154.61 157.79 38.73 Favored 'General case' 0 N--CA 1.45 -0.466 0 CA-C-N 116.06 -0.518 . . . . 6.0099999999999998 109.95 175.263 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 4.0 tt0 -81.02 15.45 1.85 Allowed 'General case' 0 CA--C 1.536 0.439 0 N-CA-C 112.796 0.665 . . . . 10.289999999999999 112.796 -172.744 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 64.1 p -143.96 23.88 1.69 Allowed 'General case' 0 C--O 1.23 0.061 0 CA-C-N 119.058 0.845 . . . . 5.1900000000000004 111.703 178.843 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 2.7 m-20 -138.47 125.29 21.04 Favored 'General case' 0 N--CA 1.453 -0.284 0 N-CA-C 105.241 -2.133 . . . . 8.7699999999999996 105.241 -170.194 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 4.7 mp -147.2 167.3 24.55 Favored 'General case' 0 CA--C 1.534 0.356 0 N-CA-C 107.968 -1.123 . . . . 3.7999999999999998 107.968 -167.617 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . 0.48 ' HB ' ' HB1' ' A' ' 26' ' ' ALA . 4.3 p -94.69 42.85 0.09 OUTLIER 'Isoleucine or valine' 0 N--CA 1.467 0.406 0 O-C-N 120.41 -1.431 . . . . 4.3899999999999997 110.496 -172.986 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 1.3 t -116.05 -47.03 2.79 Favored 'General case' 0 N--CA 1.45 -0.446 0 C-N-CA 124.621 1.168 . . . . 4.3799999999999999 108.424 174.338 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 22.6 p-10 -111.11 83.46 1.77 Allowed 'General case' 0 N--CA 1.441 -0.897 0 N-CA-C 107.582 -1.266 . . . . 5.5700000000000003 107.582 -163.283 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 31.0 t -97.55 -174.2 2.85 Favored 'General case' 0 CA--C 1.533 0.323 0 N-CA-C 109.425 -0.583 . . . . 4.7199999999999998 109.425 177.713 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 24.47 95.42 0.0 OUTLIER 'General case' 0 N--CA 1.469 0.524 0 C-N-CA 128.981 2.913 . . . . 7.1900000000000004 113.777 -178.022 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 29.4 tptt 70.09 10.83 7.51 Favored 'General case' 0 N--CA 1.463 0.218 0 C-N-CA 125.199 1.4 . . . . 13.619999999999999 111.479 -173.205 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 74.4 m-85 55.58 28.18 11.52 Favored 'General case' 0 N--CA 1.451 -0.402 0 C-N-CA 125.315 1.446 . . . . 7.0099999999999998 112.049 -177.375 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 45' ' ' ILE . . . . . 0.42 ' CG1' ' HE3' ' A' ' 49' ' ' LYS . 2.1 tt -172.52 108.61 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.537 0.469 0 N-CA-C 108.758 -0.831 . . . . 3.0600000000000001 108.758 -177.38 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 16.2 t70 -159.85 -69.34 0.08 Allowed 'General case' 0 N--CA 1.468 0.456 0 O-C-N 121.088 -1.008 . . . . 2.2000000000000002 109.112 176.072 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 2.8 mm -54.69 -49.46 67.86 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.449 0 C-N-CA 125.338 1.455 . . . . 0.52000000000000002 108.548 178.304 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 38.4 t80 -59.85 -26.35 65.76 Favored 'General case' 0 N--CA 1.453 -0.319 0 O-C-N 120.596 -1.315 . . . . 0.81999999999999995 113.462 177.683 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . 0.628 ' HA ' ' HE2' ' A' ' 49' ' ' LYS . 9.0 mmpt? -70.04 -48.0 59.72 Favored 'General case' 0 CA--C 1.516 -0.339 0 O-C-N 120.095 -1.628 . . . . 1.51 110.859 -179.482 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 4.4 tp10 -87.51 -56.64 3.27 Favored 'General case' 0 CA--C 1.533 0.314 0 N-CA-C 109.039 -0.726 . . . . 2.1099999999999999 109.039 -173.622 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . 0.465 ' OE1' ' HE3' ' A' ' 91' ' ' LYS . 19.0 mp0 -76.81 -31.87 57.25 Favored 'General case' 0 C--O 1.235 0.321 0 O-C-N 121.024 -1.048 . . . . 2.7999999999999998 111.452 -175.952 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . 0.42 ' HA2' ' CD1' ' A' ' 66' ' ' PHE . . . -70.04 38.76 0.42 Allowed Glycine 0 CA--C 1.532 1.124 0 C-N-CA 124.997 1.284 . . . . 0.39000000000000001 114.343 171.595 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 39.2 t -154.21 49.37 0.63 Allowed 'General case' 0 N--CA 1.448 -0.537 0 N-CA-C 107.234 -1.395 . . . . 1.96 107.234 153.692 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -145.34 -49.7 0.24 Allowed 'General case' 0 CA--C 1.516 -0.339 0 N-CA-C 112.644 0.609 . . . . 2.0600000000000001 112.644 -177.306 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . 0.537 HD21 ' HB2' ' A' ' 89' ' ' ALA . 17.5 mt -60.46 -35.54 76.12 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-O 120.891 0.377 . . . . 0.34999999999999998 111.047 -172.962 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER 178.28 169.58 0.78 Allowed 'General case' 0 CA--C 1.53 0.209 0 C-N-CA 125.752 1.621 . . . . 0.45000000000000001 107.487 -179.307 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 26.4 m -59.16 -33.36 70.82 Favored 'General case' 0 N--CA 1.454 -0.233 0 O-C-N 121.673 -0.642 . . . . 1.04 110.633 169.93 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -59.58 -34.19 72.4 Favored 'General case' 0 C--N 1.34 0.189 0 CA-C-N 118.31 0.505 . . . . 1.3500000000000001 109.992 173.114 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -67.95 -9.91 57.67 Favored Glycine 0 C--O 1.22 -0.741 0 CA-C-O 119.074 -0.848 . . . . 0.41999999999999998 111.836 178.184 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 41.3 ttt180 -107.77 -8.92 15.9 Favored 'General case' 0 N--CA 1.454 -0.237 0 CA-C-N 119.082 1.441 . . . . 3.5 112.582 178.084 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 68.7 p -69.45 -126.34 0.0 OUTLIER 'General case' 0 CA--C 1.537 0.461 0 CA-C-N 118.404 0.547 . . . . 1.0800000000000001 111.196 179.456 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 4.2 t-20 -75.13 148.65 39.49 Favored 'General case' 0 N--CA 1.45 -0.43 0 O-C-N 120.081 -1.637 . . . . 1.8300000000000001 107.497 176.156 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 30.7 tt0 -60.61 -31.98 71.12 Favored 'General case' 0 CA--C 1.538 0.5 0 CA-C-O 121.828 0.823 . . . . 3.2599999999999998 110.37 179.425 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 64' ' ' ALA . . . . . 0.494 ' HB1' ' CE1' ' A' ' 20' ' ' HIS . . . -61.36 -34.45 75.32 Favored 'General case' 0 CA--C 1.53 0.192 0 O-C-N 121.172 -0.955 . . . . 0.55000000000000004 113.105 173.542 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 4.6 mt-10 -77.55 -39.27 46.48 Favored 'General case' 0 C--O 1.222 -0.378 0 O-C-N 121.016 -1.053 . . . . 2.0699999999999998 110.137 179.246 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 66' ' ' PHE . . . . . 0.42 ' CD1' ' HA2' ' A' ' 52' ' ' GLY . 43.7 t80 -50.34 -45.66 55.16 Favored 'General case' 0 CA--C 1.532 0.253 0 C-N-CA 124.775 1.23 . . . . 0.40999999999999998 110.959 170.434 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 72.1 t80 -65.86 -43.96 86.85 Favored 'General case' 0 CA--C 1.533 0.309 0 O-C-N 120.994 -1.067 . . . . 0.47999999999999998 111.758 175.311 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -62.96 -53.98 45.63 Favored 'General case' 0 CA--C 1.537 0.449 0 O-C-N 121.381 -0.824 . . . . 0.40999999999999998 112.002 -174.369 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -55.94 -40.97 73.94 Favored 'General case' 0 C--N 1.332 -0.182 0 O-C-N 120.92 -1.112 . . . . 3.8900000000000001 111.299 169.868 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -55.99 -40.17 72.93 Favored 'General case' 0 C--O 1.223 -0.297 0 CA-C-N 119.122 0.874 . . . . 0.40000000000000002 110.844 177.471 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 56.9 t80 -58.06 -49.93 75.19 Favored 'General case' 0 C--O 1.233 0.224 0 CA-C-N 119.683 1.129 . . . . 3.3199999999999998 111.504 174.316 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 48.3 ttt180 -49.56 -53.8 21.66 Favored 'General case' 0 N--CA 1.467 0.377 0 N-CA-C 109.322 -0.621 . . . . 2.0800000000000001 109.322 177.605 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . 0.553 ' CB ' HG21 ' A' ' 85' ' ' VAL . 0.1 OUTLIER -65.38 -34.24 77.84 Favored 'General case' 0 C--N 1.327 -0.392 0 C-N-CA 124.187 0.995 . . . . 0.42999999999999999 110.289 -175.851 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild full ' A' A ' 74' ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER -60.04 -42.37 94.3 Favored 'General case' 0 C--N 1.333 -0.139 0 C-N-CA 123.77 0.828 . . . . 2.3599999999999999 110.939 -176.341 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 9.3 p80 -95.13 -4.99 45.14 Favored 'General case' 0 N--CA 1.457 -0.113 0 CA-C-O 116.964 -1.493 . . . . 0.85999999999999999 113.365 -178.306 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 12.4 m -40.92 126.29 2.48 Favored 'General case' 0 N--CA 1.452 -0.34 0 CA-C-O 123.222 1.487 . . . . 1.04 110.806 -168.349 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 1.1 p -52.82 -42.19 64.89 Favored 'General case' 0 N--CA 1.447 -0.584 0 CA-C-N 112.642 -2.072 . . . . 0.94999999999999996 108.8 179.481 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 62.3 t0 -72.55 111.68 7.94 Favored 'General case' 0 N--CA 1.451 -0.414 0 CA-C-O 122.089 0.947 . . . . 2.0699999999999998 108.673 168.885 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 4.2 t-160 -54.3 -33.05 57.91 Favored 'General case' 0 CA--C 1.532 0.268 0 CA-C-N 115.738 -0.665 . . . . 5.6200000000000001 109.802 176.899 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -56.87 -52.19 66.1 Favored 'General case' 0 N--CA 1.451 -0.4 0 CA-C-N 117.904 0.32 . . . . 0.65000000000000002 110.708 176.672 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 5.2 mt-10 -52.12 -39.57 60.06 Favored 'General case' 0 CA--C 1.514 -0.428 0 C-N-CA 123.365 0.666 . . . . 2.8599999999999999 110.966 -177.59 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 2.4 mtp180 -61.92 -53.54 54.36 Favored 'General case' 0 N--CA 1.448 -0.546 0 C-N-CA 119.971 -0.692 . . . . 2.7000000000000002 109.738 176.864 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 1.3 mm? -61.01 -24.53 66.23 Favored 'General case' 0 N--CA 1.453 -0.294 0 CA-C-O 117.421 -1.276 . . . . 0.53000000000000003 112.936 177.655 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 2.0 mptm? -63.73 -43.11 97.5 Favored 'General case' 0 CA--C 1.522 -0.131 0 CA-C-N 121.499 1.954 . . . . 1.1699999999999999 107.981 173.882 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 85' ' ' VAL . . . . . 0.553 HG21 ' CB ' ' A' ' 73' ' ' LEU . 99.7 t -64.13 -63.3 0.89 Allowed 'Isoleucine or valine' 0 C--O 1.214 -0.808 0 CA-C-O 118.437 -0.792 . . . . 0.45000000000000001 110.009 173.233 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -49.44 -38.57 29.88 Favored 'General case' 0 CA--C 1.532 0.256 0 CA-C-N 120.325 1.42 . . . . 2.0499999999999998 112.277 -172.492 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 22.7 tttt -64.52 -58.98 4.88 Favored 'General case' 0 N--CA 1.45 -0.439 0 C-N-CA 124.81 1.244 . . . . 2.02 110.833 174.025 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 61.6 m-20 -80.48 2.37 25.54 Favored 'General case' 0 CA--C 1.535 0.373 0 C-N-CA 123.505 0.722 . . . . 1.1100000000000001 111.815 -173.733 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 89' ' ' ALA . . . . . 0.537 ' HB2' HD21 ' A' ' 55' ' ' LEU . . . -156.66 73.63 4.74 Favored Pre-proline 0 N--CA 1.446 -0.639 0 C-N-CA 126.802 2.041 . . . . 0.5 108.012 -175.387 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 62.1 Cg_endo -80.69 60.81 8.01 Favored 'Trans proline' 0 N--CA 1.454 -0.824 0 C-N-CA 124.057 3.171 . . . . 1.96 109.351 -179.837 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 91' ' ' LYS . . . . . 0.465 ' HE3' ' OE1' ' A' ' 51' ' ' GLU . 0.0 OUTLIER 171.28 -56.81 0.01 OUTLIER 'General case' 0 C--O 1.224 -0.269 0 C-N-CA 126.411 1.884 . . . . 2.3599999999999999 110.466 -170.345 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild full ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 1.4 m -53.69 -46.01 70.56 Favored 'General case' 0 N--CA 1.466 0.373 0 CA-C-N 119.95 1.25 . . . . 0.42999999999999999 110.75 -179.534 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 8.6 t80 -61.21 -46.34 90.87 Favored 'General case' 0 CA--C 1.509 -0.599 0 CA-C-O 121.653 0.74 . . . . 2.46 110.187 178.852 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 8.1 tt0 -58.53 -30.95 67.48 Favored 'General case' 0 N--CA 1.441 -0.902 0 CA-C-N 114.482 -1.236 . . . . 1.8100000000000001 110.126 -178.538 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -63.99 -68.74 0.32 Allowed 'General case' 0 N--CA 1.452 -0.349 0 C-N-CA 124.634 1.174 . . . . 1.02 108.753 -177.666 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 96' ' ' ILE . . . . . 0.447 HD12 ' H ' ' A' ' 96' ' ' ILE . 3.8 mp -49.86 -43.38 19.59 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.217 0 C-N-CA 123.457 0.703 . . . . 0.85999999999999999 109.743 176.653 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 13.0 t30 -61.03 -35.42 76.83 Favored 'General case' 0 CA--C 1.531 0.241 0 O-C-N 121.961 -0.462 . . . . 1.3700000000000001 111.94 -177.418 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 23.1 t70 -60.41 -44.57 95.6 Favored 'General case' 0 CA--C 1.516 -0.362 0 C-N-CA 123.499 0.719 . . . . 2.1200000000000001 109.624 173.777 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 2.3 mp0 -81.35 77.99 8.17 Favored 'General case' 0 N--CA 1.444 -0.772 0 CA-C-O 121.622 0.725 . . . . 3.8199999999999998 109.153 179.013 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 9.8 tp -47.86 133.72 4.94 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.339 0 C-N-CA 124.746 1.219 . . . . 4.0099999999999998 109.753 179.869 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 1.4 tmtp? -64.08 96.56 0.15 Allowed 'General case' 0 N--CA 1.462 0.142 0 N-CA-C 109.219 -0.66 . . . . 11.390000000000001 109.219 -173.22 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 102' ' ' PHE . . . . . . . . . . . . . 1.0 OUTLIER -103.11 -29.24 11.46 Favored 'General case' 0 CA--C 1.529 0.168 0 C-N-CA 123.934 0.893 . . . . 7.0499999999999998 111.028 -175.414 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 103' ' ' ILE . . . . . 0.582 HG21 HG22 ' A' ' 22' ' ' VAL . 0.0 OUTLIER -64.77 140.54 19.55 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.424 0 C-N-CA 123.512 0.725 . . . . 4.1699999999999999 109.496 -179.34 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild full ' A' A ' 104' ' ' ILE . . . . . 0.514 ' N ' HD13 ' A' ' 103' ' ' ILE . 48.8 mt -103.22 -85.47 0.18 Allowed 'Isoleucine or valine' 0 CA--C 1.534 0.351 0 N-CA-C 107.798 -1.186 . . . . 5.8099999999999996 107.798 -176.384 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 10.2 t30 72.25 101.88 0.07 Allowed 'General case' 0 N--CA 1.464 0.226 0 C-N-CA 127.236 2.215 . . . . 9.8100000000000005 111.57 -177.329 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 15.0 p . . . . . 0 C--O 1.246 0.909 0 N-CA-C 107.139 -1.43 . . . . 9.5600000000000005 107.139 -175.575 . . . . . . . . 0 0 . 1 . 031 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . 0.47 ' CA ' ' OE2' ' A' ' 65' ' ' GLU . . . . . . . . 0 N--CA 1.467 0.735 0 N-CA-C 110.227 -1.149 . . . . 15.109999999999999 110.227 . . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 22.5 m -153.37 -36.51 0.1 Allowed 'General case' 0 C--N 1.332 -0.172 0 CA-C-N 117.281 0.541 . . . . 17.210000000000001 111.742 -177.748 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -137.69 168.09 20.37 Favored 'General case' 0 N--CA 1.45 -0.45 0 N-CA-C 107.373 -1.343 . . . . 18.68 107.373 173.18 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 164.05 -173.37 40.07 Favored Glycine 0 N--CA 1.452 -0.282 0 N-CA-C 109.652 -1.379 . . . . 16.989999999999998 109.652 179.803 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . 0.56 HG23 HD11 ' A' ' 7' ' ' LEU . 3.1 m -79.09 -166.11 0.08 OUTLIER 'Isoleucine or valine' 0 N--CA 1.45 -0.442 0 N-CA-C 108.426 -0.953 . . . . 18.25 108.426 164.893 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 10.6 pt-20 -111.47 101.16 9.61 Favored 'General case' 0 N--CA 1.453 -0.314 0 CA-C-O 122.434 1.112 . . . . 13.67 111.068 -173.624 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . 0.56 HD11 HG23 ' A' ' 5' ' ' VAL . 0.1 OUTLIER -115.01 54.6 0.78 Allowed 'General case' 0 N--CA 1.448 -0.561 0 N-CA-C 106.543 -1.651 . . . . 11.99 106.543 -179.145 . . . . . . . . 3 3 . 1 . 031 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 25.5 mtp85 51.93 56.61 7.54 Favored 'General case' 0 C--O 1.224 -0.244 0 CA-C-N 114.969 -1.014 . . . . 6.2999999999999998 111.391 -175.667 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 2.4 m120 -51.97 -31.25 28.33 Favored 'General case' 0 C--O 1.224 -0.275 0 O-C-N 120.805 -1.184 . . . . 6.0 112.564 177.207 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -66.56 -49.13 67.46 Favored 'General case' 0 N--CA 1.446 -0.673 0 O-C-N 121.289 -0.882 . . . . 3.1899999999999999 112.783 178.446 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 43.9 m -84.34 -52.98 5.78 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-O 122.157 0.979 . . . . 2.1800000000000002 108.888 -172.581 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 1.1 mp0 -89.64 -26.33 20.81 Favored 'General case' 0 C--N 1.325 -0.457 0 C-N-CA 124.255 1.022 . . . . 3.75 109.937 -173.881 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 13' ' ' GLY . . . . . . . . . . . . . . . -78.96 -37.02 26.68 Favored Glycine 0 C--O 1.221 -0.668 0 N-CA-C 109.615 -1.394 . . . . 0.71999999999999997 109.615 178.671 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 49.7 t80 -52.33 -61.04 2.53 Favored 'General case' 0 N--CA 1.463 0.204 0 CA-C-N 119.462 1.631 . . . . 4.1200000000000001 110.685 172.723 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . 0.412 HD12 ' CE1' ' A' ' 75' ' ' HIS . 1.2 pt -63.05 -33.18 59.27 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.449 0 O-C-N 121.151 -0.968 . . . . 0.60999999999999999 112.093 -178.488 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 2.6 t-160 -58.49 -49.27 77.98 Favored 'General case' 0 CA--C 1.532 0.268 0 N-CA-C 107.69 -1.226 . . . . 0.83999999999999997 107.69 174.903 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 40.1 mt-10 -61.01 -36.56 79.82 Favored 'General case' 0 C--O 1.218 -0.554 0 C-N-CA 124.168 0.987 . . . . 2.73 109.752 -178.195 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 4.1 t80 -55.04 -50.23 69.61 Favored 'General case' 0 CA--C 1.522 -0.099 0 CA-C-N 119.354 0.979 . . . . 3.7799999999999998 110.284 171.827 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -48.35 -50.23 23.98 Favored Glycine 0 CA--C 1.524 0.615 0 N-CA-C 111.454 -0.658 . . . . 0.57999999999999996 111.454 172.768 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 20' ' ' HIS . . . . . 0.658 ' CE1' ' HB1' ' A' ' 64' ' ' ALA . 2.0 t-160 -63.89 -44.93 91.51 Favored 'General case' 0 N--CA 1.45 -0.443 0 O-C-N 121.846 -0.796 . . . . 1.97 111.408 -177.533 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -55.86 -34.1 65.14 Favored 'General case' 0 N--CA 1.448 -0.536 0 C-N-CA 123.575 0.75 . . . . 0.95999999999999996 109.125 -178.318 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 98.5 t -68.37 -42.37 84.13 Favored 'Isoleucine or valine' 0 N--CA 1.457 -0.101 0 C-N-CA 119.782 -0.767 . . . . 1.05 111.986 174.474 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 23' ' ' ASP . . . . . 0.464 ' O ' HG12 ' A' ' 38' ' ' VAL . 3.7 t70 -59.0 -29.6 67.36 Favored 'General case' 0 N--CA 1.465 0.312 0 CA-C-O 122.284 1.04 . . . . 2.3399999999999999 111.428 173.262 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -76.26 -47.41 23.91 Favored 'General case' 0 N--CA 1.446 -0.649 0 N-CA-C 107.883 -1.154 . . . . 4.1399999999999997 107.883 -173.626 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 60.2 t80 -63.48 -56.59 14.93 Favored 'General case' 0 N--CA 1.451 -0.382 0 C-N-CA 123.047 0.539 . . . . 2.6299999999999999 110.353 179.839 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 26' ' ' ALA . . . . . 0.72 ' HB3' HG11 ' A' ' 38' ' ' VAL . . . -55.58 -33.89 64.31 Favored 'General case' 0 N--CA 1.453 -0.304 0 CA-C-O 118.928 -0.558 . . . . 0.96999999999999997 110.882 179.645 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -63.51 -56.13 21.38 Favored Glycine 0 C--O 1.225 -0.425 0 N-CA-C 110.503 -1.039 . . . . 1.0900000000000001 110.503 174.515 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -52.04 -42.82 63.41 Favored 'General case' 0 N--CA 1.455 -0.225 0 C-N-CA 124.472 1.109 . . . . 2.5299999999999998 111.252 -174.54 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -79.62 -33.06 41.78 Favored 'General case' 0 N--CA 1.446 -0.645 0 C-N-CA 124.21 1.004 . . . . 1.5600000000000001 112.556 -179.097 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 5.3 mt -122.36 55.14 1.16 Allowed 'General case' 0 CA--C 1.53 0.203 0 CA-C-N 118.873 0.76 . . . . 1.9099999999999999 109.263 -167.114 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 14.2 t70 -139.74 162.28 35.51 Favored 'General case' 0 CA--C 1.531 0.221 0 C-N-CA 124.712 1.205 . . . . 5.7699999999999996 108.307 178.074 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . 0.523 ' O ' ' HE3' ' A' ' 32' ' ' LYS . 0.0 OUTLIER -133.37 45.78 2.66 Favored 'General case' 0 N--CA 1.454 -0.275 0 N-CA-C 107.871 -1.159 . . . . 8.5399999999999991 107.871 176.979 . . . . . . . . 3 3 . 1 . 031 nuclear nobuild full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 3.5 t-20 -146.82 -166.23 2.44 Favored 'General case' 0 CA--C 1.537 0.458 0 C-N-CA 124.961 1.304 . . . . 6.2699999999999996 107.979 -177.854 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 18.8 mm-40 -132.02 22.76 4.53 Favored 'General case' 0 CA--C 1.534 0.33 0 C-N-CA 125.827 1.651 . . . . 10.98 107.913 167.75 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 1.2 t -159.88 51.0 0.32 Allowed 'General case' 0 N--CA 1.453 -0.307 0 O-C-N 121.231 -0.918 . . . . 7.2300000000000004 109.79 -179.361 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 5.6 t0 -153.2 164.39 38.16 Favored 'General case' 0 CA--C 1.531 0.231 0 N-CA-C 108.906 -0.775 . . . . 7.4100000000000001 108.906 172.517 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 7.1 mp -133.45 176.86 8.16 Favored 'General case' 0 CA--C 1.531 0.242 0 C-N-CA 125.122 1.369 . . . . 2.5600000000000001 107.945 179.152 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . 0.72 HG11 ' HB3' ' A' ' 26' ' ' ALA . 6.0 p -64.62 -43.3 96.71 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.262 0 C-N-CA 119.244 -0.982 . . . . 2.3500000000000001 109.319 178.795 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 26.2 p 50.05 -156.95 0.09 Allowed 'General case' 0 CA--C 1.536 0.431 0 CA-C-N 119.405 1.002 . . . . 3.8599999999999999 110.828 -175.118 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 6.8 p-10 -68.22 -21.58 64.84 Favored 'General case' 0 CA--C 1.532 0.253 0 O-C-N 120.409 -1.432 . . . . 5.71 112.77 170.965 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 74.2 p 20.17 64.71 0.02 OUTLIER 'General case' 0 N--CA 1.469 0.49 0 C-N-CA 127.02 2.128 . . . . 3.5800000000000001 114.237 -172.21 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -149.68 130.54 14.23 Favored 'General case' 0 CA--C 1.518 -0.267 0 N-CA-C 107.803 -1.184 . . . . 7.7999999999999998 107.803 -177.331 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 4.1 tttt 27.17 61.84 0.09 Allowed 'General case' 0 N--CA 1.467 0.412 0 C-N-CA 128.141 2.576 . . . . 8.0600000000000005 111.847 177.446 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 0.8 OUTLIER 40.14 72.17 0.16 Allowed 'General case' 0 CA--C 1.533 0.31 0 C-N-CA 125.103 1.361 . . . . 5.9699999999999998 111.922 177.002 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . 0.264 28.0 pt 48.27 94.52 0.01 OUTLIER 'Isoleucine or valine' 0 C--O 1.222 -0.387 0 C-N-CA 126.402 1.881 . . . . 2.5600000000000001 111.781 -173.435 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 45.9 t0 -120.74 -66.0 1.1 Allowed 'General case' 0 C--N 1.334 -0.105 0 C-N-CA 124.258 1.023 . . . . 2.48 108.817 -171.183 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 7.1 mm -50.2 -54.44 8.44 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.523 0 C-N-CA 125.32 1.448 . . . . 0.44 109.202 174.387 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 30.4 t80 -61.83 -26.5 68.16 Favored 'General case' 0 CA--C 1.531 0.245 0 O-C-N 120.927 -1.108 . . . . 0.38 113.232 179.578 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 49' ' ' LYS . . . . . 0.573 ' HA ' ' HE2' ' A' ' 49' ' ' LYS . 9.6 mmpt? -72.24 -45.01 62.01 Favored 'General case' 0 CA--C 1.516 -0.347 0 O-C-N 119.675 -1.891 . . . . 1.21 111.684 -175.513 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -86.72 -64.68 1.11 Allowed 'General case' 0 C--N 1.328 -0.349 0 N-CA-C 106.774 -1.565 . . . . 3.71 106.774 -177.701 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 15.0 mm-40 -65.09 -36.05 83.09 Favored 'General case' 0 N--CA 1.452 -0.367 0 CA-C-N 115.677 -0.692 . . . . 2.1600000000000001 110.165 -170.925 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . 0.452 ' HA2' ' CD1' ' A' ' 66' ' ' PHE . . . -69.07 37.6 0.3 Allowed Glycine 0 CA--C 1.527 0.82 0 C-N-CA 125.582 1.563 . . . . 0.28999999999999998 114.44 171.761 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 11.2 t -147.71 23.4 1.11 Allowed 'General case' 0 N--CA 1.451 -0.401 0 O-C-N 121.047 -1.267 . . . . 1.8200000000000001 110.47 155.592 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 13.7 t30 -134.11 -23.13 1.75 Allowed 'General case' 0 C--N 1.342 0.28 0 N-CA-C 113.958 1.096 . . . . 1.78 113.958 -164.1 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . 0.563 HD22 HG22 ' A' ' 85' ' ' VAL . 14.6 mt -76.91 -37.02 56.21 Favored 'General case' 0 C--O 1.226 -0.144 0 O-C-N 121.891 -0.505 . . . . 0.45000000000000001 110.571 176.124 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER 178.2 169.91 0.76 Allowed 'General case' 0 CA--C 1.532 0.273 0 C-N-CA 125.795 1.638 . . . . 0.60999999999999999 107.096 -175.796 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 7.2 m -60.11 -33.88 72.72 Favored 'General case' 0 N--CA 1.454 -0.266 0 O-C-N 121.708 -0.62 . . . . 1.2 110.721 168.596 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 58' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -67.77 -9.11 41.27 Favored 'General case' 0 N--CA 1.467 0.41 0 N-CA-C 112.328 0.492 . . . . 1.47 112.328 174.498 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . -87.83 -3.91 79.67 Favored Glycine 0 C--O 1.221 -0.683 0 CA-C-O 118.472 -1.182 . . . . 0.44 111.09 173.366 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 3.6 ttp85 -118.0 -7.97 10.8 Favored 'General case' 0 CA--C 1.53 0.183 0 CA-C-N 119.292 1.546 . . . . 3.5299999999999998 112.253 -177.155 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 25.4 p -67.39 -148.13 0.01 OUTLIER 'General case' 0 CA--C 1.537 0.477 0 C-N-CA 124.958 1.303 . . . . 0.89000000000000001 109.079 172.165 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 3.7 m120 -56.7 143.77 35.12 Favored 'General case' 0 N--CA 1.455 -0.176 0 O-C-N 119.753 -1.842 . . . . 2.5299999999999998 109.176 176.049 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 15.6 tm-20 -57.04 -32.86 66.62 Favored 'General case' 0 C--O 1.223 -0.338 0 CA-C-O 121.538 0.685 . . . . 3.5800000000000001 110.078 178.086 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 64' ' ' ALA . . . . . 0.658 ' HB1' ' CE1' ' A' ' 20' ' ' HIS . . . -56.62 -35.37 68.22 Favored 'General case' 0 N--CA 1.45 -0.466 0 O-C-N 121.357 -0.839 . . . . 0.63 112.676 176.332 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . 0.47 ' OE2' ' CA ' ' A' ' 1' ' ' GLY . 8.9 mt-10 -75.62 -42.18 52.38 Favored 'General case' 0 CA--C 1.512 -0.485 0 O-C-N 121.4 -0.812 . . . . 2.0899999999999999 110.834 175.184 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 66' ' ' PHE . . . . . 0.452 ' CD1' ' HA2' ' A' ' 52' ' ' GLY . 37.4 t80 -49.47 -56.49 9.57 Favored 'General case' 0 N--CA 1.454 -0.275 0 C-N-CA 123.782 0.833 . . . . 0.35999999999999999 110.818 175.104 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 90.5 t80 -62.14 -48.37 80.43 Favored 'General case' 0 N--CA 1.451 -0.424 0 C-N-CA 123.19 0.596 . . . . 0.46000000000000002 110.686 179.697 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -59.02 -39.4 81.81 Favored 'General case' 0 CA--C 1.544 0.737 0 O-C-N 121.112 -0.992 . . . . 0.29999999999999999 112.54 -178.113 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 37.4 mm-40 -64.37 -42.21 96.31 Favored 'General case' 0 CA--C 1.518 -0.288 0 C-N-CA 124.563 1.145 . . . . 4.5800000000000001 109.901 172.314 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -53.69 -43.05 68.6 Favored 'General case' 0 N--CA 1.449 -0.477 0 CA-C-O 118.282 -0.866 . . . . 0.41999999999999998 109.694 178.485 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 10.8 t80 -59.15 -49.48 77.7 Favored 'General case' 0 N--CA 1.463 0.211 0 CA-C-N 119.437 1.017 . . . . 2.2000000000000002 111.898 173.13 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -50.27 -55.95 13.26 Favored 'General case' 0 CA--C 1.531 0.223 0 O-C-N 121.588 -0.695 . . . . 2.4700000000000002 110.408 179.301 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . 0.722 HD12 HG23 ' A' ' 85' ' ' VAL . 0.2 OUTLIER -63.66 -30.56 71.65 Favored 'General case' 0 C--N 1.325 -0.495 0 C-N-CA 125.819 1.648 . . . . 0.41999999999999998 110.846 -179.756 . . . . . . . . 3 3 . 1 . 031 nuclear nobuild full ' A' A ' 74' ' ' MET . . . . . 0.452 ' HA ' ' CE2' ' A' ' 93' ' ' PHE . 1.1 tmt? -61.97 -39.92 93.82 Favored 'General case' 0 N--CA 1.451 -0.378 0 C-N-CA 123.281 0.632 . . . . 2.5800000000000001 111.976 -177.364 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 75' ' ' HIS . . . . . 0.412 ' CE1' HD12 ' A' ' 15' ' ' ILE . 27.6 p80 -90.06 -45.97 8.8 Favored 'General case' 0 C--O 1.225 -0.225 0 CA-C-O 116.758 -1.592 . . . . 1.1100000000000001 110.064 179.992 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 14.8 m 5.4 111.1 0.0 OUTLIER 'General case' 0 N--CA 1.469 0.492 0 C-N-CA 129.09 2.956 . . . . 1.0600000000000001 114.719 -174.514 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 3.1 p -46.47 -44.58 17.63 Favored 'General case' 0 C--O 1.235 0.325 0 C-N-CA 125.38 1.472 . . . . 1.0700000000000001 110.837 179.417 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 11.3 t0 -66.17 104.31 1.15 Allowed 'General case' 0 N--CA 1.449 -0.482 0 N-CA-C 108.673 -0.862 . . . . 2.1800000000000002 108.673 167.279 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 41.4 m80 -55.86 -30.96 62.32 Favored 'General case' 0 N--CA 1.454 -0.26 0 CA-C-O 118.994 -0.527 . . . . 5.4199999999999999 111.084 176.747 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -58.13 -50.95 71.69 Favored 'General case' 0 N--CA 1.446 -0.668 0 CA-C-O 117.937 -1.03 . . . . 0.59999999999999998 109.767 176.708 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 1.9 mt-10 -46.89 -41.2 15.47 Favored 'General case' 0 N--CA 1.464 0.236 0 CA-C-N 119.583 1.083 . . . . 3.1000000000000001 111.083 179.128 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 82' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -62.94 -51.66 66.06 Favored 'General case' 0 C--N 1.327 -0.383 0 N-CA-C 109.359 -0.608 . . . . 3.0099999999999998 109.359 179.149 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 1.7 mm? -66.56 -18.97 65.66 Favored 'General case' 0 N--CA 1.453 -0.301 0 CA-C-O 118.11 -0.948 . . . . 0.46999999999999997 113.261 176.922 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 2.0 mptm? -65.56 -48.51 72.14 Favored 'General case' 0 CA--C 1.518 -0.279 0 CA-C-N 120.629 1.559 . . . . 1.26 106.805 169.346 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 85' ' ' VAL . . . . . 0.722 HG23 HD12 ' A' ' 73' ' ' LEU . 45.6 t -63.9 -46.57 93.8 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.663 0 CA-C-O 117.482 -1.247 . . . . 0.45000000000000001 111.809 177.955 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 30.3 mt-30 -60.9 -52.23 65.91 Favored 'General case' 0 N--CA 1.462 0.126 0 CA-C-N 122.114 2.233 . . . . 2.1400000000000001 111.261 179.61 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -65.13 -40.46 94.5 Favored 'General case' 0 CA--C 1.532 0.254 0 O-C-N 121.654 -0.653 . . . . 2.3900000000000001 110.463 -172.717 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 6.9 m-20 -75.32 -21.75 58.18 Favored 'General case' 0 C--O 1.226 -0.172 0 CA-C-O 118.772 -0.632 . . . . 0.90000000000000002 110.771 177.948 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 89' ' ' ALA . . . . . 0.442 ' HB2' HD21 ' A' ' 55' ' ' LEU . . . -143.54 77.29 15.41 Favored Pre-proline 0 C--O 1.237 0.444 0 C-N-CA 124.15 0.98 . . . . 0.33000000000000002 110.217 -173.238 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 90' ' ' PRO . . . . . . . . . . . . . 94.2 Cg_endo -79.75 66.67 8.77 Favored 'Trans proline' 0 N--CA 1.453 -0.856 0 C-N-CA 124.024 3.15 . . . . 1.9399999999999999 109.8 -173.27 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER 168.34 -53.07 0.01 OUTLIER 'General case' 0 C--O 1.224 -0.273 0 C-N-CA 126.923 2.089 . . . . 2.2200000000000002 111.234 -171.718 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 4.3 m -55.38 -47.02 76.47 Favored 'General case' 0 N--CA 1.466 0.338 0 CA-C-N 120.19 1.359 . . . . 0.46000000000000002 110.567 -177.525 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 93' ' ' PHE . . . . . 0.452 ' CE2' ' HA ' ' A' ' 74' ' ' MET . 8.2 t80 -59.92 -48.11 83.03 Favored 'General case' 0 CA--C 1.511 -0.528 0 CA-C-O 121.552 0.691 . . . . 1.8700000000000001 110.163 178.278 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 8.3 tt0 -56.76 -31.31 64.47 Favored 'General case' 0 N--CA 1.441 -0.875 0 CA-C-N 114.602 -1.181 . . . . 1.9099999999999999 110.163 -178.019 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 7.1 t80 -64.86 -56.25 14.54 Favored 'General case' 0 N--CA 1.453 -0.319 0 C-N-CA 124.02 0.928 . . . . 1.1200000000000001 109.798 -176.362 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 2.9 mp -57.93 -44.62 87.04 Favored 'Isoleucine or valine' 0 N--CA 1.457 -0.119 0 N-CA-C 108.44 -0.948 . . . . 0.84999999999999998 108.44 177.321 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 24.3 t30 -60.61 -31.8 70.95 Favored 'General case' 0 CA--C 1.532 0.273 0 C-N-CA 122.285 0.234 . . . . 1.45 111.544 -177.427 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -63.8 -46.29 85.83 Favored 'General case' 0 CA--C 1.521 -0.145 0 C-N-CA 124.552 1.141 . . . . 2.6400000000000001 109.17 176.086 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 80.5 mm-40 -83.09 63.56 7.2 Favored 'General case' 0 N--CA 1.452 -0.342 0 CA-C-O 122.082 0.944 . . . . 3.1000000000000001 110.168 178.309 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 8.5 tp -71.36 83.29 0.29 Allowed 'Isoleucine or valine' 0 CA--C 1.537 0.476 0 C-N-CA 124.302 1.041 . . . . 4.2000000000000002 110.698 -177.324 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 4.3 mtpt -138.76 171.5 14.25 Favored 'General case' 0 C--N 1.334 -0.086 0 O-C-N 121.072 -1.017 . . . . 8.8100000000000005 108.698 170.32 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 102' ' ' PHE . . . . . . . . . . . . . 34.4 p90 -128.87 166.9 18.19 Favored 'General case' 0 N--CA 1.45 -0.434 0 N-CA-C 106.872 -1.529 . . . . 7.5499999999999998 106.872 172.091 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -136.91 111.22 9.65 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.532 0 N-CA-C 106.989 -1.485 . . . . 4.4500000000000002 106.989 176.208 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 104' ' ' ILE . . . . . . . . . . . . . 49.0 mt 61.32 163.35 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.539 0.532 0 C-N-CA 124.595 1.158 . . . . 6.7999999999999998 111.295 -174.257 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 19.4 t-20 -150.15 119.8 7.01 Favored 'General case' 0 N--CA 1.451 -0.419 0 N-CA-C 106.39 -1.707 . . . . 9.1199999999999992 106.39 174.47 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 15.7 p . . . . . 0 C--O 1.254 1.314 0 CA-C-O 114.24 -2.79 . . . . 11.029999999999999 107.574 -170.855 . . . . . . . . 0 0 . 1 stop_ save_